Program PWSCF v.5.1.1 starts on 16Jul2015 at 15:41:33 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 32 processors R & G space division: proc/nbgrp/npool/nimage = 32 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: ./HfIr.save/ file Ir.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5D 5D 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 38 24 7 1336 654 109 Max 39 25 8 1339 674 114 Sum 1245 779 235 42795 21263 3569 bravais-lattice index = 14 lattice parameter (alat) = 5.7761 a.u. unit-cell volume = 474.0964 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 42.00 number of Kohn-Sham states= 50 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 306.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.776136 celldm(2)= 1.521625 celldm(3)= 1.616764 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.521625 0.000000 ) a(3) = ( 0.000000 0.000000 1.616764 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.657192 -0.000000 ) b(3) = ( 0.000000 0.000000 0.618520 ) PseudoPot. # 1 for Hf read from file: /home/autes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 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 1271 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 Ir read from file: /home/autes/Pseudo/Ir.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6b565eb6e2516fc30fbc5a2cc5b4266f Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Hf 12.00 178.49000 Hf( 1.00) Ir 9.00 192.21700 Ir( 1.00) 8 Sym. Ops., with inversion, found ( 4 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 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.7608127 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.7608127 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.7608127 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.7608127 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 C2' -C2' 3 -3 C2'' -C2'' 4 -4 i 5 s_v -s_v 6 -6 s_v'-s_v' 7 -7 s_v''-s_v' 8 -8 -E -1 -i -5 Cartesian axes number of k points= 484 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 2) = ( 0.0096154 -0.0000000 -0.0000000), wk = 0.0020661 k( 3) = ( 0.0192308 -0.0000000 -0.0000000), wk = 0.0020661 k( 4) = ( 0.0288462 -0.0000000 -0.0000000), wk = 0.0020661 k( 5) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0020661 k( 6) = ( 0.0480769 -0.0000000 -0.0000000), wk = 0.0020661 k( 7) = ( 0.0576923 -0.0000000 -0.0000000), wk = 0.0020661 k( 8) = ( 0.0673077 -0.0000000 -0.0000000), wk = 0.0020661 k( 9) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0020661 k( 10) = ( 0.0865385 -0.0000000 -0.0000000), wk = 0.0020661 k( 11) = ( 0.0961538 -0.0000000 -0.0000000), wk = 0.0020661 k( 12) = ( 0.1057692 -0.0000000 -0.0000000), wk = 0.0020661 k( 13) = ( 0.1153846 -0.0000000 -0.0000000), wk = 0.0020661 k( 14) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0020661 k( 15) = ( 0.1346154 -0.0000000 -0.0000000), wk = 0.0020661 k( 16) = ( 0.1442308 -0.0000000 -0.0000000), wk = 0.0020661 k( 17) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0020661 k( 18) = ( 0.1634615 -0.0000000 -0.0000000), wk = 0.0020661 k( 19) = ( 0.1730769 -0.0000000 -0.0000000), wk = 0.0020661 k( 20) = ( 0.1826923 -0.0000000 -0.0000000), wk = 0.0020661 k( 21) = ( 0.1923077 -0.0000000 -0.0000000), wk = 0.0020661 k( 22) = ( 0.2019231 -0.0000000 -0.0000000), wk = 0.0020661 k( 23) = ( 0.2115385 -0.0000000 -0.0000000), wk = 0.0020661 k( 24) = ( 0.2211539 -0.0000000 -0.0000000), wk = 0.0020661 k( 25) = ( 0.2307692 -0.0000000 -0.0000000), wk = 0.0020661 k( 26) = ( 0.2403846 -0.0000000 -0.0000000), wk = 0.0020661 k( 27) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0020661 k( 28) = ( 0.2596154 -0.0000000 -0.0000000), wk = 0.0020661 k( 29) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0020661 k( 30) = ( 0.2788462 -0.0000000 -0.0000000), wk = 0.0020661 k( 31) = ( 0.2884615 -0.0000000 -0.0000000), wk = 0.0020661 k( 32) = ( 0.2980769 -0.0000000 -0.0000000), wk = 0.0020661 k( 33) = ( 0.3076923 -0.0000000 -0.0000000), wk = 0.0020661 k( 34) = ( 0.3173077 -0.0000000 -0.0000000), wk = 0.0020661 k( 35) = ( 0.3269231 -0.0000000 -0.0000000), wk = 0.0020661 k( 36) = ( 0.3365385 -0.0000000 -0.0000000), wk = 0.0020661 k( 37) = ( 0.3461538 -0.0000000 -0.0000000), wk = 0.0020661 k( 38) = ( 0.3557692 -0.0000000 -0.0000000), wk = 0.0020661 k( 39) = ( 0.3653846 -0.0000000 -0.0000000), wk = 0.0020661 k( 40) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0020661 k( 41) = ( 0.3846154 -0.0000000 -0.0000000), wk = 0.0020661 k( 42) = ( 0.3942308 -0.0000000 -0.0000000), wk = 0.0020661 k( 43) = ( 0.4038462 -0.0000000 -0.0000000), wk = 0.0020661 k( 44) = ( 0.4134615 -0.0000000 -0.0000000), wk = 0.0020661 k( 45) = ( 0.4230769 -0.0000000 -0.0000000), wk = 0.0020661 k( 46) = ( 0.4326923 -0.0000000 -0.0000000), wk = 0.0020661 k( 47) = ( 0.4423077 -0.0000000 -0.0000000), wk = 0.0020661 k( 48) = ( 0.4519231 -0.0000000 -0.0000000), wk = 0.0020661 k( 49) = ( 0.4615385 -0.0000000 -0.0000000), wk = 0.0020661 k( 50) = ( 0.4711538 -0.0000000 -0.0000000), wk = 0.0020661 k( 51) = ( 0.4807692 -0.0000000 -0.0000000), wk = 0.0020661 k( 52) = ( 0.4903846 -0.0000000 -0.0000000), wk = 0.0020661 k( 53) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020661 k( 54) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020661 k( 55) = ( 0.5000000 0.0096646 -0.0000000), wk = 0.0020661 k( 56) = ( 0.5000000 0.0193292 -0.0000000), wk = 0.0020661 k( 57) = ( 0.5000000 0.0289938 -0.0000000), wk = 0.0020661 k( 58) = ( 0.5000000 0.0386584 -0.0000000), wk = 0.0020661 k( 59) = ( 0.5000000 0.0483229 -0.0000000), wk = 0.0020661 k( 60) = ( 0.5000000 0.0579875 -0.0000000), wk = 0.0020661 k( 61) = ( 0.5000000 0.0676521 -0.0000000), wk = 0.0020661 k( 62) = ( 0.5000000 0.0773167 -0.0000000), wk = 0.0020661 k( 63) = ( 0.5000000 0.0869813 -0.0000000), wk = 0.0020661 k( 64) = ( 0.5000000 0.0966459 -0.0000000), wk = 0.0020661 k( 65) = ( 0.5000000 0.1063105 -0.0000000), wk = 0.0020661 k( 66) = ( 0.5000000 0.1159751 -0.0000000), wk = 0.0020661 k( 67) = ( 0.5000000 0.1256396 -0.0000000), wk = 0.0020661 k( 68) = ( 0.5000000 0.1353042 -0.0000000), wk = 0.0020661 k( 69) = ( 0.5000000 0.1449688 -0.0000000), wk = 0.0020661 k( 70) = ( 0.5000000 0.1546334 -0.0000000), wk = 0.0020661 k( 71) = ( 0.5000000 0.1642980 -0.0000000), wk = 0.0020661 k( 72) = ( 0.5000000 0.1739626 -0.0000000), wk = 0.0020661 k( 73) = ( 0.5000000 0.1836272 -0.0000000), wk = 0.0020661 k( 74) = ( 0.5000000 0.1932918 -0.0000000), wk = 0.0020661 k( 75) = ( 0.5000000 0.2029564 -0.0000000), wk = 0.0020661 k( 76) = ( 0.5000000 0.2126209 -0.0000000), wk = 0.0020661 k( 77) = ( 0.5000000 0.2222855 -0.0000000), wk = 0.0020661 k( 78) = ( 0.5000000 0.2319501 -0.0000000), wk = 0.0020661 k( 79) = ( 0.5000000 0.2416147 -0.0000000), wk = 0.0020661 k( 80) = ( 0.5000000 0.2512793 -0.0000000), wk = 0.0020661 k( 81) = ( 0.5000000 0.2609439 -0.0000000), wk = 0.0020661 k( 82) = ( 0.5000000 0.2706085 -0.0000000), wk = 0.0020661 k( 83) = ( 0.5000000 0.2802731 -0.0000000), wk = 0.0020661 k( 84) = ( 0.5000000 0.2899376 -0.0000000), wk = 0.0020661 k( 85) = ( 0.5000000 0.2996022 -0.0000000), wk = 0.0020661 k( 86) = ( 0.5000000 0.3092668 -0.0000000), wk = 0.0020661 k( 87) = ( 0.5000000 0.3189314 -0.0000000), wk = 0.0020661 k( 88) = ( 0.5000000 0.3285960 -0.0000000), wk = 0.0020661 k( 89) = ( 0.5000000 0.3285960 -0.0000000), wk = 0.0020661 k( 90) = ( 0.4903846 0.3285960 -0.0000000), wk = 0.0020661 k( 91) = ( 0.4807692 0.3285960 -0.0000000), wk = 0.0020661 k( 92) = ( 0.4711538 0.3285960 -0.0000000), wk = 0.0020661 k( 93) = ( 0.4615385 0.3285960 -0.0000000), wk = 0.0020661 k( 94) = ( 0.4519231 0.3285960 -0.0000000), wk = 0.0020661 k( 95) = ( 0.4423077 0.3285960 -0.0000000), wk = 0.0020661 k( 96) = ( 0.4326923 0.3285960 -0.0000000), wk = 0.0020661 k( 97) = ( 0.4230769 0.3285960 -0.0000000), wk = 0.0020661 k( 98) = ( 0.4134615 0.3285960 -0.0000000), wk = 0.0020661 k( 99) = ( 0.4038462 0.3285960 -0.0000000), wk = 0.0020661 k( 100) = ( 0.3942308 0.3285960 -0.0000000), wk = 0.0020661 k( 101) = ( 0.3846154 0.3285960 -0.0000000), wk = 0.0020661 k( 102) = ( 0.3750000 0.3285960 -0.0000000), wk = 0.0020661 k( 103) = ( 0.3653846 0.3285960 -0.0000000), wk = 0.0020661 k( 104) = ( 0.3557692 0.3285960 -0.0000000), wk = 0.0020661 k( 105) = ( 0.3461538 0.3285960 -0.0000000), wk = 0.0020661 k( 106) = ( 0.3365385 0.3285960 -0.0000000), wk = 0.0020661 k( 107) = ( 0.3269231 0.3285960 -0.0000000), wk = 0.0020661 k( 108) = ( 0.3173077 0.3285960 -0.0000000), wk = 0.0020661 k( 109) = ( 0.3076923 0.3285960 -0.0000000), wk = 0.0020661 k( 110) = ( 0.2980769 0.3285960 -0.0000000), wk = 0.0020661 k( 111) = ( 0.2884615 0.3285960 -0.0000000), wk = 0.0020661 k( 112) = ( 0.2788462 0.3285960 -0.0000000), wk = 0.0020661 k( 113) = ( 0.2692308 0.3285960 -0.0000000), wk = 0.0020661 k( 114) = ( 0.2596154 0.3285960 -0.0000000), wk = 0.0020661 k( 115) = ( 0.2500000 0.3285960 -0.0000000), wk = 0.0020661 k( 116) = ( 0.2403846 0.3285960 -0.0000000), wk = 0.0020661 k( 117) = ( 0.2307692 0.3285960 -0.0000000), wk = 0.0020661 k( 118) = ( 0.2211539 0.3285960 -0.0000000), wk = 0.0020661 k( 119) = ( 0.2115385 0.3285960 -0.0000000), wk = 0.0020661 k( 120) = ( 0.2019231 0.3285960 -0.0000000), wk = 0.0020661 k( 121) = ( 0.1923077 0.3285960 -0.0000000), wk = 0.0020661 k( 122) = ( 0.1826923 0.3285960 -0.0000000), wk = 0.0020661 k( 123) = ( 0.1730769 0.3285960 -0.0000000), wk = 0.0020661 k( 124) = ( 0.1634615 0.3285960 -0.0000000), wk = 0.0020661 k( 125) = ( 0.1538461 0.3285960 -0.0000000), wk = 0.0020661 k( 126) = ( 0.1442308 0.3285960 -0.0000000), wk = 0.0020661 k( 127) = ( 0.1346154 0.3285960 -0.0000000), wk = 0.0020661 k( 128) = ( 0.1250000 0.3285960 -0.0000000), wk = 0.0020661 k( 129) = ( 0.1153846 0.3285960 -0.0000000), wk = 0.0020661 k( 130) = ( 0.1057692 0.3285960 -0.0000000), wk = 0.0020661 k( 131) = ( 0.0961538 0.3285960 -0.0000000), wk = 0.0020661 k( 132) = ( 0.0865385 0.3285960 -0.0000000), wk = 0.0020661 k( 133) = ( 0.0769231 0.3285960 -0.0000000), wk = 0.0020661 k( 134) = ( 0.0673077 0.3285960 -0.0000000), wk = 0.0020661 k( 135) = ( 0.0576923 0.3285960 -0.0000000), wk = 0.0020661 k( 136) = ( 0.0480769 0.3285960 -0.0000000), wk = 0.0020661 k( 137) = ( 0.0384615 0.3285960 -0.0000000), wk = 0.0020661 k( 138) = ( 0.0288462 0.3285960 -0.0000000), wk = 0.0020661 k( 139) = ( 0.0192308 0.3285960 -0.0000000), wk = 0.0020661 k( 140) = ( 0.0096154 0.3285960 -0.0000000), wk = 0.0020661 k( 141) = ( 0.0000000 0.3285960 -0.0000000), wk = 0.0020661 k( 142) = ( 0.0000000 0.3285960 -0.0000000), wk = 0.0020661 k( 143) = ( 0.0000000 0.3189314 -0.0000000), wk = 0.0020661 k( 144) = ( 0.0000000 0.3092668 -0.0000000), wk = 0.0020661 k( 145) = ( 0.0000000 0.2996022 -0.0000000), wk = 0.0020661 k( 146) = ( 0.0000000 0.2899376 -0.0000000), wk = 0.0020661 k( 147) = ( 0.0000000 0.2802731 -0.0000000), wk = 0.0020661 k( 148) = ( 0.0000000 0.2706085 -0.0000000), wk = 0.0020661 k( 149) = ( 0.0000000 0.2609439 -0.0000000), wk = 0.0020661 k( 150) = ( 0.0000000 0.2512793 -0.0000000), wk = 0.0020661 k( 151) = ( 0.0000000 0.2416147 -0.0000000), wk = 0.0020661 k( 152) = ( 0.0000000 0.2319501 -0.0000000), wk = 0.0020661 k( 153) = ( 0.0000000 0.2222855 -0.0000000), wk = 0.0020661 k( 154) = ( 0.0000000 0.2126209 -0.0000000), wk = 0.0020661 k( 155) = ( 0.0000000 0.2029564 -0.0000000), wk = 0.0020661 k( 156) = ( 0.0000000 0.1932918 -0.0000000), wk = 0.0020661 k( 157) = ( 0.0000000 0.1836272 -0.0000000), wk = 0.0020661 k( 158) = ( 0.0000000 0.1739626 -0.0000000), wk = 0.0020661 k( 159) = ( 0.0000000 0.1642980 -0.0000000), wk = 0.0020661 k( 160) = ( 0.0000000 0.1546334 -0.0000000), wk = 0.0020661 k( 161) = ( 0.0000000 0.1449688 -0.0000000), wk = 0.0020661 k( 162) = ( 0.0000000 0.1353042 -0.0000000), wk = 0.0020661 k( 163) = ( 0.0000000 0.1256396 -0.0000000), wk = 0.0020661 k( 164) = ( 0.0000000 0.1159751 -0.0000000), wk = 0.0020661 k( 165) = ( 0.0000000 0.1063105 -0.0000000), wk = 0.0020661 k( 166) = ( 0.0000000 0.0966459 -0.0000000), wk = 0.0020661 k( 167) = ( 0.0000000 0.0869813 -0.0000000), wk = 0.0020661 k( 168) = ( 0.0000000 0.0773167 -0.0000000), wk = 0.0020661 k( 169) = ( 0.0000000 0.0676521 -0.0000000), wk = 0.0020661 k( 170) = ( 0.0000000 0.0579875 -0.0000000), wk = 0.0020661 k( 171) = ( 0.0000000 0.0483229 -0.0000000), wk = 0.0020661 k( 172) = ( 0.0000000 0.0386584 -0.0000000), wk = 0.0020661 k( 173) = ( 0.0000000 0.0289938 -0.0000000), wk = 0.0020661 k( 174) = ( 0.0000000 0.0193292 -0.0000000), wk = 0.0020661 k( 175) = ( 0.0000000 0.0096646 -0.0000000), wk = 0.0020661 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 178) = ( 0.0000000 0.0000000 0.0096644), wk = 0.0020661 k( 179) = ( 0.0000000 0.0000000 0.0193287), wk = 0.0020661 k( 180) = ( 0.0000000 0.0000000 0.0289931), wk = 0.0020661 k( 181) = ( 0.0000000 0.0000000 0.0386575), wk = 0.0020661 k( 182) = ( 0.0000000 0.0000000 0.0483218), wk = 0.0020661 k( 183) = ( 0.0000000 0.0000000 0.0579862), wk = 0.0020661 k( 184) = ( 0.0000000 0.0000000 0.0676506), wk = 0.0020661 k( 185) = ( 0.0000000 0.0000000 0.0773149), wk = 0.0020661 k( 186) = ( 0.0000000 0.0000000 0.0869793), wk = 0.0020661 k( 187) = ( 0.0000000 0.0000000 0.0966437), wk = 0.0020661 k( 188) = ( 0.0000000 0.0000000 0.1063081), wk = 0.0020661 k( 189) = ( 0.0000000 0.0000000 0.1159724), wk = 0.0020661 k( 190) = ( 0.0000000 0.0000000 0.1256368), wk = 0.0020661 k( 191) = ( 0.0000000 0.0000000 0.1353012), wk = 0.0020661 k( 192) = ( 0.0000000 0.0000000 0.1449655), wk = 0.0020661 k( 193) = ( 0.0000000 0.0000000 0.1546299), wk = 0.0020661 k( 194) = ( 0.0000000 0.0000000 0.1642943), wk = 0.0020661 k( 195) = ( 0.0000000 0.0000000 0.1739586), wk = 0.0020661 k( 196) = ( 0.0000000 0.0000000 0.1836230), wk = 0.0020661 k( 197) = ( 0.0000000 0.0000000 0.1932874), wk = 0.0020661 k( 198) = ( 0.0000000 0.0000000 0.2029517), wk = 0.0020661 k( 199) = ( 0.0000000 0.0000000 0.2126161), wk = 0.0020661 k( 200) = ( 0.0000000 0.0000000 0.2222805), wk = 0.0020661 k( 201) = ( 0.0000000 0.0000000 0.2319448), wk = 0.0020661 k( 202) = ( 0.0000000 0.0000000 0.2416092), wk = 0.0020661 k( 203) = ( 0.0000000 0.0000000 0.2512736), wk = 0.0020661 k( 204) = ( 0.0000000 0.0000000 0.2609379), wk = 0.0020661 k( 205) = ( 0.0000000 0.0000000 0.2706023), wk = 0.0020661 k( 206) = ( 0.0000000 0.0000000 0.2802667), wk = 0.0020661 k( 207) = ( 0.0000000 0.0000000 0.2899310), wk = 0.0020661 k( 208) = ( 0.0000000 0.0000000 0.2995954), wk = 0.0020661 k( 209) = ( 0.0000000 0.0000000 0.3092598), wk = 0.0020661 k( 210) = ( 0.0000000 0.0000000 0.3092598), wk = 0.0020661 k( 211) = ( 0.0096154 -0.0000000 0.3092598), wk = 0.0020661 k( 212) = ( 0.0192308 -0.0000000 0.3092598), wk = 0.0020661 k( 213) = ( 0.0288462 -0.0000000 0.3092598), wk = 0.0020661 k( 214) = ( 0.0384615 -0.0000000 0.3092598), wk = 0.0020661 k( 215) = ( 0.0480769 -0.0000000 0.3092598), wk = 0.0020661 k( 216) = ( 0.0576923 -0.0000000 0.3092598), wk = 0.0020661 k( 217) = ( 0.0673077 -0.0000000 0.3092598), wk = 0.0020661 k( 218) = ( 0.0769231 -0.0000000 0.3092598), wk = 0.0020661 k( 219) = ( 0.0865385 -0.0000000 0.3092598), wk = 0.0020661 k( 220) = ( 0.0961538 -0.0000000 0.3092598), wk = 0.0020661 k( 221) = ( 0.1057692 -0.0000000 0.3092598), wk = 0.0020661 k( 222) = ( 0.1153846 -0.0000000 0.3092598), wk = 0.0020661 k( 223) = ( 0.1250000 -0.0000000 0.3092598), wk = 0.0020661 k( 224) = ( 0.1346154 -0.0000000 0.3092598), wk = 0.0020661 k( 225) = ( 0.1442308 -0.0000000 0.3092598), wk = 0.0020661 k( 226) = ( 0.1538461 -0.0000000 0.3092598), wk = 0.0020661 k( 227) = ( 0.1634615 -0.0000000 0.3092598), wk = 0.0020661 k( 228) = ( 0.1730769 -0.0000000 0.3092598), wk = 0.0020661 k( 229) = ( 0.1826923 -0.0000000 0.3092598), wk = 0.0020661 k( 230) = ( 0.1923077 -0.0000000 0.3092598), wk = 0.0020661 k( 231) = ( 0.2019231 -0.0000000 0.3092598), wk = 0.0020661 k( 232) = ( 0.2115385 -0.0000000 0.3092598), wk = 0.0020661 k( 233) = ( 0.2211539 -0.0000000 0.3092598), wk = 0.0020661 k( 234) = ( 0.2307692 -0.0000000 0.3092598), wk = 0.0020661 k( 235) = ( 0.2403846 -0.0000000 0.3092598), wk = 0.0020661 k( 236) = ( 0.2500000 -0.0000000 0.3092598), wk = 0.0020661 k( 237) = ( 0.2596154 -0.0000000 0.3092598), wk = 0.0020661 k( 238) = ( 0.2692308 -0.0000000 0.3092598), wk = 0.0020661 k( 239) = ( 0.2788462 -0.0000000 0.3092598), wk = 0.0020661 k( 240) = ( 0.2884615 -0.0000000 0.3092598), wk = 0.0020661 k( 241) = ( 0.2980769 -0.0000000 0.3092598), wk = 0.0020661 k( 242) = ( 0.3076923 -0.0000000 0.3092598), wk = 0.0020661 k( 243) = ( 0.3173077 -0.0000000 0.3092598), wk = 0.0020661 k( 244) = ( 0.3269231 -0.0000000 0.3092598), wk = 0.0020661 k( 245) = ( 0.3365385 -0.0000000 0.3092598), wk = 0.0020661 k( 246) = ( 0.3461538 -0.0000000 0.3092598), wk = 0.0020661 k( 247) = ( 0.3557692 -0.0000000 0.3092598), wk = 0.0020661 k( 248) = ( 0.3653846 -0.0000000 0.3092598), wk = 0.0020661 k( 249) = ( 0.3750000 -0.0000000 0.3092598), wk = 0.0020661 k( 250) = ( 0.3846154 -0.0000000 0.3092598), wk = 0.0020661 k( 251) = ( 0.3942308 -0.0000000 0.3092598), wk = 0.0020661 k( 252) = ( 0.4038462 -0.0000000 0.3092598), wk = 0.0020661 k( 253) = ( 0.4134615 -0.0000000 0.3092598), wk = 0.0020661 k( 254) = ( 0.4230769 -0.0000000 0.3092598), wk = 0.0020661 k( 255) = ( 0.4326923 -0.0000000 0.3092598), wk = 0.0020661 k( 256) = ( 0.4423077 -0.0000000 0.3092598), wk = 0.0020661 k( 257) = ( 0.4519231 -0.0000000 0.3092598), wk = 0.0020661 k( 258) = ( 0.4615385 -0.0000000 0.3092598), wk = 0.0020661 k( 259) = ( 0.4711538 -0.0000000 0.3092598), wk = 0.0020661 k( 260) = ( 0.4807692 -0.0000000 0.3092598), wk = 0.0020661 k( 261) = ( 0.4903846 -0.0000000 0.3092598), wk = 0.0020661 k( 262) = ( 0.5000000 -0.0000000 0.3092598), wk = 0.0020661 k( 263) = ( 0.5000000 -0.0000000 0.3092598), wk = 0.0020661 k( 264) = ( 0.5000000 0.0096646 0.3092598), wk = 0.0020661 k( 265) = ( 0.5000000 0.0193292 0.3092598), wk = 0.0020661 k( 266) = ( 0.5000000 0.0289938 0.3092598), wk = 0.0020661 k( 267) = ( 0.5000000 0.0386584 0.3092598), wk = 0.0020661 k( 268) = ( 0.5000000 0.0483229 0.3092598), wk = 0.0020661 k( 269) = ( 0.5000000 0.0579875 0.3092598), wk = 0.0020661 k( 270) = ( 0.5000000 0.0676521 0.3092598), wk = 0.0020661 k( 271) = ( 0.5000000 0.0773167 0.3092598), wk = 0.0020661 k( 272) = ( 0.5000000 0.0869813 0.3092598), wk = 0.0020661 k( 273) = ( 0.5000000 0.0966459 0.3092598), wk = 0.0020661 k( 274) = ( 0.5000000 0.1063105 0.3092598), wk = 0.0020661 k( 275) = ( 0.5000000 0.1159751 0.3092598), wk = 0.0020661 k( 276) = ( 0.5000000 0.1256396 0.3092598), wk = 0.0020661 k( 277) = ( 0.5000000 0.1353042 0.3092598), wk = 0.0020661 k( 278) = ( 0.5000000 0.1449688 0.3092598), wk = 0.0020661 k( 279) = ( 0.5000000 0.1546334 0.3092598), wk = 0.0020661 k( 280) = ( 0.5000000 0.1642980 0.3092598), wk = 0.0020661 k( 281) = ( 0.5000000 0.1739626 0.3092598), wk = 0.0020661 k( 282) = ( 0.5000000 0.1836272 0.3092598), wk = 0.0020661 k( 283) = ( 0.5000000 0.1932918 0.3092598), wk = 0.0020661 k( 284) = ( 0.5000000 0.2029564 0.3092598), wk = 0.0020661 k( 285) = ( 0.5000000 0.2126209 0.3092598), wk = 0.0020661 k( 286) = ( 0.5000000 0.2222855 0.3092598), wk = 0.0020661 k( 287) = ( 0.5000000 0.2319501 0.3092598), wk = 0.0020661 k( 288) = ( 0.5000000 0.2416147 0.3092598), wk = 0.0020661 k( 289) = ( 0.5000000 0.2512793 0.3092598), wk = 0.0020661 k( 290) = ( 0.5000000 0.2609439 0.3092598), wk = 0.0020661 k( 291) = ( 0.5000000 0.2706085 0.3092598), wk = 0.0020661 k( 292) = ( 0.5000000 0.2802731 0.3092598), wk = 0.0020661 k( 293) = ( 0.5000000 0.2899376 0.3092598), wk = 0.0020661 k( 294) = ( 0.5000000 0.2996022 0.3092598), wk = 0.0020661 k( 295) = ( 0.5000000 0.3092668 0.3092598), wk = 0.0020661 k( 296) = ( 0.5000000 0.3189314 0.3092598), wk = 0.0020661 k( 297) = ( 0.5000000 0.3285960 0.3092598), wk = 0.0020661 k( 298) = ( 0.5000000 0.3285960 0.3092598), wk = 0.0020661 k( 299) = ( 0.4903846 0.3285960 0.3092598), wk = 0.0020661 k( 300) = ( 0.4807692 0.3285960 0.3092598), wk = 0.0020661 k( 301) = ( 0.4711538 0.3285960 0.3092598), wk = 0.0020661 k( 302) = ( 0.4615385 0.3285960 0.3092598), wk = 0.0020661 k( 303) = ( 0.4519231 0.3285960 0.3092598), wk = 0.0020661 k( 304) = ( 0.4423077 0.3285960 0.3092598), wk = 0.0020661 k( 305) = ( 0.4326923 0.3285960 0.3092598), wk = 0.0020661 k( 306) = ( 0.4230769 0.3285960 0.3092598), wk = 0.0020661 k( 307) = ( 0.4134615 0.3285960 0.3092598), wk = 0.0020661 k( 308) = ( 0.4038462 0.3285960 0.3092598), wk = 0.0020661 k( 309) = ( 0.3942308 0.3285960 0.3092598), wk = 0.0020661 k( 310) = ( 0.3846154 0.3285960 0.3092598), wk = 0.0020661 k( 311) = ( 0.3750000 0.3285960 0.3092598), wk = 0.0020661 k( 312) = ( 0.3653846 0.3285960 0.3092598), wk = 0.0020661 k( 313) = ( 0.3557692 0.3285960 0.3092598), wk = 0.0020661 k( 314) = ( 0.3461538 0.3285960 0.3092598), wk = 0.0020661 k( 315) = ( 0.3365385 0.3285960 0.3092598), wk = 0.0020661 k( 316) = ( 0.3269231 0.3285960 0.3092598), wk = 0.0020661 k( 317) = ( 0.3173077 0.3285960 0.3092598), wk = 0.0020661 k( 318) = ( 0.3076923 0.3285960 0.3092598), wk = 0.0020661 k( 319) = ( 0.2980769 0.3285960 0.3092598), wk = 0.0020661 k( 320) = ( 0.2884615 0.3285960 0.3092598), wk = 0.0020661 k( 321) = ( 0.2788462 0.3285960 0.3092598), wk = 0.0020661 k( 322) = ( 0.2692308 0.3285960 0.3092598), wk = 0.0020661 k( 323) = ( 0.2596154 0.3285960 0.3092598), wk = 0.0020661 k( 324) = ( 0.2500000 0.3285960 0.3092598), wk = 0.0020661 k( 325) = ( 0.2403846 0.3285960 0.3092598), wk = 0.0020661 k( 326) = ( 0.2307692 0.3285960 0.3092598), wk = 0.0020661 k( 327) = ( 0.2211539 0.3285960 0.3092598), wk = 0.0020661 k( 328) = ( 0.2115385 0.3285960 0.3092598), wk = 0.0020661 k( 329) = ( 0.2019231 0.3285960 0.3092598), wk = 0.0020661 k( 330) = ( 0.1923077 0.3285960 0.3092598), wk = 0.0020661 k( 331) = ( 0.1826923 0.3285960 0.3092598), wk = 0.0020661 k( 332) = ( 0.1730769 0.3285960 0.3092598), wk = 0.0020661 k( 333) = ( 0.1634615 0.3285960 0.3092598), wk = 0.0020661 k( 334) = ( 0.1538461 0.3285960 0.3092598), wk = 0.0020661 k( 335) = ( 0.1442308 0.3285960 0.3092598), wk = 0.0020661 k( 336) = ( 0.1346154 0.3285960 0.3092598), wk = 0.0020661 k( 337) = ( 0.1250000 0.3285960 0.3092598), wk = 0.0020661 k( 338) = ( 0.1153846 0.3285960 0.3092598), wk = 0.0020661 k( 339) = ( 0.1057692 0.3285960 0.3092598), wk = 0.0020661 k( 340) = ( 0.0961538 0.3285960 0.3092598), wk = 0.0020661 k( 341) = ( 0.0865385 0.3285960 0.3092598), wk = 0.0020661 k( 342) = ( 0.0769231 0.3285960 0.3092598), wk = 0.0020661 k( 343) = ( 0.0673077 0.3285960 0.3092598), wk = 0.0020661 k( 344) = ( 0.0576923 0.3285960 0.3092598), wk = 0.0020661 k( 345) = ( 0.0480769 0.3285960 0.3092598), wk = 0.0020661 k( 346) = ( 0.0384615 0.3285960 0.3092598), wk = 0.0020661 k( 347) = ( 0.0288462 0.3285960 0.3092598), wk = 0.0020661 k( 348) = ( 0.0192308 0.3285960 0.3092598), wk = 0.0020661 k( 349) = ( 0.0096154 0.3285960 0.3092598), wk = 0.0020661 k( 350) = ( 0.0000000 0.3285960 0.3092598), wk = 0.0020661 k( 351) = ( 0.0000000 0.3285960 0.3092598), wk = 0.0020661 k( 352) = ( 0.0000000 0.3189314 0.3092598), wk = 0.0020661 k( 353) = ( 0.0000000 0.3092668 0.3092598), wk = 0.0020661 k( 354) = ( 0.0000000 0.2996022 0.3092598), wk = 0.0020661 k( 355) = ( 0.0000000 0.2899376 0.3092598), wk = 0.0020661 k( 356) = ( 0.0000000 0.2802731 0.3092598), wk = 0.0020661 k( 357) = ( 0.0000000 0.2706085 0.3092598), wk = 0.0020661 k( 358) = ( 0.0000000 0.2609439 0.3092598), wk = 0.0020661 k( 359) = ( 0.0000000 0.2512793 0.3092598), wk = 0.0020661 k( 360) = ( 0.0000000 0.2416147 0.3092598), wk = 0.0020661 k( 361) = ( 0.0000000 0.2319501 0.3092598), wk = 0.0020661 k( 362) = ( 0.0000000 0.2222855 0.3092598), wk = 0.0020661 k( 363) = ( 0.0000000 0.2126209 0.3092598), wk = 0.0020661 k( 364) = ( 0.0000000 0.2029564 0.3092598), wk = 0.0020661 k( 365) = ( 0.0000000 0.1932918 0.3092598), wk = 0.0020661 k( 366) = ( 0.0000000 0.1836272 0.3092598), wk = 0.0020661 k( 367) = ( 0.0000000 0.1739626 0.3092598), wk = 0.0020661 k( 368) = ( 0.0000000 0.1642980 0.3092598), wk = 0.0020661 k( 369) = ( 0.0000000 0.1546334 0.3092598), wk = 0.0020661 k( 370) = ( 0.0000000 0.1449688 0.3092598), wk = 0.0020661 k( 371) = ( 0.0000000 0.1353042 0.3092598), wk = 0.0020661 k( 372) = ( 0.0000000 0.1256396 0.3092598), wk = 0.0020661 k( 373) = ( 0.0000000 0.1159751 0.3092598), wk = 0.0020661 k( 374) = ( 0.0000000 0.1063105 0.3092598), wk = 0.0020661 k( 375) = ( 0.0000000 0.0966459 0.3092598), wk = 0.0020661 k( 376) = ( 0.0000000 0.0869813 0.3092598), wk = 0.0020661 k( 377) = ( 0.0000000 0.0773167 0.3092598), wk = 0.0020661 k( 378) = ( 0.0000000 0.0676521 0.3092598), wk = 0.0020661 k( 379) = ( 0.0000000 0.0579875 0.3092598), wk = 0.0020661 k( 380) = ( 0.0000000 0.0483229 0.3092598), wk = 0.0020661 k( 381) = ( 0.0000000 0.0386584 0.3092598), wk = 0.0020661 k( 382) = ( 0.0000000 0.0289938 0.3092598), wk = 0.0020661 k( 383) = ( 0.0000000 0.0193292 0.3092598), wk = 0.0020661 k( 384) = ( 0.0000000 0.0096646 0.3092598), wk = 0.0020661 k( 385) = ( 0.0000000 0.0000000 0.3092598), wk = 0.0020661 k( 386) = ( 0.0000000 0.3285960 -0.0000000), wk = 0.0020661 k( 387) = ( 0.0000000 0.3285960 0.0096644), wk = 0.0020661 k( 388) = ( 0.0000000 0.3285960 0.0193287), wk = 0.0020661 k( 389) = ( 0.0000000 0.3285960 0.0289931), wk = 0.0020661 k( 390) = ( 0.0000000 0.3285960 0.0386575), wk = 0.0020661 k( 391) = ( 0.0000000 0.3285960 0.0483218), wk = 0.0020661 k( 392) = ( 0.0000000 0.3285960 0.0579862), wk = 0.0020661 k( 393) = ( 0.0000000 0.3285960 0.0676506), wk = 0.0020661 k( 394) = ( 0.0000000 0.3285960 0.0773149), wk = 0.0020661 k( 395) = ( 0.0000000 0.3285960 0.0869793), wk = 0.0020661 k( 396) = ( 0.0000000 0.3285960 0.0966437), wk = 0.0020661 k( 397) = ( 0.0000000 0.3285960 0.1063081), wk = 0.0020661 k( 398) = ( 0.0000000 0.3285960 0.1159724), wk = 0.0020661 k( 399) = ( 0.0000000 0.3285960 0.1256368), wk = 0.0020661 k( 400) = ( 0.0000000 0.3285960 0.1353012), wk = 0.0020661 k( 401) = ( 0.0000000 0.3285960 0.1449655), wk = 0.0020661 k( 402) = ( 0.0000000 0.3285960 0.1546299), wk = 0.0020661 k( 403) = ( 0.0000000 0.3285960 0.1642943), wk = 0.0020661 k( 404) = ( 0.0000000 0.3285960 0.1739586), wk = 0.0020661 k( 405) = ( 0.0000000 0.3285960 0.1836230), wk = 0.0020661 k( 406) = ( 0.0000000 0.3285960 0.1932874), wk = 0.0020661 k( 407) = ( 0.0000000 0.3285960 0.2029517), wk = 0.0020661 k( 408) = ( 0.0000000 0.3285960 0.2126161), wk = 0.0020661 k( 409) = ( 0.0000000 0.3285960 0.2222805), wk = 0.0020661 k( 410) = ( 0.0000000 0.3285960 0.2319448), wk = 0.0020661 k( 411) = ( 0.0000000 0.3285960 0.2416092), wk = 0.0020661 k( 412) = ( 0.0000000 0.3285960 0.2512736), wk = 0.0020661 k( 413) = ( 0.0000000 0.3285960 0.2609379), wk = 0.0020661 k( 414) = ( 0.0000000 0.3285960 0.2706023), wk = 0.0020661 k( 415) = ( 0.0000000 0.3285960 0.2802667), wk = 0.0020661 k( 416) = ( 0.0000000 0.3285960 0.2899310), wk = 0.0020661 k( 417) = ( 0.0000000 0.3285960 0.2995954), wk = 0.0020661 k( 418) = ( 0.0000000 0.3285960 0.3092598), wk = 0.0020661 k( 419) = ( 0.5000000 -0.0000000 0.3092598), wk = 0.0020661 k( 420) = ( 0.5000000 -0.0000000 0.2995954), wk = 0.0020661 k( 421) = ( 0.5000000 -0.0000000 0.2899310), wk = 0.0020661 k( 422) = ( 0.5000000 -0.0000000 0.2802667), wk = 0.0020661 k( 423) = ( 0.5000000 -0.0000000 0.2706023), wk = 0.0020661 k( 424) = ( 0.5000000 -0.0000000 0.2609379), wk = 0.0020661 k( 425) = ( 0.5000000 -0.0000000 0.2512736), wk = 0.0020661 k( 426) = ( 0.5000000 -0.0000000 0.2416092), wk = 0.0020661 k( 427) = ( 0.5000000 -0.0000000 0.2319448), wk = 0.0020661 k( 428) = ( 0.5000000 -0.0000000 0.2222805), wk = 0.0020661 k( 429) = ( 0.5000000 -0.0000000 0.2126161), wk = 0.0020661 k( 430) = ( 0.5000000 -0.0000000 0.2029517), wk = 0.0020661 k( 431) = ( 0.5000000 -0.0000000 0.1932874), wk = 0.0020661 k( 432) = ( 0.5000000 -0.0000000 0.1836230), wk = 0.0020661 k( 433) = ( 0.5000000 -0.0000000 0.1739586), wk = 0.0020661 k( 434) = ( 0.5000000 -0.0000000 0.1642943), wk = 0.0020661 k( 435) = ( 0.5000000 -0.0000000 0.1546299), wk = 0.0020661 k( 436) = ( 0.5000000 -0.0000000 0.1449655), wk = 0.0020661 k( 437) = ( 0.5000000 -0.0000000 0.1353012), wk = 0.0020661 k( 438) = ( 0.5000000 -0.0000000 0.1256368), wk = 0.0020661 k( 439) = ( 0.5000000 -0.0000000 0.1159724), wk = 0.0020661 k( 440) = ( 0.5000000 -0.0000000 0.1063081), wk = 0.0020661 k( 441) = ( 0.5000000 -0.0000000 0.0966437), wk = 0.0020661 k( 442) = ( 0.5000000 -0.0000000 0.0869793), wk = 0.0020661 k( 443) = ( 0.5000000 -0.0000000 0.0773149), wk = 0.0020661 k( 444) = ( 0.5000000 -0.0000000 0.0676506), wk = 0.0020661 k( 445) = ( 0.5000000 -0.0000000 0.0579862), wk = 0.0020661 k( 446) = ( 0.5000000 -0.0000000 0.0483218), wk = 0.0020661 k( 447) = ( 0.5000000 -0.0000000 0.0386575), wk = 0.0020661 k( 448) = ( 0.5000000 -0.0000000 0.0289931), wk = 0.0020661 k( 449) = ( 0.5000000 -0.0000000 0.0193287), wk = 0.0020661 k( 450) = ( 0.5000000 -0.0000000 0.0096644), wk = 0.0020661 k( 451) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0020661 k( 452) = ( 0.5000000 0.3285960 -0.0000000), wk = 0.0020661 k( 453) = ( 0.5000000 0.3285960 0.0096644), wk = 0.0020661 k( 454) = ( 0.5000000 0.3285960 0.0193287), wk = 0.0020661 k( 455) = ( 0.5000000 0.3285960 0.0289931), wk = 0.0020661 k( 456) = ( 0.5000000 0.3285960 0.0386575), wk = 0.0020661 k( 457) = ( 0.5000000 0.3285960 0.0483218), wk = 0.0020661 k( 458) = ( 0.5000000 0.3285960 0.0579862), wk = 0.0020661 k( 459) = ( 0.5000000 0.3285960 0.0676506), wk = 0.0020661 k( 460) = ( 0.5000000 0.3285960 0.0773149), wk = 0.0020661 k( 461) = ( 0.5000000 0.3285960 0.0869793), wk = 0.0020661 k( 462) = ( 0.5000000 0.3285960 0.0966437), wk = 0.0020661 k( 463) = ( 0.5000000 0.3285960 0.1063081), wk = 0.0020661 k( 464) = ( 0.5000000 0.3285960 0.1159724), wk = 0.0020661 k( 465) = ( 0.5000000 0.3285960 0.1256368), wk = 0.0020661 k( 466) = ( 0.5000000 0.3285960 0.1353012), wk = 0.0020661 k( 467) = ( 0.5000000 0.3285960 0.1449655), wk = 0.0020661 k( 468) = ( 0.5000000 0.3285960 0.1546299), wk = 0.0020661 k( 469) = ( 0.5000000 0.3285960 0.1642943), wk = 0.0020661 k( 470) = ( 0.5000000 0.3285960 0.1739586), wk = 0.0020661 k( 471) = ( 0.5000000 0.3285960 0.1836230), wk = 0.0020661 k( 472) = ( 0.5000000 0.3285960 0.1932874), wk = 0.0020661 k( 473) = ( 0.5000000 0.3285960 0.2029517), wk = 0.0020661 k( 474) = ( 0.5000000 0.3285960 0.2126161), wk = 0.0020661 k( 475) = ( 0.5000000 0.3285960 0.2222805), wk = 0.0020661 k( 476) = ( 0.5000000 0.3285960 0.2319448), wk = 0.0020661 k( 477) = ( 0.5000000 0.3285960 0.2416092), wk = 0.0020661 k( 478) = ( 0.5000000 0.3285960 0.2512736), wk = 0.0020661 k( 479) = ( 0.5000000 0.3285960 0.2609379), wk = 0.0020661 k( 480) = ( 0.5000000 0.3285960 0.2706023), wk = 0.0020661 k( 481) = ( 0.5000000 0.3285960 0.2802667), wk = 0.0020661 k( 482) = ( 0.5000000 0.3285960 0.2899310), wk = 0.0020661 k( 483) = ( 0.5000000 0.3285960 0.2995954), wk = 0.0020661 k( 484) = ( 0.5000000 0.3285960 0.3092598), wk = 0.0020661 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 2) = ( 0.0096154 -0.0000000 -0.0000000), wk = 0.0020661 k( 3) = ( 0.0192308 -0.0000000 -0.0000000), wk = 0.0020661 k( 4) = ( 0.0288462 0.0000000 -0.0000000), wk = 0.0020661 k( 5) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0020661 k( 6) = ( 0.0480769 -0.0000000 -0.0000000), wk = 0.0020661 k( 7) = ( 0.0576923 -0.0000000 -0.0000000), wk = 0.0020661 k( 8) = ( 0.0673077 0.0000000 -0.0000000), wk = 0.0020661 k( 9) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0020661 k( 10) = ( 0.0865385 -0.0000000 0.0000000), wk = 0.0020661 k( 11) = ( 0.0961538 -0.0000000 -0.0000000), wk = 0.0020661 k( 12) = ( 0.1057692 0.0000000 -0.0000000), wk = 0.0020661 k( 13) = ( 0.1153846 -0.0000000 -0.0000000), wk = 0.0020661 k( 14) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0020661 k( 15) = ( 0.1346154 0.0000000 -0.0000000), wk = 0.0020661 k( 16) = ( 0.1442308 -0.0000000 -0.0000000), wk = 0.0020661 k( 17) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0020661 k( 18) = ( 0.1634615 0.0000000 -0.0000000), wk = 0.0020661 k( 19) = ( 0.1730769 -0.0000000 0.0000000), wk = 0.0020661 k( 20) = ( 0.1826923 0.0000000 0.0000000), wk = 0.0020661 k( 21) = ( 0.1923077 0.0000000 -0.0000000), wk = 0.0020661 k( 22) = ( 0.2019231 0.0000000 -0.0000000), wk = 0.0020661 k( 23) = ( 0.2115385 0.0000000 -0.0000000), wk = 0.0020661 k( 24) = ( 0.2211539 0.0000000 -0.0000000), wk = 0.0020661 k( 25) = ( 0.2307692 0.0000000 -0.0000000), wk = 0.0020661 k( 26) = ( 0.2403846 0.0000000 -0.0000000), wk = 0.0020661 k( 27) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0020661 k( 28) = ( 0.2596154 -0.0000000 -0.0000000), wk = 0.0020661 k( 29) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0020661 k( 30) = ( 0.2788462 -0.0000000 -0.0000000), wk = 0.0020661 k( 31) = ( 0.2884615 -0.0000000 -0.0000000), wk = 0.0020661 k( 32) = ( 0.2980769 -0.0000000 -0.0000000), wk = 0.0020661 k( 33) = ( 0.3076923 -0.0000000 -0.0000000), wk = 0.0020661 k( 34) = ( 0.3173077 -0.0000000 -0.0000000), wk = 0.0020661 k( 35) = ( 0.3269231 0.0000000 -0.0000000), wk = 0.0020661 k( 36) = ( 0.3365385 0.0000000 -0.0000000), wk = 0.0020661 k( 37) = ( 0.3461538 0.0000000 -0.0000000), wk = 0.0020661 k( 38) = ( 0.3557692 -0.0000000 0.0000000), wk = 0.0020661 k( 39) = ( 0.3653846 0.0000000 0.0000000), wk = 0.0020661 k( 40) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0020661 k( 41) = ( 0.3846154 0.0000000 -0.0000000), wk = 0.0020661 k( 42) = ( 0.3942308 0.0000000 -0.0000000), wk = 0.0020661 k( 43) = ( 0.4038462 0.0000000 -0.0000000), wk = 0.0020661 k( 44) = ( 0.4134615 -0.0000000 -0.0000000), wk = 0.0020661 k( 45) = ( 0.4230769 0.0000000 -0.0000000), wk = 0.0020661 k( 46) = ( 0.4326923 0.0000000 -0.0000000), wk = 0.0020661 k( 47) = ( 0.4423077 0.0000000 -0.0000000), wk = 0.0020661 k( 48) = ( 0.4519231 0.0000000 -0.0000000), wk = 0.0020661 k( 49) = ( 0.4615385 0.0000000 -0.0000000), wk = 0.0020661 k( 50) = ( 0.4711538 0.0000000 -0.0000000), wk = 0.0020661 k( 51) = ( 0.4807692 -0.0000000 -0.0000000), wk = 0.0020661 k( 52) = ( 0.4903846 -0.0000000 -0.0000000), wk = 0.0020661 k( 53) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0020661 k( 54) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0020661 k( 55) = ( 0.5000000 0.0147059 -0.0000000), wk = 0.0020661 k( 56) = ( 0.5000000 0.0294118 -0.0000000), wk = 0.0020661 k( 57) = ( 0.5000000 0.0441177 -0.0000000), wk = 0.0020661 k( 58) = ( 0.5000000 0.0588235 -0.0000000), wk = 0.0020661 k( 59) = ( 0.5000000 0.0735294 -0.0000000), wk = 0.0020661 k( 60) = ( 0.5000000 0.0882353 -0.0000000), wk = 0.0020661 k( 61) = ( 0.5000000 0.1029412 -0.0000000), wk = 0.0020661 k( 62) = ( 0.5000000 0.1176471 -0.0000000), wk = 0.0020661 k( 63) = ( 0.5000000 0.1323529 -0.0000000), wk = 0.0020661 k( 64) = ( 0.5000000 0.1470588 -0.0000000), wk = 0.0020661 k( 65) = ( 0.5000000 0.1617647 -0.0000000), wk = 0.0020661 k( 66) = ( 0.5000000 0.1764706 -0.0000000), wk = 0.0020661 k( 67) = ( 0.5000000 0.1911765 -0.0000000), wk = 0.0020661 k( 68) = ( 0.5000000 0.2058823 -0.0000000), wk = 0.0020661 k( 69) = ( 0.5000000 0.2205882 -0.0000000), wk = 0.0020661 k( 70) = ( 0.5000000 0.2352941 -0.0000000), wk = 0.0020661 k( 71) = ( 0.5000000 0.2500000 -0.0000000), wk = 0.0020661 k( 72) = ( 0.5000000 0.2647059 -0.0000000), wk = 0.0020661 k( 73) = ( 0.5000000 0.2794118 0.0000000), wk = 0.0020661 k( 74) = ( 0.5000000 0.2941177 -0.0000000), wk = 0.0020661 k( 75) = ( 0.5000000 0.3088235 -0.0000000), wk = 0.0020661 k( 76) = ( 0.5000000 0.3235294 -0.0000000), wk = 0.0020661 k( 77) = ( 0.5000000 0.3382353 0.0000000), wk = 0.0020661 k( 78) = ( 0.5000000 0.3529412 -0.0000000), wk = 0.0020661 k( 79) = ( 0.5000000 0.3676471 0.0000000), wk = 0.0020661 k( 80) = ( 0.5000000 0.3823529 -0.0000000), wk = 0.0020661 k( 81) = ( 0.5000000 0.3970588 -0.0000000), wk = 0.0020661 k( 82) = ( 0.5000000 0.4117647 -0.0000000), wk = 0.0020661 k( 83) = ( 0.5000000 0.4264706 -0.0000000), wk = 0.0020661 k( 84) = ( 0.5000000 0.4411765 0.0000000), wk = 0.0020661 k( 85) = ( 0.5000000 0.4558824 -0.0000000), wk = 0.0020661 k( 86) = ( 0.5000000 0.4705882 -0.0000000), wk = 0.0020661 k( 87) = ( 0.5000000 0.4852941 -0.0000000), wk = 0.0020661 k( 88) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020661 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020661 k( 90) = ( 0.4903846 0.5000000 -0.0000000), wk = 0.0020661 k( 91) = ( 0.4807692 0.5000000 0.0000000), wk = 0.0020661 k( 92) = ( 0.4711538 0.5000000 0.0000000), wk = 0.0020661 k( 93) = ( 0.4615385 0.5000000 0.0000000), wk = 0.0020661 k( 94) = ( 0.4519231 0.5000000 -0.0000000), wk = 0.0020661 k( 95) = ( 0.4423077 0.5000000 -0.0000000), wk = 0.0020661 k( 96) = ( 0.4326923 0.5000000 -0.0000000), wk = 0.0020661 k( 97) = ( 0.4230769 0.5000000 -0.0000000), wk = 0.0020661 k( 98) = ( 0.4134615 0.5000000 0.0000000), wk = 0.0020661 k( 99) = ( 0.4038462 0.5000000 0.0000000), wk = 0.0020661 k( 100) = ( 0.3942308 0.5000000 0.0000000), wk = 0.0020661 k( 101) = ( 0.3846154 0.5000000 0.0000000), wk = 0.0020661 k( 102) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0020661 k( 103) = ( 0.3653846 0.5000000 -0.0000000), wk = 0.0020661 k( 104) = ( 0.3557692 0.5000000 -0.0000000), wk = 0.0020661 k( 105) = ( 0.3461538 0.5000000 -0.0000000), wk = 0.0020661 k( 106) = ( 0.3365385 0.5000000 -0.0000000), wk = 0.0020661 k( 107) = ( 0.3269231 0.5000000 0.0000000), wk = 0.0020661 k( 108) = ( 0.3173077 0.5000000 -0.0000000), wk = 0.0020661 k( 109) = ( 0.3076923 0.5000000 -0.0000000), wk = 0.0020661 k( 110) = ( 0.2980769 0.5000000 -0.0000000), wk = 0.0020661 k( 111) = ( 0.2884615 0.5000000 -0.0000000), wk = 0.0020661 k( 112) = ( 0.2788462 0.5000000 -0.0000000), wk = 0.0020661 k( 113) = ( 0.2692308 0.5000000 0.0000000), wk = 0.0020661 k( 114) = ( 0.2596154 0.5000000 0.0000000), wk = 0.0020661 k( 115) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0020661 k( 116) = ( 0.2403846 0.5000000 -0.0000000), wk = 0.0020661 k( 117) = ( 0.2307692 0.5000000 0.0000000), wk = 0.0020661 k( 118) = ( 0.2211539 0.5000000 -0.0000000), wk = 0.0020661 k( 119) = ( 0.2115385 0.5000000 0.0000000), wk = 0.0020661 k( 120) = ( 0.2019231 0.5000000 0.0000000), wk = 0.0020661 k( 121) = ( 0.1923077 0.5000000 0.0000000), wk = 0.0020661 k( 122) = ( 0.1826923 0.5000000 0.0000000), wk = 0.0020661 k( 123) = ( 0.1730769 0.5000000 0.0000000), wk = 0.0020661 k( 124) = ( 0.1634615 0.5000000 0.0000000), wk = 0.0020661 k( 125) = ( 0.1538461 0.5000000 -0.0000000), wk = 0.0020661 k( 126) = ( 0.1442308 0.5000000 0.0000000), wk = 0.0020661 k( 127) = ( 0.1346154 0.5000000 0.0000000), wk = 0.0020661 k( 128) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0020661 k( 129) = ( 0.1153846 0.5000000 0.0000000), wk = 0.0020661 k( 130) = ( 0.1057692 0.5000000 -0.0000000), wk = 0.0020661 k( 131) = ( 0.0961538 0.5000000 0.0000000), wk = 0.0020661 k( 132) = ( 0.0865385 0.5000000 0.0000000), wk = 0.0020661 k( 133) = ( 0.0769231 0.5000000 0.0000000), wk = 0.0020661 k( 134) = ( 0.0673077 0.5000000 0.0000000), wk = 0.0020661 k( 135) = ( 0.0576923 0.5000000 0.0000000), wk = 0.0020661 k( 136) = ( 0.0480769 0.5000000 0.0000000), wk = 0.0020661 k( 137) = ( 0.0384615 0.5000000 0.0000000), wk = 0.0020661 k( 138) = ( 0.0288462 0.5000000 0.0000000), wk = 0.0020661 k( 139) = ( 0.0192308 0.5000000 0.0000000), wk = 0.0020661 k( 140) = ( 0.0096154 0.5000000 0.0000000), wk = 0.0020661 k( 141) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020661 k( 142) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020661 k( 143) = ( 0.0000000 0.4852941 0.0000000), wk = 0.0020661 k( 144) = ( 0.0000000 0.4705882 0.0000000), wk = 0.0020661 k( 145) = ( 0.0000000 0.4558824 0.0000000), wk = 0.0020661 k( 146) = ( 0.0000000 0.4411765 0.0000000), wk = 0.0020661 k( 147) = ( 0.0000000 0.4264706 0.0000000), wk = 0.0020661 k( 148) = ( 0.0000000 0.4117647 0.0000000), wk = 0.0020661 k( 149) = ( 0.0000000 0.3970588 0.0000000), wk = 0.0020661 k( 150) = ( 0.0000000 0.3823529 0.0000000), wk = 0.0020661 k( 151) = ( 0.0000000 0.3676471 0.0000000), wk = 0.0020661 k( 152) = ( 0.0000000 0.3529412 0.0000000), wk = 0.0020661 k( 153) = ( 0.0000000 0.3382353 0.0000000), wk = 0.0020661 k( 154) = ( 0.0000000 0.3235294 0.0000000), wk = 0.0020661 k( 155) = ( 0.0000000 0.3088235 0.0000000), wk = 0.0020661 k( 156) = ( 0.0000000 0.2941177 0.0000000), wk = 0.0020661 k( 157) = ( 0.0000000 0.2794118 0.0000000), wk = 0.0020661 k( 158) = ( 0.0000000 0.2647059 0.0000000), wk = 0.0020661 k( 159) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0020661 k( 160) = ( 0.0000000 0.2352941 0.0000000), wk = 0.0020661 k( 161) = ( 0.0000000 0.2205882 0.0000000), wk = 0.0020661 k( 162) = ( 0.0000000 0.2058823 0.0000000), wk = 0.0020661 k( 163) = ( 0.0000000 0.1911765 0.0000000), wk = 0.0020661 k( 164) = ( 0.0000000 0.1764706 0.0000000), wk = 0.0020661 k( 165) = ( 0.0000000 0.1617647 0.0000000), wk = 0.0020661 k( 166) = ( 0.0000000 0.1470588 0.0000000), wk = 0.0020661 k( 167) = ( 0.0000000 0.1323529 0.0000000), wk = 0.0020661 k( 168) = ( 0.0000000 0.1176471 0.0000000), wk = 0.0020661 k( 169) = ( 0.0000000 0.1029412 0.0000000), wk = 0.0020661 k( 170) = ( 0.0000000 0.0882353 0.0000000), wk = 0.0020661 k( 171) = ( 0.0000000 0.0735294 0.0000000), wk = 0.0020661 k( 172) = ( 0.0000000 0.0588235 0.0000000), wk = 0.0020661 k( 173) = ( 0.0000000 0.0441177 0.0000000), wk = 0.0020661 k( 174) = ( 0.0000000 0.0294118 0.0000000), wk = 0.0020661 k( 175) = ( 0.0000000 0.0147059 0.0000000), wk = 0.0020661 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0020661 k( 178) = ( 0.0000000 0.0000000 0.0156250), wk = 0.0020661 k( 179) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0020661 k( 180) = ( 0.0000000 0.0000000 0.0468750), wk = 0.0020661 k( 181) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0020661 k( 182) = ( 0.0000000 0.0000000 0.0781250), wk = 0.0020661 k( 183) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0020661 k( 184) = ( 0.0000000 0.0000000 0.1093750), wk = 0.0020661 k( 185) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0020661 k( 186) = ( 0.0000000 0.0000000 0.1406250), wk = 0.0020661 k( 187) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0020661 k( 188) = ( 0.0000000 0.0000000 0.1718750), wk = 0.0020661 k( 189) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0020661 k( 190) = ( 0.0000000 0.0000000 0.2031250), wk = 0.0020661 k( 191) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0020661 k( 192) = ( 0.0000000 0.0000000 0.2343750), wk = 0.0020661 k( 193) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0020661 k( 194) = ( 0.0000000 0.0000000 0.2656250), wk = 0.0020661 k( 195) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0020661 k( 196) = ( 0.0000000 0.0000000 0.2968750), wk = 0.0020661 k( 197) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0020661 k( 198) = ( 0.0000000 0.0000000 0.3281250), wk = 0.0020661 k( 199) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0020661 k( 200) = ( 0.0000000 0.0000000 0.3593750), wk = 0.0020661 k( 201) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0020661 k( 202) = ( 0.0000000 0.0000000 0.3906250), wk = 0.0020661 k( 203) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0020661 k( 204) = ( 0.0000000 0.0000000 0.4218750), wk = 0.0020661 k( 205) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0020661 k( 206) = ( 0.0000000 0.0000000 0.4531250), wk = 0.0020661 k( 207) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0020661 k( 208) = ( 0.0000000 0.0000000 0.4843750), wk = 0.0020661 k( 209) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020661 k( 210) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020661 k( 211) = ( 0.0096154 -0.0000000 0.5000000), wk = 0.0020661 k( 212) = ( 0.0192308 -0.0000000 0.5000000), wk = 0.0020661 k( 213) = ( 0.0288462 0.0000000 0.5000000), wk = 0.0020661 k( 214) = ( 0.0384615 -0.0000000 0.5000000), wk = 0.0020661 k( 215) = ( 0.0480769 -0.0000000 0.5000000), wk = 0.0020661 k( 216) = ( 0.0576923 -0.0000000 0.5000000), wk = 0.0020661 k( 217) = ( 0.0673077 0.0000000 0.5000000), wk = 0.0020661 k( 218) = ( 0.0769231 -0.0000000 0.5000000), wk = 0.0020661 k( 219) = ( 0.0865385 -0.0000000 0.5000000), wk = 0.0020661 k( 220) = ( 0.0961538 -0.0000000 0.5000000), wk = 0.0020661 k( 221) = ( 0.1057692 0.0000000 0.5000000), wk = 0.0020661 k( 222) = ( 0.1153846 -0.0000000 0.5000000), wk = 0.0020661 k( 223) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0020661 k( 224) = ( 0.1346154 0.0000000 0.5000000), wk = 0.0020661 k( 225) = ( 0.1442308 -0.0000000 0.5000000), wk = 0.0020661 k( 226) = ( 0.1538461 -0.0000000 0.5000000), wk = 0.0020661 k( 227) = ( 0.1634615 0.0000000 0.5000000), wk = 0.0020661 k( 228) = ( 0.1730769 -0.0000000 0.5000000), wk = 0.0020661 k( 229) = ( 0.1826923 0.0000000 0.5000000), wk = 0.0020661 k( 230) = ( 0.1923077 0.0000000 0.5000000), wk = 0.0020661 k( 231) = ( 0.2019231 0.0000000 0.5000000), wk = 0.0020661 k( 232) = ( 0.2115385 0.0000000 0.5000000), wk = 0.0020661 k( 233) = ( 0.2211539 0.0000000 0.5000000), wk = 0.0020661 k( 234) = ( 0.2307692 0.0000000 0.5000000), wk = 0.0020661 k( 235) = ( 0.2403846 0.0000000 0.5000000), wk = 0.0020661 k( 236) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0020661 k( 237) = ( 0.2596154 -0.0000000 0.5000000), wk = 0.0020661 k( 238) = ( 0.2692308 -0.0000000 0.5000000), wk = 0.0020661 k( 239) = ( 0.2788462 -0.0000000 0.5000000), wk = 0.0020661 k( 240) = ( 0.2884615 -0.0000000 0.5000000), wk = 0.0020661 k( 241) = ( 0.2980769 -0.0000000 0.5000000), wk = 0.0020661 k( 242) = ( 0.3076923 -0.0000000 0.5000000), wk = 0.0020661 k( 243) = ( 0.3173077 -0.0000000 0.5000000), wk = 0.0020661 k( 244) = ( 0.3269231 0.0000000 0.5000000), wk = 0.0020661 k( 245) = ( 0.3365385 0.0000000 0.5000000), wk = 0.0020661 k( 246) = ( 0.3461538 0.0000000 0.5000000), wk = 0.0020661 k( 247) = ( 0.3557692 -0.0000000 0.5000000), wk = 0.0020661 k( 248) = ( 0.3653846 0.0000000 0.5000000), wk = 0.0020661 k( 249) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0020661 k( 250) = ( 0.3846154 0.0000000 0.5000000), wk = 0.0020661 k( 251) = ( 0.3942308 0.0000000 0.5000000), wk = 0.0020661 k( 252) = ( 0.4038462 0.0000000 0.5000000), wk = 0.0020661 k( 253) = ( 0.4134615 -0.0000000 0.5000000), wk = 0.0020661 k( 254) = ( 0.4230769 0.0000000 0.5000000), wk = 0.0020661 k( 255) = ( 0.4326923 0.0000000 0.5000000), wk = 0.0020661 k( 256) = ( 0.4423077 0.0000000 0.5000000), wk = 0.0020661 k( 257) = ( 0.4519231 0.0000000 0.5000000), wk = 0.0020661 k( 258) = ( 0.4615385 0.0000000 0.5000000), wk = 0.0020661 k( 259) = ( 0.4711538 0.0000000 0.5000000), wk = 0.0020661 k( 260) = ( 0.4807692 -0.0000000 0.5000000), wk = 0.0020661 k( 261) = ( 0.4903846 -0.0000000 0.5000000), wk = 0.0020661 k( 262) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0020661 k( 263) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0020661 k( 264) = ( 0.5000000 0.0147059 0.5000000), wk = 0.0020661 k( 265) = ( 0.5000000 0.0294118 0.5000000), wk = 0.0020661 k( 266) = ( 0.5000000 0.0441177 0.5000000), wk = 0.0020661 k( 267) = ( 0.5000000 0.0588235 0.5000000), wk = 0.0020661 k( 268) = ( 0.5000000 0.0735294 0.5000000), wk = 0.0020661 k( 269) = ( 0.5000000 0.0882353 0.5000000), wk = 0.0020661 k( 270) = ( 0.5000000 0.1029412 0.5000000), wk = 0.0020661 k( 271) = ( 0.5000000 0.1176471 0.5000000), wk = 0.0020661 k( 272) = ( 0.5000000 0.1323529 0.5000000), wk = 0.0020661 k( 273) = ( 0.5000000 0.1470588 0.5000000), wk = 0.0020661 k( 274) = ( 0.5000000 0.1617647 0.5000000), wk = 0.0020661 k( 275) = ( 0.5000000 0.1764706 0.5000000), wk = 0.0020661 k( 276) = ( 0.5000000 0.1911765 0.5000000), wk = 0.0020661 k( 277) = ( 0.5000000 0.2058823 0.5000000), wk = 0.0020661 k( 278) = ( 0.5000000 0.2205882 0.5000000), wk = 0.0020661 k( 279) = ( 0.5000000 0.2352941 0.5000000), wk = 0.0020661 k( 280) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0020661 k( 281) = ( 0.5000000 0.2647059 0.5000000), wk = 0.0020661 k( 282) = ( 0.5000000 0.2794118 0.5000000), wk = 0.0020661 k( 283) = ( 0.5000000 0.2941177 0.5000000), wk = 0.0020661 k( 284) = ( 0.5000000 0.3088235 0.5000000), wk = 0.0020661 k( 285) = ( 0.5000000 0.3235294 0.5000000), wk = 0.0020661 k( 286) = ( 0.5000000 0.3382353 0.5000000), wk = 0.0020661 k( 287) = ( 0.5000000 0.3529412 0.5000000), wk = 0.0020661 k( 288) = ( 0.5000000 0.3676471 0.5000000), wk = 0.0020661 k( 289) = ( 0.5000000 0.3823529 0.5000000), wk = 0.0020661 k( 290) = ( 0.5000000 0.3970588 0.5000000), wk = 0.0020661 k( 291) = ( 0.5000000 0.4117647 0.5000000), wk = 0.0020661 k( 292) = ( 0.5000000 0.4264706 0.5000000), wk = 0.0020661 k( 293) = ( 0.5000000 0.4411765 0.5000000), wk = 0.0020661 k( 294) = ( 0.5000000 0.4558824 0.5000000), wk = 0.0020661 k( 295) = ( 0.5000000 0.4705882 0.5000000), wk = 0.0020661 k( 296) = ( 0.5000000 0.4852941 0.5000000), wk = 0.0020661 k( 297) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020661 k( 298) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020661 k( 299) = ( 0.4903846 0.5000000 0.5000000), wk = 0.0020661 k( 300) = ( 0.4807692 0.5000000 0.5000000), wk = 0.0020661 k( 301) = ( 0.4711538 0.5000000 0.5000000), wk = 0.0020661 k( 302) = ( 0.4615385 0.5000000 0.5000000), wk = 0.0020661 k( 303) = ( 0.4519231 0.5000000 0.5000000), wk = 0.0020661 k( 304) = ( 0.4423077 0.5000000 0.5000000), wk = 0.0020661 k( 305) = ( 0.4326923 0.5000000 0.5000000), wk = 0.0020661 k( 306) = ( 0.4230769 0.5000000 0.5000000), wk = 0.0020661 k( 307) = ( 0.4134615 0.5000000 0.5000000), wk = 0.0020661 k( 308) = ( 0.4038462 0.5000000 0.5000000), wk = 0.0020661 k( 309) = ( 0.3942308 0.5000000 0.5000000), wk = 0.0020661 k( 310) = ( 0.3846154 0.5000000 0.5000000), wk = 0.0020661 k( 311) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0020661 k( 312) = ( 0.3653846 0.5000000 0.5000000), wk = 0.0020661 k( 313) = ( 0.3557692 0.5000000 0.5000000), wk = 0.0020661 k( 314) = ( 0.3461538 0.5000000 0.5000000), wk = 0.0020661 k( 315) = ( 0.3365385 0.5000000 0.5000000), wk = 0.0020661 k( 316) = ( 0.3269231 0.5000000 0.5000000), wk = 0.0020661 k( 317) = ( 0.3173077 0.5000000 0.5000000), wk = 0.0020661 k( 318) = ( 0.3076923 0.5000000 0.5000000), wk = 0.0020661 k( 319) = ( 0.2980769 0.5000000 0.5000000), wk = 0.0020661 k( 320) = ( 0.2884615 0.5000000 0.5000000), wk = 0.0020661 k( 321) = ( 0.2788462 0.5000000 0.5000000), wk = 0.0020661 k( 322) = ( 0.2692308 0.5000000 0.5000000), wk = 0.0020661 k( 323) = ( 0.2596154 0.5000000 0.5000000), wk = 0.0020661 k( 324) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0020661 k( 325) = ( 0.2403846 0.5000000 0.5000000), wk = 0.0020661 k( 326) = ( 0.2307692 0.5000000 0.5000000), wk = 0.0020661 k( 327) = ( 0.2211539 0.5000000 0.5000000), wk = 0.0020661 k( 328) = ( 0.2115385 0.5000000 0.5000000), wk = 0.0020661 k( 329) = ( 0.2019231 0.5000000 0.5000000), wk = 0.0020661 k( 330) = ( 0.1923077 0.5000000 0.5000000), wk = 0.0020661 k( 331) = ( 0.1826923 0.5000000 0.5000000), wk = 0.0020661 k( 332) = ( 0.1730769 0.5000000 0.5000000), wk = 0.0020661 k( 333) = ( 0.1634615 0.5000000 0.5000000), wk = 0.0020661 k( 334) = ( 0.1538461 0.5000000 0.5000000), wk = 0.0020661 k( 335) = ( 0.1442308 0.5000000 0.5000000), wk = 0.0020661 k( 336) = ( 0.1346154 0.5000000 0.5000000), wk = 0.0020661 k( 337) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0020661 k( 338) = ( 0.1153846 0.5000000 0.5000000), wk = 0.0020661 k( 339) = ( 0.1057692 0.5000000 0.5000000), wk = 0.0020661 k( 340) = ( 0.0961538 0.5000000 0.5000000), wk = 0.0020661 k( 341) = ( 0.0865385 0.5000000 0.5000000), wk = 0.0020661 k( 342) = ( 0.0769231 0.5000000 0.5000000), wk = 0.0020661 k( 343) = ( 0.0673077 0.5000000 0.5000000), wk = 0.0020661 k( 344) = ( 0.0576923 0.5000000 0.5000000), wk = 0.0020661 k( 345) = ( 0.0480769 0.5000000 0.5000000), wk = 0.0020661 k( 346) = ( 0.0384615 0.5000000 0.5000000), wk = 0.0020661 k( 347) = ( 0.0288462 0.5000000 0.5000000), wk = 0.0020661 k( 348) = ( 0.0192308 0.5000000 0.5000000), wk = 0.0020661 k( 349) = ( 0.0096154 0.5000000 0.5000000), wk = 0.0020661 k( 350) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020661 k( 351) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020661 k( 352) = ( 0.0000000 0.4852941 0.5000000), wk = 0.0020661 k( 353) = ( 0.0000000 0.4705882 0.5000000), wk = 0.0020661 k( 354) = ( 0.0000000 0.4558824 0.5000000), wk = 0.0020661 k( 355) = ( 0.0000000 0.4411765 0.5000000), wk = 0.0020661 k( 356) = ( 0.0000000 0.4264706 0.5000000), wk = 0.0020661 k( 357) = ( 0.0000000 0.4117647 0.5000000), wk = 0.0020661 k( 358) = ( 0.0000000 0.3970588 0.5000000), wk = 0.0020661 k( 359) = ( 0.0000000 0.3823529 0.5000000), wk = 0.0020661 k( 360) = ( 0.0000000 0.3676471 0.5000000), wk = 0.0020661 k( 361) = ( 0.0000000 0.3529412 0.5000000), wk = 0.0020661 k( 362) = ( 0.0000000 0.3382353 0.5000000), wk = 0.0020661 k( 363) = ( 0.0000000 0.3235294 0.5000000), wk = 0.0020661 k( 364) = ( 0.0000000 0.3088235 0.5000000), wk = 0.0020661 k( 365) = ( 0.0000000 0.2941177 0.5000000), wk = 0.0020661 k( 366) = ( 0.0000000 0.2794118 0.5000000), wk = 0.0020661 k( 367) = ( 0.0000000 0.2647059 0.5000000), wk = 0.0020661 k( 368) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0020661 k( 369) = ( 0.0000000 0.2352941 0.5000000), wk = 0.0020661 k( 370) = ( 0.0000000 0.2205882 0.5000000), wk = 0.0020661 k( 371) = ( 0.0000000 0.2058823 0.5000000), wk = 0.0020661 k( 372) = ( 0.0000000 0.1911765 0.5000000), wk = 0.0020661 k( 373) = ( 0.0000000 0.1764706 0.5000000), wk = 0.0020661 k( 374) = ( 0.0000000 0.1617647 0.5000000), wk = 0.0020661 k( 375) = ( 0.0000000 0.1470588 0.5000000), wk = 0.0020661 k( 376) = ( 0.0000000 0.1323529 0.5000000), wk = 0.0020661 k( 377) = ( 0.0000000 0.1176471 0.5000000), wk = 0.0020661 k( 378) = ( 0.0000000 0.1029412 0.5000000), wk = 0.0020661 k( 379) = ( 0.0000000 0.0882353 0.5000000), wk = 0.0020661 k( 380) = ( 0.0000000 0.0735294 0.5000000), wk = 0.0020661 k( 381) = ( 0.0000000 0.0588235 0.5000000), wk = 0.0020661 k( 382) = ( 0.0000000 0.0441177 0.5000000), wk = 0.0020661 k( 383) = ( 0.0000000 0.0294118 0.5000000), wk = 0.0020661 k( 384) = ( 0.0000000 0.0147059 0.5000000), wk = 0.0020661 k( 385) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0020661 k( 386) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0020661 k( 387) = ( 0.0000000 0.5000000 0.0156250), wk = 0.0020661 k( 388) = ( 0.0000000 0.5000000 0.0312500), wk = 0.0020661 k( 389) = ( 0.0000000 0.5000000 0.0468750), wk = 0.0020661 k( 390) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0020661 k( 391) = ( 0.0000000 0.5000000 0.0781250), wk = 0.0020661 k( 392) = ( 0.0000000 0.5000000 0.0937500), wk = 0.0020661 k( 393) = ( 0.0000000 0.5000000 0.1093750), wk = 0.0020661 k( 394) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0020661 k( 395) = ( 0.0000000 0.5000000 0.1406250), wk = 0.0020661 k( 396) = ( 0.0000000 0.5000000 0.1562500), wk = 0.0020661 k( 397) = ( 0.0000000 0.5000000 0.1718750), wk = 0.0020661 k( 398) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0020661 k( 399) = ( 0.0000000 0.5000000 0.2031250), wk = 0.0020661 k( 400) = ( 0.0000000 0.5000000 0.2187500), wk = 0.0020661 k( 401) = ( 0.0000000 0.5000000 0.2343750), wk = 0.0020661 k( 402) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0020661 k( 403) = ( 0.0000000 0.5000000 0.2656250), wk = 0.0020661 k( 404) = ( 0.0000000 0.5000000 0.2812500), wk = 0.0020661 k( 405) = ( 0.0000000 0.5000000 0.2968750), wk = 0.0020661 k( 406) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0020661 k( 407) = ( 0.0000000 0.5000000 0.3281250), wk = 0.0020661 k( 408) = ( 0.0000000 0.5000000 0.3437500), wk = 0.0020661 k( 409) = ( 0.0000000 0.5000000 0.3593750), wk = 0.0020661 k( 410) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0020661 k( 411) = ( 0.0000000 0.5000000 0.3906250), wk = 0.0020661 k( 412) = ( 0.0000000 0.5000000 0.4062500), wk = 0.0020661 k( 413) = ( 0.0000000 0.5000000 0.4218750), wk = 0.0020661 k( 414) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0020661 k( 415) = ( 0.0000000 0.5000000 0.4531250), wk = 0.0020661 k( 416) = ( 0.0000000 0.5000000 0.4687500), wk = 0.0020661 k( 417) = ( 0.0000000 0.5000000 0.4843750), wk = 0.0020661 k( 418) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0020661 k( 419) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0020661 k( 420) = ( 0.5000000 0.0000000 0.4843750), wk = 0.0020661 k( 421) = ( 0.5000000 0.0000000 0.4687500), wk = 0.0020661 k( 422) = ( 0.5000000 0.0000000 0.4531250), wk = 0.0020661 k( 423) = ( 0.5000000 0.0000000 0.4375000), wk = 0.0020661 k( 424) = ( 0.5000000 0.0000000 0.4218750), wk = 0.0020661 k( 425) = ( 0.5000000 0.0000000 0.4062500), wk = 0.0020661 k( 426) = ( 0.5000000 0.0000000 0.3906250), wk = 0.0020661 k( 427) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0020661 k( 428) = ( 0.5000000 0.0000000 0.3593750), wk = 0.0020661 k( 429) = ( 0.5000000 0.0000000 0.3437500), wk = 0.0020661 k( 430) = ( 0.5000000 0.0000000 0.3281250), wk = 0.0020661 k( 431) = ( 0.5000000 0.0000000 0.3125000), wk = 0.0020661 k( 432) = ( 0.5000000 0.0000000 0.2968750), wk = 0.0020661 k( 433) = ( 0.5000000 0.0000000 0.2812500), wk = 0.0020661 k( 434) = ( 0.5000000 0.0000000 0.2656250), wk = 0.0020661 k( 435) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0020661 k( 436) = ( 0.5000000 0.0000000 0.2343750), wk = 0.0020661 k( 437) = ( 0.5000000 0.0000000 0.2187500), wk = 0.0020661 k( 438) = ( 0.5000000 0.0000000 0.2031250), wk = 0.0020661 k( 439) = ( 0.5000000 0.0000000 0.1875000), wk = 0.0020661 k( 440) = ( 0.5000000 0.0000000 0.1718750), wk = 0.0020661 k( 441) = ( 0.5000000 0.0000000 0.1562500), wk = 0.0020661 k( 442) = ( 0.5000000 0.0000000 0.1406250), wk = 0.0020661 k( 443) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0020661 k( 444) = ( 0.5000000 0.0000000 0.1093750), wk = 0.0020661 k( 445) = ( 0.5000000 0.0000000 0.0937500), wk = 0.0020661 k( 446) = ( 0.5000000 0.0000000 0.0781250), wk = 0.0020661 k( 447) = ( 0.5000000 0.0000000 0.0625000), wk = 0.0020661 k( 448) = ( 0.5000000 0.0000000 0.0468750), wk = 0.0020661 k( 449) = ( 0.5000000 0.0000000 0.0312500), wk = 0.0020661 k( 450) = ( 0.5000000 0.0000000 0.0156250), wk = 0.0020661 k( 451) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0020661 k( 452) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0020661 k( 453) = ( 0.5000000 0.5000000 0.0156250), wk = 0.0020661 k( 454) = ( 0.5000000 0.5000000 0.0312500), wk = 0.0020661 k( 455) = ( 0.5000000 0.5000000 0.0468750), wk = 0.0020661 k( 456) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0020661 k( 457) = ( 0.5000000 0.5000000 0.0781250), wk = 0.0020661 k( 458) = ( 0.5000000 0.5000000 0.0937500), wk = 0.0020661 k( 459) = ( 0.5000000 0.5000000 0.1093750), wk = 0.0020661 k( 460) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0020661 k( 461) = ( 0.5000000 0.5000000 0.1406250), wk = 0.0020661 k( 462) = ( 0.5000000 0.5000000 0.1562500), wk = 0.0020661 k( 463) = ( 0.5000000 0.5000000 0.1718750), wk = 0.0020661 k( 464) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0020661 k( 465) = ( 0.5000000 0.5000000 0.2031250), wk = 0.0020661 k( 466) = ( 0.5000000 0.5000000 0.2187500), wk = 0.0020661 k( 467) = ( 0.5000000 0.5000000 0.2343750), wk = 0.0020661 k( 468) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0020661 k( 469) = ( 0.5000000 0.5000000 0.2656250), wk = 0.0020661 k( 470) = ( 0.5000000 0.5000000 0.2812500), wk = 0.0020661 k( 471) = ( 0.5000000 0.5000000 0.2968750), wk = 0.0020661 k( 472) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0020661 k( 473) = ( 0.5000000 0.5000000 0.3281250), wk = 0.0020661 k( 474) = ( 0.5000000 0.5000000 0.3437500), wk = 0.0020661 k( 475) = ( 0.5000000 0.5000000 0.3593750), wk = 0.0020661 k( 476) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0020661 k( 477) = ( 0.5000000 0.5000000 0.3906250), wk = 0.0020661 k( 478) = ( 0.5000000 0.5000000 0.4062500), wk = 0.0020661 k( 479) = ( 0.5000000 0.5000000 0.4218750), wk = 0.0020661 k( 480) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0020661 k( 481) = ( 0.5000000 0.5000000 0.4531250), wk = 0.0020661 k( 482) = ( 0.5000000 0.5000000 0.4687500), wk = 0.0020661 k( 483) = ( 0.5000000 0.5000000 0.4843750), wk = 0.0020661 k( 484) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0020661 Dense grid: 42795 G-vectors FFT dimensions: ( 36, 50, 54) Smooth grid: 21263 G-vectors FFT dimensions: ( 25, 40, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.13 Mb ( 168, 50) NL pseudopotentials 0.17 Mb ( 84, 136) Each V/rho on FFT grid 0.05 Mb ( 3600) Each G-vector array 0.01 Mb ( 1339) G-vector shells 0.01 Mb ( 674) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.51 Mb ( 168, 200) Each subspace H/S matrix 0.61 Mb ( 200, 200) Each matrix 0.21 Mb ( 136, 2, 50) The potential is recalculated from file : ./HfIr.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.4 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 4.7 secs Computing kpt #: 4 total cpu time spent up to now is 5.4 secs Computing kpt #: 5 total cpu time spent up to now is 6.1 secs Computing kpt #: 6 total cpu time spent up to now is 6.8 secs Computing kpt #: 7 total cpu time spent up to now is 7.5 secs Computing kpt #: 8 total cpu time spent up to now is 8.3 secs Computing kpt #: 9 total cpu time spent up to now is 9.1 secs Computing kpt #: 10 total cpu time spent up to now is 9.8 secs Computing kpt #: 11 total cpu time spent up to now is 10.6 secs Computing kpt #: 12 total cpu time spent up to now is 11.4 secs Computing kpt #: 13 total cpu time spent up to now is 12.1 secs Computing kpt #: 14 total cpu time spent up to now is 12.9 secs Computing kpt #: 15 total cpu time spent up to now is 13.8 secs Computing kpt #: 16 total cpu time spent up to now is 14.6 secs Computing kpt #: 17 total cpu time spent up to now is 15.4 secs Computing kpt #: 18 total cpu time spent up to now is 16.2 secs Computing kpt #: 19 total cpu time spent up to now is 17.0 secs Computing kpt #: 20 total cpu time spent up to now is 17.9 secs Computing kpt #: 21 total cpu time spent up to now is 18.7 secs Computing kpt #: 22 total cpu time spent up to now is 19.7 secs Computing kpt #: 23 total cpu time spent up to now is 20.6 secs Computing kpt #: 24 total cpu time spent up to now is 21.5 secs Computing kpt #: 25 total cpu time spent up to now is 22.3 secs Computing kpt #: 26 total cpu time spent up to now is 23.2 secs Computing kpt #: 27 total cpu time spent up to now is 24.1 secs Computing kpt #: 28 total cpu time spent up to now is 24.9 secs Computing kpt #: 29 total cpu time spent up to now is 25.8 secs Computing kpt #: 30 total cpu time spent up to now is 26.7 secs Computing kpt #: 31 total cpu time spent up to now is 27.6 secs Computing kpt #: 32 total cpu time spent up to now is 28.6 secs Computing kpt #: 33 total cpu time spent up to now is 29.6 secs Computing kpt #: 34 total cpu time spent up to now is 30.5 secs Computing kpt #: 35 total cpu time spent up to now is 31.5 secs Computing kpt #: 36 total cpu time spent up to now is 32.4 secs Computing kpt #: 37 total cpu time spent up to now is 33.4 secs Computing kpt #: 38 total cpu time spent up to now is 34.4 secs Computing kpt #: 39 total cpu time spent up to now is 35.4 secs Computing kpt #: 40 total cpu time spent up to now is 36.3 secs Computing kpt #: 41 total cpu time spent up to now is 37.3 secs Computing kpt #: 42 total cpu time spent up to now is 38.2 secs Computing kpt #: 43 total cpu time spent up to now is 39.1 secs Computing kpt #: 44 total cpu time spent up to now is 40.0 secs Computing kpt #: 45 total cpu time spent up to now is 40.9 secs Computing kpt #: 46 total cpu time spent up to now is 41.8 secs Computing kpt #: 47 total cpu time spent up to now is 42.6 secs Computing kpt #: 48 total cpu time spent up to now is 43.5 secs Computing kpt #: 49 total cpu time spent up to now is 44.4 secs Computing kpt #: 50 total cpu time spent up to now is 45.2 secs Computing kpt #: 51 total cpu time spent up to now is 46.0 secs Computing kpt #: 52 total cpu time spent up to now is 46.8 secs Computing kpt #: 53 total cpu time spent up to now is 47.7 secs Computing kpt #: 54 total cpu time spent up to now is 48.5 secs Computing kpt #: 55 total cpu time spent up to now is 49.3 secs Computing kpt #: 56 total cpu time spent up to now is 50.1 secs Computing kpt #: 57 total cpu time spent up to now is 50.9 secs Computing kpt #: 58 total cpu time spent up to now is 51.8 secs Computing kpt #: 59 total cpu time spent up to now is 52.6 secs Computing kpt #: 60 total cpu time spent up to now is 53.4 secs Computing kpt #: 61 total cpu time spent up to now is 54.2 secs Computing kpt #: 62 total cpu time spent up to now is 55.0 secs Computing kpt #: 63 total cpu time spent up to now is 55.8 secs Computing kpt #: 64 total cpu time spent up to now is 56.6 secs Computing kpt #: 65 total cpu time spent up to now is 57.4 secs Computing kpt #: 66 total cpu time spent up to now is 58.1 secs Computing kpt #: 67 total cpu time spent up to now is 58.9 secs Computing kpt #: 68 total cpu time spent up to now is 59.7 secs Computing kpt #: 69 total cpu time spent up to now is 60.4 secs Computing kpt #: 70 total cpu time spent up to now is 61.2 secs Computing kpt #: 71 total cpu time spent up to now is 61.9 secs Computing kpt #: 72 total cpu time spent up to now is 62.6 secs Computing kpt #: 73 total cpu time spent up to now is 63.3 secs Computing kpt #: 74 total cpu time spent up to now is 64.0 secs Computing kpt #: 75 total cpu time spent up to now is 64.7 secs Computing kpt #: 76 total cpu time spent up to now is 65.4 secs Computing kpt #: 77 total cpu time spent up to now is 66.1 secs Computing kpt #: 78 total cpu time spent up to now is 66.9 secs Computing kpt #: 79 total cpu time spent up to now is 67.6 secs Computing kpt #: 80 total cpu time spent up to now is 68.3 secs Computing kpt #: 81 total cpu time spent up to now is 69.1 secs Computing kpt #: 82 total cpu time spent up to now is 69.8 secs Computing kpt #: 83 total cpu time spent up to now is 70.6 secs Computing kpt #: 84 total cpu time spent up to now is 71.4 secs Computing kpt #: 85 total cpu time spent up to now is 72.2 secs Computing kpt #: 86 total cpu time spent up to now is 73.0 secs Computing kpt #: 87 total cpu time spent up to now is 74.0 secs Computing kpt #: 88 total cpu time spent up to now is 74.7 secs Computing kpt #: 89 total cpu time spent up to now is 75.5 secs Computing kpt #: 90 total cpu time spent up to now is 76.9 secs Computing kpt #: 91 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 78.6 secs Computing kpt #: 92 total cpu time spent up to now is 80.0 secs Computing kpt #: 93 total cpu time spent up to now is 81.0 secs Computing kpt #: 94 total cpu time spent up to now is 82.0 secs Computing kpt #: 95 total cpu time spent up to now is 83.2 secs Computing kpt #: 96 total cpu time spent up to now is 84.3 secs Computing kpt #: 97 total cpu time spent up to now is 85.3 secs Computing kpt #: 98 total cpu time spent up to now is 86.3 secs Computing kpt #: 99 total cpu time spent up to now is 87.4 secs Computing kpt #: 100 total cpu time spent up to now is 88.4 secs Computing kpt #: 101 total cpu time spent up to now is 89.4 secs Computing kpt #: 102 total cpu time spent up to now is 90.4 secs Computing kpt #: 103 total cpu time spent up to now is 91.5 secs Computing kpt #: 104 total cpu time spent up to now is 92.5 secs Computing kpt #: 105 total cpu time spent up to now is 93.5 secs Computing kpt #: 106 total cpu time spent up to now is 94.6 secs Computing kpt #: 107 total cpu time spent up to now is 95.6 secs Computing kpt #: 108 total cpu time spent up to now is 96.6 secs Computing kpt #: 109 total cpu time spent up to now is 97.6 secs Computing kpt #: 110 total cpu time spent up to now is 98.6 secs Computing kpt #: 111 total cpu time spent up to now is 99.6 secs Computing kpt #: 112 total cpu time spent up to now is 100.7 secs Computing kpt #: 113 total cpu time spent up to now is 101.7 secs Computing kpt #: 114 total cpu time spent up to now is 102.7 secs Computing kpt #: 115 total cpu time spent up to now is 103.8 secs Computing kpt #: 116 total cpu time spent up to now is 104.9 secs Computing kpt #: 117 total cpu time spent up to now is 106.0 secs Computing kpt #: 118 total cpu time spent up to now is 107.1 secs Computing kpt #: 119 total cpu time spent up to now is 108.5 secs Computing kpt #: 120 total cpu time spent up to now is 109.7 secs Computing kpt #: 121 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 111.4 secs Computing kpt #: 122 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 113.1 secs Computing kpt #: 123 total cpu time spent up to now is 114.2 secs Computing kpt #: 124 total cpu time spent up to now is 115.2 secs Computing kpt #: 125 total cpu time spent up to now is 116.4 secs Computing kpt #: 126 total cpu time spent up to now is 117.5 secs Computing kpt #: 127 total cpu time spent up to now is 119.0 secs Computing kpt #: 128 total cpu time spent up to now is 120.4 secs Computing kpt #: 129 total cpu time spent up to now is 121.6 secs Computing kpt #: 130 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 123.3 secs Computing kpt #: 131 total cpu time spent up to now is 124.8 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 126.5 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 128.2 secs Computing kpt #: 134 total cpu time spent up to now is 129.7 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 131.4 secs Computing kpt #: 136 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 133.0 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 134.7 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 136.4 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 138.1 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 139.8 secs Computing kpt #: 141 total cpu time spent up to now is 140.6 secs Computing kpt #: 142 total cpu time spent up to now is 141.3 secs Computing kpt #: 143 total cpu time spent up to now is 142.9 secs Computing kpt #: 144 total cpu time spent up to now is 144.3 secs Computing kpt #: 145 total cpu time spent up to now is 145.5 secs Computing kpt #: 146 total cpu time spent up to now is 146.5 secs Computing kpt #: 147 total cpu time spent up to now is 147.5 secs Computing kpt #: 148 total cpu time spent up to now is 148.5 secs Computing kpt #: 149 total cpu time spent up to now is 149.5 secs Computing kpt #: 150 total cpu time spent up to now is 150.5 secs Computing kpt #: 151 total cpu time spent up to now is 151.6 secs Computing kpt #: 152 total cpu time spent up to now is 152.6 secs Computing kpt #: 153 total cpu time spent up to now is 153.7 secs Computing kpt #: 154 total cpu time spent up to now is 154.8 secs Computing kpt #: 155 total cpu time spent up to now is 155.8 secs Computing kpt #: 156 total cpu time spent up to now is 156.9 secs Computing kpt #: 157 total cpu time spent up to now is 157.9 secs Computing kpt #: 158 total cpu time spent up to now is 158.8 secs Computing kpt #: 159 total cpu time spent up to now is 159.7 secs Computing kpt #: 160 total cpu time spent up to now is 160.6 secs Computing kpt #: 161 total cpu time spent up to now is 161.4 secs Computing kpt #: 162 total cpu time spent up to now is 162.3 secs Computing kpt #: 163 total cpu time spent up to now is 163.1 secs Computing kpt #: 164 total cpu time spent up to now is 163.8 secs Computing kpt #: 165 total cpu time spent up to now is 164.6 secs Computing kpt #: 166 total cpu time spent up to now is 165.4 secs Computing kpt #: 167 total cpu time spent up to now is 166.1 secs Computing kpt #: 168 total cpu time spent up to now is 166.8 secs Computing kpt #: 169 total cpu time spent up to now is 167.5 secs Computing kpt #: 170 total cpu time spent up to now is 168.1 secs Computing kpt #: 171 total cpu time spent up to now is 168.8 secs Computing kpt #: 172 total cpu time spent up to now is 169.5 secs Computing kpt #: 173 total cpu time spent up to now is 170.2 secs Computing kpt #: 174 total cpu time spent up to now is 170.9 secs Computing kpt #: 175 total cpu time spent up to now is 171.6 secs Computing kpt #: 176 total cpu time spent up to now is 172.3 secs Computing kpt #: 177 total cpu time spent up to now is 172.9 secs Computing kpt #: 178 total cpu time spent up to now is 173.6 secs Computing kpt #: 179 total cpu time spent up to now is 174.3 secs Computing kpt #: 180 total cpu time spent up to now is 175.0 secs Computing kpt #: 181 total cpu time spent up to now is 175.7 secs Computing kpt #: 182 total cpu time spent up to now is 176.4 secs Computing kpt #: 183 total cpu time spent up to now is 177.0 secs Computing kpt #: 184 total cpu time spent up to now is 177.8 secs Computing kpt #: 185 total cpu time spent up to now is 178.5 secs Computing kpt #: 186 total cpu time spent up to now is 179.3 secs Computing kpt #: 187 total cpu time spent up to now is 180.0 secs Computing kpt #: 188 total cpu time spent up to now is 180.8 secs Computing kpt #: 189 total cpu time spent up to now is 181.6 secs Computing kpt #: 190 total cpu time spent up to now is 182.4 secs Computing kpt #: 191 total cpu time spent up to now is 183.2 secs Computing kpt #: 192 total cpu time spent up to now is 184.0 secs Computing kpt #: 193 total cpu time spent up to now is 184.8 secs Computing kpt #: 194 total cpu time spent up to now is 185.7 secs Computing kpt #: 195 total cpu time spent up to now is 186.8 secs Computing kpt #: 196 total cpu time spent up to now is 187.9 secs Computing kpt #: 197 total cpu time spent up to now is 189.4 secs Computing kpt #: 198 total cpu time spent up to now is 190.7 secs Computing kpt #: 199 total cpu time spent up to now is 191.7 secs Computing kpt #: 200 total cpu time spent up to now is 192.8 secs Computing kpt #: 201 total cpu time spent up to now is 193.8 secs Computing kpt #: 202 total cpu time spent up to now is 194.7 secs Computing kpt #: 203 total cpu time spent up to now is 195.6 secs Computing kpt #: 204 total cpu time spent up to now is 196.4 secs Computing kpt #: 205 total cpu time spent up to now is 197.3 secs Computing kpt #: 206 total cpu time spent up to now is 198.2 secs Computing kpt #: 207 total cpu time spent up to now is 199.1 secs Computing kpt #: 208 total cpu time spent up to now is 200.0 secs Computing kpt #: 209 total cpu time spent up to now is 200.9 secs Computing kpt #: 210 total cpu time spent up to now is 201.7 secs Computing kpt #: 211 total cpu time spent up to now is 202.7 secs Computing kpt #: 212 total cpu time spent up to now is 203.6 secs Computing kpt #: 213 total cpu time spent up to now is 204.5 secs Computing kpt #: 214 total cpu time spent up to now is 205.4 secs Computing kpt #: 215 total cpu time spent up to now is 206.3 secs Computing kpt #: 216 total cpu time spent up to now is 207.1 secs Computing kpt #: 217 total cpu time spent up to now is 208.1 secs Computing kpt #: 218 total cpu time spent up to now is 209.0 secs Computing kpt #: 219 total cpu time spent up to now is 209.9 secs Computing kpt #: 220 total cpu time spent up to now is 210.8 secs Computing kpt #: 221 total cpu time spent up to now is 211.8 secs Computing kpt #: 222 total cpu time spent up to now is 212.9 secs Computing kpt #: 223 total cpu time spent up to now is 213.9 secs Computing kpt #: 224 total cpu time spent up to now is 214.9 secs Computing kpt #: 225 total cpu time spent up to now is 216.0 secs Computing kpt #: 226 total cpu time spent up to now is 217.1 secs Computing kpt #: 227 total cpu time spent up to now is 218.1 secs Computing kpt #: 228 total cpu time spent up to now is 219.1 secs Computing kpt #: 229 total cpu time spent up to now is 220.1 secs Computing kpt #: 230 total cpu time spent up to now is 221.0 secs Computing kpt #: 231 total cpu time spent up to now is 221.9 secs Computing kpt #: 232 total cpu time spent up to now is 222.9 secs Computing kpt #: 233 total cpu time spent up to now is 223.8 secs Computing kpt #: 234 total cpu time spent up to now is 224.8 secs Computing kpt #: 235 total cpu time spent up to now is 225.9 secs Computing kpt #: 236 total cpu time spent up to now is 227.1 secs Computing kpt #: 237 total cpu time spent up to now is 228.3 secs Computing kpt #: 238 total cpu time spent up to now is 229.3 secs Computing kpt #: 239 total cpu time spent up to now is 230.3 secs Computing kpt #: 240 total cpu time spent up to now is 231.1 secs Computing kpt #: 241 total cpu time spent up to now is 232.0 secs Computing kpt #: 242 total cpu time spent up to now is 232.8 secs Computing kpt #: 243 total cpu time spent up to now is 233.6 secs Computing kpt #: 244 total cpu time spent up to now is 234.5 secs Computing kpt #: 245 total cpu time spent up to now is 235.3 secs Computing kpt #: 246 total cpu time spent up to now is 236.1 secs Computing kpt #: 247 total cpu time spent up to now is 236.9 secs Computing kpt #: 248 total cpu time spent up to now is 237.6 secs Computing kpt #: 249 total cpu time spent up to now is 238.4 secs Computing kpt #: 250 total cpu time spent up to now is 239.2 secs Computing kpt #: 251 total cpu time spent up to now is 239.9 secs Computing kpt #: 252 total cpu time spent up to now is 240.7 secs Computing kpt #: 253 total cpu time spent up to now is 241.5 secs Computing kpt #: 254 total cpu time spent up to now is 242.2 secs Computing kpt #: 255 total cpu time spent up to now is 243.0 secs Computing kpt #: 256 total cpu time spent up to now is 243.8 secs Computing kpt #: 257 total cpu time spent up to now is 244.5 secs Computing kpt #: 258 total cpu time spent up to now is 245.3 secs Computing kpt #: 259 total cpu time spent up to now is 246.1 secs Computing kpt #: 260 total cpu time spent up to now is 246.9 secs Computing kpt #: 261 total cpu time spent up to now is 247.6 secs Computing kpt #: 262 total cpu time spent up to now is 248.4 secs Computing kpt #: 263 total cpu time spent up to now is 249.2 secs Computing kpt #: 264 total cpu time spent up to now is 249.9 secs Computing kpt #: 265 total cpu time spent up to now is 250.7 secs Computing kpt #: 266 total cpu time spent up to now is 251.5 secs Computing kpt #: 267 total cpu time spent up to now is 252.2 secs Computing kpt #: 268 total cpu time spent up to now is 253.0 secs Computing kpt #: 269 total cpu time spent up to now is 253.8 secs Computing kpt #: 270 total cpu time spent up to now is 254.6 secs Computing kpt #: 271 total cpu time spent up to now is 255.3 secs Computing kpt #: 272 total cpu time spent up to now is 256.1 secs Computing kpt #: 273 total cpu time spent up to now is 256.9 secs Computing kpt #: 274 total cpu time spent up to now is 257.7 secs Computing kpt #: 275 total cpu time spent up to now is 258.5 secs Computing kpt #: 276 total cpu time spent up to now is 259.3 secs Computing kpt #: 277 total cpu time spent up to now is 260.1 secs Computing kpt #: 278 total cpu time spent up to now is 260.9 secs Computing kpt #: 279 total cpu time spent up to now is 261.7 secs Computing kpt #: 280 total cpu time spent up to now is 262.5 secs Computing kpt #: 281 total cpu time spent up to now is 263.4 secs Computing kpt #: 282 total cpu time spent up to now is 264.2 secs Computing kpt #: 283 total cpu time spent up to now is 265.1 secs Computing kpt #: 284 total cpu time spent up to now is 265.9 secs Computing kpt #: 285 total cpu time spent up to now is 266.8 secs Computing kpt #: 286 total cpu time spent up to now is 267.6 secs Computing kpt #: 287 total cpu time spent up to now is 268.5 secs Computing kpt #: 288 total cpu time spent up to now is 269.4 secs Computing kpt #: 289 total cpu time spent up to now is 270.2 secs Computing kpt #: 290 total cpu time spent up to now is 271.1 secs Computing kpt #: 291 total cpu time spent up to now is 272.0 secs Computing kpt #: 292 total cpu time spent up to now is 273.0 secs Computing kpt #: 293 total cpu time spent up to now is 273.9 secs Computing kpt #: 294 total cpu time spent up to now is 274.9 secs Computing kpt #: 295 total cpu time spent up to now is 276.0 secs Computing kpt #: 296 total cpu time spent up to now is 277.1 secs Computing kpt #: 297 total cpu time spent up to now is 277.9 secs Computing kpt #: 298 total cpu time spent up to now is 278.7 secs Computing kpt #: 299 total cpu time spent up to now is 279.8 secs Computing kpt #: 300 total cpu time spent up to now is 280.9 secs Computing kpt #: 301 total cpu time spent up to now is 282.0 secs Computing kpt #: 302 total cpu time spent up to now is 283.1 secs Computing kpt #: 303 total cpu time spent up to now is 284.2 secs Computing kpt #: 304 total cpu time spent up to now is 285.2 secs Computing kpt #: 305 total cpu time spent up to now is 286.3 secs Computing kpt #: 306 total cpu time spent up to now is 287.3 secs Computing kpt #: 307 total cpu time spent up to now is 288.3 secs Computing kpt #: 308 total cpu time spent up to now is 289.3 secs Computing kpt #: 309 total cpu time spent up to now is 290.4 secs Computing kpt #: 310 total cpu time spent up to now is 291.4 secs Computing kpt #: 311 total cpu time spent up to now is 292.4 secs Computing kpt #: 312 total cpu time spent up to now is 293.3 secs Computing kpt #: 313 total cpu time spent up to now is 294.4 secs Computing kpt #: 314 total cpu time spent up to now is 295.5 secs Computing kpt #: 315 total cpu time spent up to now is 296.5 secs Computing kpt #: 316 total cpu time spent up to now is 297.6 secs Computing kpt #: 317 total cpu time spent up to now is 298.7 secs Computing kpt #: 318 total cpu time spent up to now is 299.8 secs Computing kpt #: 319 total cpu time spent up to now is 300.9 secs Computing kpt #: 320 total cpu time spent up to now is 302.1 secs Computing kpt #: 321 total cpu time spent up to now is 303.3 secs Computing kpt #: 322 total cpu time spent up to now is 304.5 secs Computing kpt #: 323 total cpu time spent up to now is 305.7 secs Computing kpt #: 324 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 307.4 secs Computing kpt #: 325 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 309.0 secs Computing kpt #: 326 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 310.7 secs Computing kpt #: 327 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 312.4 secs Computing kpt #: 328 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 314.0 secs Computing kpt #: 329 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 315.7 secs Computing kpt #: 330 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 317.4 secs Computing kpt #: 331 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 319.1 secs Computing kpt #: 332 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 320.8 secs Computing kpt #: 333 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 322.5 secs Computing kpt #: 334 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 324.2 secs Computing kpt #: 335 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 325.8 secs Computing kpt #: 336 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 327.5 secs Computing kpt #: 337 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 329.2 secs Computing kpt #: 338 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 330.9 secs Computing kpt #: 339 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 332.6 secs Computing kpt #: 340 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 334.3 secs Computing kpt #: 341 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 335.9 secs Computing kpt #: 342 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 337.6 secs Computing kpt #: 343 total cpu time spent up to now is 338.4 secs Computing kpt #: 344 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 340.1 secs Computing kpt #: 345 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 341.8 secs Computing kpt #: 346 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 343.5 secs Computing kpt #: 347 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 345.2 secs Computing kpt #: 348 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 346.9 secs Computing kpt #: 349 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 348.6 secs Computing kpt #: 350 total cpu time spent up to now is 349.3 secs Computing kpt #: 351 total cpu time spent up to now is 350.1 secs Computing kpt #: 352 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 351.7 secs Computing kpt #: 353 total cpu time spent up to now is 352.9 secs Computing kpt #: 354 total cpu time spent up to now is 354.1 secs Computing kpt #: 355 total cpu time spent up to now is 355.1 secs Computing kpt #: 356 total cpu time spent up to now is 356.1 secs Computing kpt #: 357 total cpu time spent up to now is 357.1 secs Computing kpt #: 358 total cpu time spent up to now is 357.9 secs Computing kpt #: 359 total cpu time spent up to now is 358.8 secs Computing kpt #: 360 total cpu time spent up to now is 359.6 secs Computing kpt #: 361 total cpu time spent up to now is 360.5 secs Computing kpt #: 362 total cpu time spent up to now is 361.3 secs Computing kpt #: 363 total cpu time spent up to now is 362.1 secs Computing kpt #: 364 total cpu time spent up to now is 362.9 secs Computing kpt #: 365 total cpu time spent up to now is 363.7 secs Computing kpt #: 366 total cpu time spent up to now is 364.5 secs Computing kpt #: 367 total cpu time spent up to now is 365.3 secs Computing kpt #: 368 total cpu time spent up to now is 366.1 secs Computing kpt #: 369 total cpu time spent up to now is 366.9 secs Computing kpt #: 370 total cpu time spent up to now is 367.7 secs Computing kpt #: 371 total cpu time spent up to now is 368.6 secs Computing kpt #: 372 total cpu time spent up to now is 369.4 secs Computing kpt #: 373 total cpu time spent up to now is 370.2 secs Computing kpt #: 374 total cpu time spent up to now is 371.1 secs Computing kpt #: 375 total cpu time spent up to now is 371.9 secs Computing kpt #: 376 total cpu time spent up to now is 372.7 secs Computing kpt #: 377 total cpu time spent up to now is 373.6 secs Computing kpt #: 378 total cpu time spent up to now is 374.5 secs Computing kpt #: 379 total cpu time spent up to now is 375.4 secs Computing kpt #: 380 total cpu time spent up to now is 376.3 secs Computing kpt #: 381 total cpu time spent up to now is 377.3 secs Computing kpt #: 382 total cpu time spent up to now is 378.3 secs Computing kpt #: 383 total cpu time spent up to now is 379.1 secs Computing kpt #: 384 total cpu time spent up to now is 380.0 secs Computing kpt #: 385 total cpu time spent up to now is 380.9 secs Computing kpt #: 386 total cpu time spent up to now is 381.7 secs Computing kpt #: 387 total cpu time spent up to now is 382.5 secs Computing kpt #: 388 total cpu time spent up to now is 383.3 secs Computing kpt #: 389 total cpu time spent up to now is 384.0 secs Computing kpt #: 390 total cpu time spent up to now is 384.8 secs Computing kpt #: 391 total cpu time spent up to now is 385.6 secs Computing kpt #: 392 total cpu time spent up to now is 386.4 secs Computing kpt #: 393 total cpu time spent up to now is 387.2 secs Computing kpt #: 394 total cpu time spent up to now is 388.0 secs Computing kpt #: 395 total cpu time spent up to now is 388.8 secs Computing kpt #: 396 total cpu time spent up to now is 389.6 secs Computing kpt #: 397 total cpu time spent up to now is 390.4 secs Computing kpt #: 398 total cpu time spent up to now is 391.2 secs Computing kpt #: 399 total cpu time spent up to now is 392.0 secs Computing kpt #: 400 total cpu time spent up to now is 392.8 secs Computing kpt #: 401 total cpu time spent up to now is 393.7 secs Computing kpt #: 402 total cpu time spent up to now is 394.5 secs Computing kpt #: 403 total cpu time spent up to now is 395.3 secs Computing kpt #: 404 total cpu time spent up to now is 396.1 secs Computing kpt #: 405 total cpu time spent up to now is 396.9 secs Computing kpt #: 406 total cpu time spent up to now is 397.7 secs Computing kpt #: 407 total cpu time spent up to now is 398.5 secs Computing kpt #: 408 total cpu time spent up to now is 399.3 secs Computing kpt #: 409 total cpu time spent up to now is 400.1 secs Computing kpt #: 410 total cpu time spent up to now is 400.9 secs Computing kpt #: 411 total cpu time spent up to now is 401.7 secs Computing kpt #: 412 total cpu time spent up to now is 402.5 secs Computing kpt #: 413 total cpu time spent up to now is 403.3 secs Computing kpt #: 414 total cpu time spent up to now is 404.1 secs Computing kpt #: 415 total cpu time spent up to now is 404.8 secs Computing kpt #: 416 total cpu time spent up to now is 405.6 secs Computing kpt #: 417 total cpu time spent up to now is 406.4 secs Computing kpt #: 418 total cpu time spent up to now is 407.2 secs Computing kpt #: 419 total cpu time spent up to now is 408.0 secs Computing kpt #: 420 total cpu time spent up to now is 408.7 secs Computing kpt #: 421 total cpu time spent up to now is 409.5 secs Computing kpt #: 422 total cpu time spent up to now is 410.2 secs Computing kpt #: 423 total cpu time spent up to now is 411.0 secs Computing kpt #: 424 total cpu time spent up to now is 411.7 secs Computing kpt #: 425 total cpu time spent up to now is 412.5 secs Computing kpt #: 426 total cpu time spent up to now is 413.2 secs Computing kpt #: 427 total cpu time spent up to now is 413.9 secs Computing kpt #: 428 total cpu time spent up to now is 414.6 secs Computing kpt #: 429 total cpu time spent up to now is 415.4 secs Computing kpt #: 430 total cpu time spent up to now is 416.1 secs Computing kpt #: 431 total cpu time spent up to now is 416.9 secs Computing kpt #: 432 total cpu time spent up to now is 417.7 secs Computing kpt #: 433 total cpu time spent up to now is 418.4 secs Computing kpt #: 434 total cpu time spent up to now is 419.2 secs Computing kpt #: 435 total cpu time spent up to now is 420.0 secs Computing kpt #: 436 total cpu time spent up to now is 420.7 secs Computing kpt #: 437 total cpu time spent up to now is 421.6 secs Computing kpt #: 438 total cpu time spent up to now is 422.4 secs Computing kpt #: 439 total cpu time spent up to now is 423.3 secs Computing kpt #: 440 total cpu time spent up to now is 424.2 secs Computing kpt #: 441 total cpu time spent up to now is 425.2 secs Computing kpt #: 442 total cpu time spent up to now is 426.3 secs Computing kpt #: 443 total cpu time spent up to now is 427.3 secs Computing kpt #: 444 total cpu time spent up to now is 428.4 secs Computing kpt #: 445 total cpu time spent up to now is 429.4 secs Computing kpt #: 446 total cpu time spent up to now is 430.3 secs Computing kpt #: 447 total cpu time spent up to now is 431.2 secs Computing kpt #: 448 total cpu time spent up to now is 432.1 secs Computing kpt #: 449 total cpu time spent up to now is 432.9 secs Computing kpt #: 450 total cpu time spent up to now is 433.7 secs Computing kpt #: 451 total cpu time spent up to now is 434.6 secs Computing kpt #: 452 total cpu time spent up to now is 435.3 secs Computing kpt #: 453 total cpu time spent up to now is 436.1 secs Computing kpt #: 454 total cpu time spent up to now is 436.8 secs Computing kpt #: 455 total cpu time spent up to now is 437.6 secs Computing kpt #: 456 total cpu time spent up to now is 438.4 secs Computing kpt #: 457 total cpu time spent up to now is 439.1 secs Computing kpt #: 458 total cpu time spent up to now is 439.9 secs Computing kpt #: 459 total cpu time spent up to now is 440.6 secs Computing kpt #: 460 total cpu time spent up to now is 441.4 secs Computing kpt #: 461 total cpu time spent up to now is 442.2 secs Computing kpt #: 462 total cpu time spent up to now is 442.9 secs Computing kpt #: 463 total cpu time spent up to now is 443.7 secs Computing kpt #: 464 total cpu time spent up to now is 444.5 secs Computing kpt #: 465 total cpu time spent up to now is 445.3 secs Computing kpt #: 466 total cpu time spent up to now is 446.1 secs Computing kpt #: 467 total cpu time spent up to now is 446.9 secs Computing kpt #: 468 total cpu time spent up to now is 447.7 secs Computing kpt #: 469 total cpu time spent up to now is 448.4 secs Computing kpt #: 470 total cpu time spent up to now is 449.2 secs Computing kpt #: 471 total cpu time spent up to now is 450.0 secs Computing kpt #: 472 total cpu time spent up to now is 450.8 secs Computing kpt #: 473 total cpu time spent up to now is 451.6 secs Computing kpt #: 474 total cpu time spent up to now is 452.4 secs Computing kpt #: 475 total cpu time spent up to now is 453.2 secs Computing kpt #: 476 total cpu time spent up to now is 454.0 secs Computing kpt #: 477 total cpu time spent up to now is 454.8 secs Computing kpt #: 478 total cpu time spent up to now is 455.7 secs Computing kpt #: 479 total cpu time spent up to now is 456.5 secs Computing kpt #: 480 total cpu time spent up to now is 457.3 secs Computing kpt #: 481 total cpu time spent up to now is 458.1 secs Computing kpt #: 482 total cpu time spent up to now is 458.9 secs Computing kpt #: 483 total cpu time spent up to now is 459.7 secs Computing kpt #: 484 total cpu time spent up to now is 460.5 secs ethr = 2.38E-11, avg # of iterations = 40.9 total cpu time spent up to now is 460.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2675 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0864 -19.0864 -19.0114 -19.0114 -11.5726 -11.5726 -11.2918 -11.2918 -11.2084 -11.2084 -11.1489 -11.1489 8.1633 8.1633 11.0574 11.0574 11.4800 11.4800 11.7042 11.7042 11.7727 11.7727 13.8522 13.8522 14.2958 14.2958 14.4193 14.4193 14.9849 14.9849 15.6155 15.6155 16.0839 16.0839 16.2495 16.2495 16.8158 16.8158 17.5894 17.5894 18.2503 18.2503 18.6900 18.6900 19.3569 19.3569 k = 0.0096-0.0000-0.0000 ( 2677 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0865 -19.0865 -19.0115 -19.0115 -11.5726 -11.5726 -11.2918 -11.2918 -11.2089 -11.2089 -11.1494 -11.1494 8.1656 8.1656 11.0598 11.0598 11.4820 11.4820 11.7060 11.7060 11.7735 11.7735 13.8515 13.8515 14.2941 14.2941 14.4200 14.4200 14.9840 14.9840 15.6142 15.6142 16.0846 16.0846 16.2495 16.2495 16.8137 16.8137 17.5859 17.5859 18.2522 18.2522 18.6919 18.6919 19.3548 19.3548 k = 0.0192-0.0000-0.0000 ( 2671 PWs) bands (ev): -44.7794 -44.7794 -44.7604 -44.7604 -19.0866 -19.0866 -19.0118 -19.0118 -11.5723 -11.5723 -11.2916 -11.2916 -11.2102 -11.2102 -11.1508 -11.1508 8.1726 8.1726 11.0671 11.0671 11.4880 11.4880 11.7116 11.7116 11.7761 11.7761 13.8493 13.8493 14.2893 14.2893 14.4221 14.4221 14.9810 14.9810 15.6105 15.6105 16.0868 16.0868 16.2495 16.2495 16.8072 16.8072 17.5758 17.5758 18.2579 18.2579 18.6975 18.6975 19.3487 19.3487 k = 0.0288-0.0000-0.0000 ( 2659 PWs) bands (ev): -44.7793 -44.7793 -44.7602 -44.7602 -19.0870 -19.0870 -19.0121 -19.0121 -11.5719 -11.5719 -11.2913 -11.2913 -11.2124 -11.2124 -11.1531 -11.1531 8.1842 8.1842 11.0792 11.0792 11.4979 11.4979 11.7210 11.7210 11.7804 11.7804 13.8456 13.8456 14.2815 14.2815 14.4253 14.4253 14.9762 14.9762 15.6044 15.6044 16.0902 16.0902 16.2496 16.2496 16.7966 16.7966 17.5589 17.5589 18.2674 18.2674 18.7069 18.7069 19.3386 19.3386 k = 0.0385-0.0000-0.0000 ( 2663 PWs) bands (ev): -44.7790 -44.7790 -44.7600 -44.7600 -19.0877 -19.0877 -19.0128 -19.0128 -11.5715 -11.5715 -11.2909 -11.2909 -11.2157 -11.2157 -11.1565 -11.1565 8.2004 8.2004 11.0961 11.0961 11.5117 11.5117 11.7339 11.7339 11.7864 11.7864 13.8405 13.8405 14.2708 14.2708 14.4295 14.4295 14.9694 14.9694 15.5959 15.5959 16.0949 16.0949 16.2496 16.2496 16.7817 16.7817 17.5354 17.5354 18.2806 18.2806 18.7200 18.7200 19.3246 19.3246 k = 0.0481-0.0000-0.0000 ( 2667 PWs) bands (ev): -44.7788 -44.7788 -44.7597 -44.7597 -19.0885 -19.0885 -19.0137 -19.0137 -11.5710 -11.5710 -11.2905 -11.2905 -11.2199 -11.2199 -11.1609 -11.1609 8.2211 8.2211 11.1178 11.1178 11.5293 11.5293 11.7503 11.7503 11.7942 11.7942 13.8340 13.8340 14.2574 14.2574 14.4345 14.4345 14.9608 14.9608 15.5853 15.5853 16.1007 16.1007 16.2498 16.2498 16.7629 16.7629 17.5057 17.5057 18.2975 18.2975 18.7368 18.7368 19.3069 19.3069 k = 0.0577-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7784 -44.7784 -44.7594 -44.7594 -19.0895 -19.0895 -19.0147 -19.0147 -11.5703 -11.5703 -11.2899 -11.2899 -11.2249 -11.2249 -11.1661 -11.1661 8.2465 8.2465 11.1443 11.1443 11.5507 11.5507 11.7700 11.7700 11.8040 11.8040 13.8261 13.8261 14.2416 14.2416 14.4403 14.4403 14.9504 14.9504 15.5726 15.5726 16.1074 16.1074 16.2502 16.2502 16.7402 16.7402 17.4701 17.4701 18.3182 18.3182 18.7574 18.7574 19.2855 19.2855 k = 0.0673-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7780 -44.7780 -44.7590 -44.7590 -19.0906 -19.0906 -19.0159 -19.0159 -11.5695 -11.5695 -11.2892 -11.2892 -11.2307 -11.2307 -11.1722 -11.1722 8.2763 8.2763 11.1755 11.1755 11.5758 11.5758 11.7924 11.7924 11.8162 11.8162 13.8170 13.8170 14.2235 14.2235 14.4467 14.4467 14.9382 14.9382 15.5581 15.5581 16.1147 16.1147 16.2508 16.2508 16.7139 16.7139 17.4288 17.4288 18.3424 18.3424 18.7816 18.7816 19.2607 19.2607 k = 0.0769-0.0000-0.0000 ( 2673 PWs) bands (ev): -44.7776 -44.7776 -44.7586 -44.7586 -19.0920 -19.0920 -19.0173 -19.0173 -11.5686 -11.5686 -11.2885 -11.2885 -11.2375 -11.2375 -11.1793 -11.1793 8.3107 8.3107 11.2114 11.2114 11.6044 11.6044 11.8151 11.8151 11.8332 11.8332 13.8066 13.8066 14.2033 14.2033 14.4537 14.4537 14.9244 14.9244 15.5418 15.5418 16.1224 16.1224 16.2519 16.2519 16.6841 16.6841 17.3822 17.3822 18.3702 18.3702 18.8094 18.8094 19.2326 19.2326 k = 0.0865-0.0000-0.0000 ( 2669 PWs) bands (ev): -44.7771 -44.7771 -44.7581 -44.7581 -19.0934 -19.0934 -19.0188 -19.0188 -11.5675 -11.5675 -11.2876 -11.2876 -11.2450 -11.2450 -11.1871 -11.1871 8.3494 8.3494 11.2520 11.2520 11.6365 11.6365 11.8343 11.8343 11.8586 11.8586 13.7951 13.7951 14.1810 14.1810 14.4612 14.4612 14.9090 14.9090 15.5241 15.5241 16.1301 16.1301 16.2537 16.2537 16.6513 16.6513 17.3308 17.3308 18.4014 18.4014 18.8408 18.8408 19.2014 19.2014 k = 0.0962-0.0000-0.0000 ( 2669 PWs) bands (ev): -44.7765 -44.7765 -44.7576 -44.7576 -19.0950 -19.0950 -19.0205 -19.0205 -11.5664 -11.5664 -11.2866 -11.2866 -11.2532 -11.2532 -11.1958 -11.1958 8.3926 8.3926 11.2972 11.2972 11.6718 11.6718 11.8516 11.8516 11.8906 11.8906 13.7824 13.7824 14.1569 14.1569 14.4691 14.4691 14.8920 14.8920 15.5050 15.5050 16.1374 16.1374 16.2565 16.2565 16.6156 16.6156 17.2750 17.2750 18.4359 18.4359 18.8754 18.8754 19.1675 19.1675 k = 0.1058-0.0000-0.0000 ( 2669 PWs) bands (ev): -44.7759 -44.7759 -44.7570 -44.7570 -19.0968 -19.0968 -19.0224 -19.0224 -11.5651 -11.5651 -11.2856 -11.2856 -11.2621 -11.2621 -11.2052 -11.2052 8.4400 8.4400 11.3469 11.3469 11.7103 11.7103 11.8695 11.8695 11.9268 11.9268 13.7688 13.7688 14.1310 14.1310 14.4773 14.4773 14.8737 14.8737 15.4847 15.4847 16.1437 16.1437 16.2605 16.2605 16.5774 16.5774 17.2153 17.2153 18.4736 18.4736 18.9130 18.9130 19.1312 19.1312 k = 0.1154-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7753 -44.7753 -44.7564 -44.7564 -19.0987 -19.0987 -19.0244 -19.0244 -11.5638 -11.5638 -11.2847 -11.2847 -11.2716 -11.2716 -11.2153 -11.2153 8.4917 8.4917 11.4011 11.4011 11.7516 11.7516 11.8887 11.8887 11.9662 11.9662 13.7542 13.7542 14.1035 14.1035 14.4858 14.4858 14.8540 14.8540 15.4635 15.4635 16.1487 16.1487 16.2660 16.2660 16.5373 16.5373 17.1521 17.1521 18.5142 18.5142 18.9524 18.9524 19.0937 19.0937 k = 0.1250-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7745 -44.7745 -44.7557 -44.7557 -19.1007 -19.1007 -19.0265 -19.0265 -11.5623 -11.5623 -11.2849 -11.2849 -11.2804 -11.2804 -11.2261 -11.2261 8.5476 8.5476 11.4597 11.4597 11.7956 11.7956 11.9093 11.9093 12.0085 12.0085 13.7388 13.7388 14.0745 14.0745 14.4946 14.4946 14.8332 14.8332 15.4414 15.4414 16.1518 16.1518 16.2731 16.2731 16.4958 16.4958 17.0859 17.0859 18.5575 18.5575 18.9875 18.9875 19.0609 19.0609 k = 0.1346-0.0000-0.0000 ( 2659 PWs) bands (ev): -44.7738 -44.7738 -44.7549 -44.7549 -19.1028 -19.1028 -19.0288 -19.0288 -11.5608 -11.5608 -11.2935 -11.2935 -11.2813 -11.2813 -11.2376 -11.2376 8.6076 8.6076 11.5226 11.5226 11.8418 11.8418 11.9316 11.9316 12.0534 12.0534 13.7227 13.7227 14.0443 14.0443 14.5035 14.5035 14.8112 14.8112 15.4188 15.4188 16.1530 16.1530 16.2810 16.2810 16.4539 16.4539 17.0171 17.0171 18.6033 18.6033 18.9841 18.9841 19.0667 19.0667 k = 0.1442-0.0000-0.0000 ( 2663 PWs) bands (ev): -44.7730 -44.7730 -44.7542 -44.7542 -19.1052 -19.1052 -19.0313 -19.0313 -11.5592 -11.5592 -11.3049 -11.3049 -11.2801 -11.2801 -11.2496 -11.2496 8.6716 8.6716 11.5897 11.5897 11.8898 11.8898 11.9560 11.9560 12.1007 12.1007 13.7060 13.7060 14.0129 14.0129 14.5124 14.5124 14.7883 14.7883 15.3955 15.3955 16.1521 16.1521 16.2880 16.2880 16.4138 16.4138 16.9463 16.9463 18.6511 18.6511 18.9445 18.9445 19.1084 19.1084 k = 0.1538-0.0000-0.0000 ( 2667 PWs) bands (ev): -44.7722 -44.7722 -44.7534 -44.7534 -19.1076 -19.1076 -19.0339 -19.0339 -11.5575 -11.5575 -11.3168 -11.3168 -11.2787 -11.2787 -11.2623 -11.2623 8.7395 8.7395 11.6609 11.6609 11.9380 11.9380 11.9837 11.9837 12.1501 12.1501 13.6887 13.6887 13.9806 13.9806 14.5212 14.5212 14.7646 14.7646 15.3719 15.3719 16.1492 16.1492 16.2884 16.2884 16.3813 16.3813 16.8739 16.8739 18.7005 18.7005 18.8972 18.8972 19.1569 19.1569 k = 0.1635-0.0000-0.0000 ( 2667 PWs) bands (ev): -44.7713 -44.7713 -44.7526 -44.7526 -19.1101 -19.1101 -19.0366 -19.0366 -11.5557 -11.5557 -11.3292 -11.3292 -11.2773 -11.2773 -11.2753 -11.2753 8.8112 8.8112 11.7359 11.7359 11.9823 11.9823 12.0187 12.0187 12.2015 12.2015 13.6710 13.6710 13.9475 13.9475 14.5298 14.5298 14.7401 14.7401 15.3481 15.3481 16.1443 16.1443 16.2711 16.2711 16.3675 16.3675 16.8005 16.8005 18.7503 18.7503 18.8474 18.8474 19.2063 19.2063 k = 0.1731-0.0000-0.0000 ( 2675 PWs) bands (ev): -44.7704 -44.7704 -44.7517 -44.7517 -19.1128 -19.1128 -19.0395 -19.0395 -11.5540 -11.5540 -11.3422 -11.3422 -11.2889 -11.2889 -11.2757 -11.2757 8.8866 8.8866 11.8146 11.8146 12.0183 12.0183 12.0650 12.0650 12.2545 12.2545 13.6530 13.6530 13.9138 13.9138 14.5380 14.5380 14.7152 14.7152 15.3242 15.3242 16.1373 16.1373 16.2369 16.2369 16.3720 16.3720 16.7266 16.7266 18.7807 18.7807 18.8152 18.8152 19.2536 19.2536 k = 0.1827-0.0000-0.0000 ( 2673 PWs) bands (ev): -44.7695 -44.7695 -44.7508 -44.7508 -19.1155 -19.1155 -19.0423 -19.0423 -11.5521 -11.5521 -11.3554 -11.3554 -11.3028 -11.3028 -11.2741 -11.2741 8.9657 8.9657 11.8966 11.8966 12.0502 12.0502 12.1186 12.1186 12.3089 12.3089 13.6348 13.6348 13.8797 13.8797 14.5458 14.5458 14.6898 14.6898 15.3002 15.3002 16.1274 16.1274 16.1968 16.1968 16.3844 16.3844 16.6531 16.6531 18.7331 18.7331 18.8590 18.8590 19.2950 19.2950 k = 0.1923-0.0000-0.0000 ( 2677 PWs) bands (ev): -44.7685 -44.7685 -44.7499 -44.7499 -19.1183 -19.1183 -19.0454 -19.0454 -11.5502 -11.5502 -11.3689 -11.3689 -11.3170 -11.3170 -11.2725 -11.2725 9.0482 9.0482 11.9810 11.9810 12.0823 12.0823 12.1754 12.1754 12.3644 12.3644 13.6165 13.6165 13.8453 13.8453 14.5529 14.5529 14.6642 14.6642 15.2762 15.2762 16.1116 16.1116 16.1590 16.1590 16.3985 16.3985 16.5817 16.5817 18.6762 18.6762 18.9096 18.9096 19.3256 19.3256 k = 0.2019-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7676 -44.7676 -44.7490 -44.7490 -19.1211 -19.1211 -19.0485 -19.0485 -11.5482 -11.5482 -11.3826 -11.3826 -11.3315 -11.3315 -11.2708 -11.2708 9.1342 9.1342 12.0641 12.0641 12.1193 12.1193 12.2339 12.2339 12.4206 12.4206 13.5982 13.5982 13.8109 13.8109 14.5590 14.5590 14.6389 14.6389 15.2522 15.2522 16.0835 16.0835 16.1317 16.1317 16.4073 16.4073 16.5181 16.5181 18.6169 18.6169 18.9592 18.9592 19.3399 19.3399 k = 0.2115-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7666 -44.7666 -44.7480 -44.7480 -19.1241 -19.1241 -19.0516 -19.0516 -11.5462 -11.5462 -11.3965 -11.3965 -11.3461 -11.3461 -11.2691 -11.2691 9.2234 9.2234 12.1263 12.1263 12.1807 12.1807 12.2937 12.2937 12.4774 12.4774 13.5801 13.5801 13.7766 13.7766 14.5633 14.5633 14.6147 14.6147 15.2284 15.2284 16.0450 16.0450 16.1140 16.1140 16.3888 16.3888 16.4842 16.4842 18.5558 18.5558 19.0063 19.0063 19.3342 19.3342 k = 0.2212-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7656 -44.7656 -44.7470 -44.7470 -19.1270 -19.1270 -19.0548 -19.0548 -11.5441 -11.5441 -11.4106 -11.4106 -11.3610 -11.3610 -11.2674 -11.2674 9.3157 9.3157 12.1650 12.1650 12.2687 12.2687 12.3544 12.3544 12.5343 12.5343 13.5622 13.5622 13.7425 13.7425 14.5624 14.5624 14.5948 14.5948 15.2045 15.2045 16.0037 16.0037 16.0987 16.0987 16.3341 16.3341 16.4890 16.4890 18.4932 18.4932 19.0495 19.0495 19.3091 19.3091 k = 0.2308-0.0000-0.0000 ( 2675 PWs) bands (ev): -44.7646 -44.7646 -44.7460 -44.7460 -19.1300 -19.1300 -19.0581 -19.0581 -11.5420 -11.5420 -11.4247 -11.4247 -11.3759 -11.3759 -11.2656 -11.2656 9.4110 9.4110 12.1995 12.1995 12.3632 12.3632 12.4163 12.4163 12.5910 12.5910 13.5447 13.5447 13.7090 13.7090 14.5489 14.5489 14.5871 14.5871 15.1805 15.1805 15.9624 15.9624 16.0828 16.0828 16.2700 16.2700 16.5066 16.5066 18.4293 18.4293 19.0862 19.0862 19.2697 19.2697 k = 0.2404-0.0000-0.0000 ( 2681 PWs) bands (ev): -44.7635 -44.7635 -44.7451 -44.7451 -19.1331 -19.1331 -19.0613 -19.0613 -11.5400 -11.5400 -11.4390 -11.4390 -11.3908 -11.3908 -11.2638 -11.2638 9.5092 9.5092 12.2335 12.2335 12.4554 12.4554 12.4835 12.4835 12.6472 12.6472 13.5278 13.5278 13.6762 13.6762 14.5269 14.5269 14.5874 14.5874 15.1564 15.1564 15.9221 15.9221 16.0647 16.0647 16.2069 16.2069 16.5278 16.5278 18.3641 18.3641 19.1108 19.1108 19.2260 19.2260 k = 0.2500-0.0000-0.0000 ( 2675 PWs) bands (ev): -44.7625 -44.7625 -44.7441 -44.7441 -19.1362 -19.1362 -19.0645 -19.0645 -11.5379 -11.5379 -11.4532 -11.4532 -11.4056 -11.4056 -11.2619 -11.2619 9.6101 9.6101 12.2676 12.2676 12.5283 12.5283 12.5715 12.5715 12.7024 12.7024 13.5117 13.5117 13.6444 13.6444 14.5032 14.5032 14.5894 14.5894 15.1320 15.1320 15.8830 15.8830 16.0426 16.0426 16.1492 16.1492 16.5504 16.5504 18.2980 18.2980 19.1055 19.1055 19.1989 19.1989 k = 0.2596-0.0000-0.0000 ( 2675 PWs) bands (ev): -44.7615 -44.7615 -44.7431 -44.7431 -19.1392 -19.1392 -19.0678 -19.0678 -11.5359 -11.5359 -11.4673 -11.4673 -11.4205 -11.4205 -11.2601 -11.2601 9.7135 9.7135 12.3020 12.3020 12.5903 12.5903 12.6705 12.6705 12.7564 12.7564 13.4967 13.4967 13.6137 13.6137 14.4794 14.4794 14.5915 14.5915 15.1072 15.1072 15.8445 15.8445 16.0134 16.0134 16.1018 16.1018 16.5737 16.5737 18.2311 18.2311 19.0615 19.0615 19.1992 19.1992 k = 0.2692-0.0000-0.0000 ( 2675 PWs) bands (ev): -44.7604 -44.7604 -44.7421 -44.7421 -19.1423 -19.1423 -19.0711 -19.0711 -11.5339 -11.5339 -11.4813 -11.4813 -11.4352 -11.4352 -11.2583 -11.2583 9.8193 9.8193 12.3367 12.3367 12.6499 12.6499 12.7706 12.7706 12.8089 12.8089 13.4832 13.4832 13.5845 13.5845 14.4563 14.4563 14.5934 14.5934 15.0820 15.0820 15.8058 15.8058 15.9765 15.9765 16.0667 16.0667 16.5972 16.5972 18.1635 18.1635 19.0029 19.0029 19.2038 19.2038 k = 0.2788-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7594 -44.7594 -44.7411 -44.7411 -19.1454 -19.1454 -19.0744 -19.0744 -11.5321 -11.5321 -11.4950 -11.4950 -11.4497 -11.4497 -11.2566 -11.2566 9.9273 9.9273 12.3715 12.3715 12.7079 12.7079 12.8572 12.8572 12.8712 12.8712 13.4721 13.4721 13.5572 13.5572 14.4342 14.4342 14.5953 14.5953 15.0563 15.0563 15.7656 15.7656 15.9376 15.9376 16.0405 16.0405 16.6209 16.6209 18.0955 18.0955 18.9409 18.9409 19.2021 19.2021 k = 0.2885-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7584 -44.7584 -44.7401 -44.7401 -19.1484 -19.1484 -19.0776 -19.0776 -11.5306 -11.5306 -11.5081 -11.5081 -11.4641 -11.4641 -11.2547 -11.2547 10.0373 10.0373 12.4065 12.4065 12.7643 12.7643 12.9060 12.9060 12.9644 12.9644 13.4644 13.4644 13.5326 13.5326 14.4135 14.4135 14.5975 14.5975 15.0301 15.0301 15.7228 15.7228 15.9026 15.9026 16.0185 16.0185 16.6443 16.6443 18.0273 18.0273 18.8787 18.8787 19.1915 19.1915 k = 0.2981-0.0000-0.0000 ( 2679 PWs) bands (ev): -44.7574 -44.7574 -44.7392 -44.7392 -19.1514 -19.1514 -19.0809 -19.0809 -11.5307 -11.5307 -11.5193 -11.5193 -11.4781 -11.4781 -11.2530 -11.2530 10.1492 10.1492 12.4415 12.4415 12.8189 12.8189 12.9512 12.9512 13.0502 13.0502 13.4609 13.4609 13.5130 13.5130 14.3944 14.3944 14.6001 14.6001 15.0035 15.0035 15.6772 15.6772 15.8747 15.8747 15.9982 15.9982 16.6675 16.6675 17.9591 17.9591 18.8176 18.8176 19.1714 19.1714 k = 0.3077-0.0000-0.0000 ( 2671 PWs) bands (ev): -44.7564 -44.7564 -44.7382 -44.7382 -19.1543 -19.1543 -19.0839 -19.0839 -11.5381 -11.5381 -11.5231 -11.5231 -11.4917 -11.4917 -11.2512 -11.2512 10.2626 10.2626 12.4764 12.4764 12.8714 12.8714 12.9931 12.9931 13.1219 13.1219 13.4576 13.4576 13.5074 13.5074 14.3775 14.3775 14.6039 14.6039 14.9768 14.9768 15.6297 15.6297 15.8541 15.8541 15.9786 15.9786 16.6901 16.6901 17.8912 17.8912 18.7583 18.7583 19.1421 19.1421 k = 0.3173-0.0000-0.0000 ( 2667 PWs) bands (ev): -44.7555 -44.7555 -44.7373 -44.7373 -19.1571 -19.1571 -19.0870 -19.0870 -11.5496 -11.5496 -11.5223 -11.5223 -11.5049 -11.5049 -11.2495 -11.2495 10.3774 10.3774 12.5111 12.5111 12.9212 12.9212 13.0318 13.0318 13.1734 13.1734 13.4462 13.4462 13.5285 13.5285 14.3632 14.3632 14.6094 14.6094 14.9502 14.9502 15.5818 15.5818 15.8399 15.8399 15.9594 15.9594 16.7121 16.7121 17.8237 17.8237 18.7011 18.7011 19.1046 19.1046 k = 0.3269-0.0000-0.0000 ( 2663 PWs) bands (ev): -44.7545 -44.7545 -44.7364 -44.7364 -19.1599 -19.1599 -19.0899 -19.0899 -11.5616 -11.5616 -11.5215 -11.5215 -11.5170 -11.5170 -11.2479 -11.2479 10.4933 10.4933 12.5454 12.5454 12.9677 12.9677 13.0673 13.0673 13.2032 13.2032 13.4304 13.4304 13.5728 13.5728 14.3520 14.3520 14.6174 14.6174 14.9240 14.9240 15.5346 15.5346 15.8311 15.8311 15.9404 15.9404 16.7332 16.7332 17.7569 17.7569 18.6463 18.6463 19.0604 19.0604 k = 0.3365-0.0000-0.0000 ( 2667 PWs) bands (ev): -44.7537 -44.7537 -44.7355 -44.7355 -19.1626 -19.1626 -19.0930 -19.0930 -11.5733 -11.5733 -11.5309 -11.5309 -11.5185 -11.5185 -11.2463 -11.2463 10.6102 10.6102 12.5793 12.5793 13.0097 13.0097 13.0999 13.0999 13.2162 13.2162 13.4142 13.4142 13.6293 13.6293 14.3444 14.3444 14.6289 14.6289 14.8987 14.8987 15.4893 15.4893 15.8267 15.8267 15.9218 15.9218 16.7533 16.7533 17.6912 17.6912 18.5940 18.5940 19.0109 19.0109 k = 0.3462-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7528 -44.7528 -44.7347 -44.7347 -19.1652 -19.1652 -19.0958 -19.0958 -11.5847 -11.5847 -11.5427 -11.5427 -11.5169 -11.5169 -11.2448 -11.2448 10.7276 10.7276 12.6127 12.6127 13.0453 13.0453 13.1307 13.1307 13.2194 13.2194 13.3988 13.3988 13.6879 13.6879 14.3406 14.3406 14.6447 14.6447 14.8753 14.8753 15.4469 15.4469 15.8258 15.8258 15.9037 15.9037 16.7721 16.7721 17.6268 17.6268 18.5445 18.5445 18.9578 18.9578 k = 0.3558-0.0000-0.0000 ( 2665 PWs) bands (ev): -44.7519 -44.7519 -44.7339 -44.7339 -19.1678 -19.1678 -19.0984 -19.0984 -11.5956 -11.5956 -11.5540 -11.5540 -11.5154 -11.5154 -11.2433 -11.2433 10.8453 10.8453 12.6454 12.6454 13.0722 13.0722 13.1612 13.1612 13.2181 13.2181 13.3844 13.3844 13.7415 13.7415 14.3406 14.3406 14.6650 14.6650 14.8552 14.8552 15.4082 15.4082 15.8272 15.8272 15.8865 15.8865 16.7895 16.7895 17.5640 17.5640 18.4976 18.4976 18.9022 18.9022 k = 0.3654-0.0000-0.0000 ( 2659 PWs) bands (ev): -44.7511 -44.7511 -44.7331 -44.7331 -19.1702 -19.1702 -19.1010 -19.1010 -11.6060 -11.6060 -11.5648 -11.5648 -11.5138 -11.5138 -11.2418 -11.2418 10.9629 10.9629 12.6774 12.6774 13.0890 13.0890 13.1923 13.1923 13.2152 13.2152 13.3710 13.3710 13.7857 13.7857 14.3435 14.3435 14.6878 14.6878 14.8418 14.8418 15.3742 15.3742 15.8295 15.8295 15.8715 15.8715 16.8053 16.8053 17.5032 17.5032 18.4535 18.4535 18.8452 18.8452 k = 0.3750-0.0000-0.0000 ( 2654 PWs) bands (ev): -44.7504 -44.7504 -44.7324 -44.7324 -19.1724 -19.1724 -19.1034 -19.1034 -11.6157 -11.6157 -11.5750 -11.5750 -11.5122 -11.5122 -11.2405 -11.2405 11.0802 11.0802 12.7084 12.7084 13.0964 13.0964 13.2118 13.2118 13.2233 13.2233 13.3589 13.3589 13.8190 13.8190 14.3480 14.3480 14.7063 14.7063 14.8415 14.8415 15.3462 15.3462 15.8285 15.8285 15.8624 15.8624 16.8193 16.8193 17.4448 17.4448 18.4121 18.4121 18.7880 18.7880 k = 0.3846-0.0000-0.0000 ( 2654 PWs) bands (ev): -44.7497 -44.7497 -44.7317 -44.7317 -19.1746 -19.1746 -19.1057 -19.1057 -11.6250 -11.6250 -11.5847 -11.5847 -11.5108 -11.5108 -11.2392 -11.2392 11.1966 11.1966 12.7386 12.7386 13.0965 13.0965 13.2074 13.2074 13.2524 13.2524 13.3487 13.3487 13.8416 13.8416 14.3527 14.3527 14.7120 14.7120 14.8611 14.8611 15.3261 15.3261 15.8200 15.8200 15.8631 15.8631 16.8311 16.8311 17.3891 17.3891 18.3735 18.3735 18.7315 18.7315 k = 0.3942-0.0000-0.0000 ( 2654 PWs) bands (ev): -44.7490 -44.7490 -44.7311 -44.7311 -19.1766 -19.1766 -19.1079 -19.1079 -11.6335 -11.6335 -11.5937 -11.5937 -11.5094 -11.5094 -11.2380 -11.2380 11.3116 11.3116 12.7676 12.7676 13.0920 13.0920 13.2011 13.2011 13.2763 13.2763 13.3427 13.3427 13.8552 13.8552 14.3564 14.3564 14.7057 14.7057 14.8956 14.8956 15.3167 15.3167 15.8070 15.8070 15.8705 15.8705 16.8407 16.8407 17.3366 17.3366 18.3377 18.3377 18.6765 18.6765 k = 0.4038-0.0000-0.0000 ( 2654 PWs) bands (ev): -44.7484 -44.7484 -44.7305 -44.7305 -19.1785 -19.1785 -19.1099 -19.1099 -11.6414 -11.6414 -11.6019 -11.6019 -11.5082 -11.5082 -11.2370 -11.2370 11.4247 11.4247 12.7955 12.7955 13.0847 13.0847 13.1915 13.1915 13.2886 13.2886 13.3466 13.3466 13.8619 13.8619 14.3587 14.3587 14.6937 14.6937 14.9326 14.9326 15.3213 15.3213 15.7930 15.7930 15.8808 15.8808 16.8477 16.8477 17.2878 17.2878 18.3048 18.3048 18.6238 18.6238 k = 0.4135-0.0000-0.0000 ( 2650 PWs) bands (ev): -44.7478 -44.7478 -44.7299 -44.7299 -19.1801 -19.1801 -19.1118 -19.1118 -11.6485 -11.6485 -11.6095 -11.6095 -11.5070 -11.5070 -11.2360 -11.2360 11.5354 11.5354 12.8221 12.8221 13.0761 13.0761 13.1782 13.1782 13.2873 13.2873 13.3620 13.3620 13.8636 13.8636 14.3594 14.3594 14.6800 14.6800 14.9625 14.9625 15.3428 15.3428 15.7793 15.7793 15.8926 15.8926 16.8520 16.8520 17.2430 17.2430 18.2747 18.2747 18.5742 18.5742 k = 0.4231-0.0000-0.0000 ( 2646 PWs) bands (ev): -44.7473 -44.7473 -44.7294 -44.7294 -19.1817 -19.1817 -19.1134 -19.1134 -11.6551 -11.6551 -11.6162 -11.6162 -11.5059 -11.5059 -11.2351 -11.2351 11.6427 11.6427 12.8473 12.8473 13.0669 13.0669 13.1609 13.1609 13.2794 13.2794 13.3815 13.3815 13.8621 13.8621 14.3587 14.3587 14.6666 14.6666 14.9812 14.9812 15.3805 15.3805 15.7665 15.7665 15.9054 15.9054 16.8535 16.8535 17.2028 17.2028 18.2474 18.2474 18.5282 18.5282 k = 0.4327-0.0000-0.0000 ( 2648 PWs) bands (ev): -44.7469 -44.7469 -44.7290 -44.7290 -19.1831 -19.1831 -19.1149 -19.1149 -11.6609 -11.6609 -11.6223 -11.6223 -11.5050 -11.5050 -11.2343 -11.2343 11.7457 11.7457 12.8708 12.8708 13.0573 13.0573 13.1400 13.1400 13.2693 13.2693 13.4009 13.4009 13.8585 13.8585 14.3568 14.3568 14.6541 14.6541 14.9898 14.9898 15.4297 15.4297 15.7548 15.7548 15.9188 15.9188 16.8523 16.8523 17.1674 17.1674 18.2232 18.2232 18.4865 18.4865 k = 0.4423-0.0000-0.0000 ( 2648 PWs) bands (ev): -44.7465 -44.7465 -44.7286 -44.7286 -19.1843 -19.1843 -19.1162 -19.1162 -11.6660 -11.6660 -11.6276 -11.6276 -11.5042 -11.5042 -11.2336 -11.2336 11.8433 11.8433 12.8924 12.8924 13.0471 13.0471 13.1166 13.1166 13.2585 13.2585 13.4184 13.4184 13.8539 13.8539 14.3543 14.3543 14.6431 14.6431 14.9917 14.9917 15.4838 15.4838 15.7443 15.7443 15.9325 15.9325 16.8486 16.8486 17.1371 17.1371 18.2019 18.2019 18.4494 18.4494 k = 0.4519-0.0000-0.0000 ( 2648 PWs) bands (ev): -44.7461 -44.7461 -44.7283 -44.7283 -19.1853 -19.1853 -19.1173 -19.1173 -11.6703 -11.6703 -11.6321 -11.6321 -11.5035 -11.5035 -11.2330 -11.2330 11.9338 11.9338 12.9119 12.9119 13.0351 13.0351 13.0931 13.0931 13.2478 13.2478 13.4336 13.4336 13.8490 13.8490 14.3514 14.3514 14.6337 14.6337 14.9900 14.9900 15.5371 15.5371 15.7352 15.7352 15.9464 15.9464 16.8430 16.8430 17.1120 17.1120 18.1837 18.1837 18.4174 18.4174 k = 0.4615-0.0000-0.0000 ( 2646 PWs) bands (ev): -44.7459 -44.7459 -44.7280 -44.7280 -19.1862 -19.1862 -19.1182 -19.1182 -11.6738 -11.6738 -11.6358 -11.6358 -11.5029 -11.5029 -11.2325 -11.2325 12.0151 12.0151 12.9287 12.9287 13.0192 13.0192 13.0735 13.0735 13.2378 13.2378 13.4462 13.4462 13.8444 13.8444 14.3486 14.3486 14.6260 14.6260 14.9868 14.9868 15.5851 15.5851 15.7275 15.7275 15.9599 15.9599 16.8364 16.8364 17.0918 17.0918 18.1687 18.1687 18.3907 18.3907 k = 0.4712-0.0000-0.0000 ( 2646 PWs) bands (ev): -44.7456 -44.7456 -44.7278 -44.7278 -19.1869 -19.1869 -19.1189 -19.1189 -11.6766 -11.6766 -11.6387 -11.6387 -11.5025 -11.5025 -11.2320 -11.2320 12.0845 12.0845 12.9423 12.9423 12.9989 12.9989 13.0607 13.0607 13.2289 13.2289 13.4561 13.4561 13.8405 13.8405 14.3460 14.3460 14.6201 14.6201 14.9835 14.9835 15.6247 15.6247 15.7215 15.7215 15.9722 15.9722 16.8298 16.8298 17.0763 17.0763 18.1569 18.1569 18.3696 18.3696 k = 0.4808-0.0000-0.0000 ( 2652 PWs) bands (ev): -44.7455 -44.7455 -44.7277 -44.7277 -19.1874 -19.1874 -19.1195 -19.1195 -11.6787 -11.6787 -11.6408 -11.6408 -11.5022 -11.5022 -11.2318 -11.2318 12.1385 12.1385 12.9515 12.9515 12.9792 12.9792 13.0537 13.0537 13.2219 13.2219 13.4633 13.4633 13.8375 13.8375 14.3439 14.3439 14.6158 14.6158 14.9808 14.9808 15.6539 15.6539 15.7171 15.7171 15.9824 15.9824 16.8241 16.8241 17.0654 17.0654 18.1484 18.1484 18.3544 18.3544 k = 0.4904-0.0000-0.0000 ( 2648 PWs) bands (ev): -44.7454 -44.7454 -44.7276 -44.7276 -19.1877 -19.1877 -19.1197 -19.1197 -11.6798 -11.6798 -11.6420 -11.6420 -11.5020 -11.5020 -11.2316 -11.2316 12.1732 12.1732 12.9534 12.9534 12.9683 12.9683 13.0503 13.0503 13.2173 13.2173 13.4675 13.4675 13.8357 13.8357 14.3426 14.3426 14.6133 14.6133 14.9790 14.9790 15.6717 15.6717 15.7144 15.7144 15.9892 15.9892 16.8203 16.8203 17.0589 17.0589 18.1433 18.1433 18.3452 18.3452 k = 0.5000-0.0000-0.0000 ( 2640 PWs) bands (ev): -44.7454 -44.7454 -44.7275 -44.7275 -19.1877 -19.1877 -19.1198 -19.1198 -11.6801 -11.6801 -11.6424 -11.6424 -11.5019 -11.5019 -11.2315 -11.2315 12.1853 12.1853 12.9511 12.9511 12.9671 12.9671 13.0493 13.0493 13.2157 13.2157 13.4690 13.4690 13.8351 13.8351 14.3422 14.3422 14.6125 14.6125 14.9784 14.9784 15.6777 15.6777 15.7135 15.7135 15.9916 15.9916 16.8190 16.8190 17.0568 17.0568 18.1416 18.1416 18.3422 18.3422 k = 0.5000-0.0000-0.0000 ( 2640 PWs) bands (ev): -44.7454 -44.7454 -44.7275 -44.7275 -19.1877 -19.1877 -19.1198 -19.1198 -11.6801 -11.6801 -11.6424 -11.6424 -11.5019 -11.5019 -11.2315 -11.2315 12.1853 12.1853 12.9511 12.9511 12.9671 12.9671 13.0493 13.0493 13.2157 13.2157 13.4690 13.4690 13.8351 13.8351 14.3422 14.3422 14.6125 14.6125 14.9784 14.9784 15.6777 15.6777 15.7135 15.7135 15.9916 15.9916 16.8190 16.8190 17.0568 17.0568 18.1416 18.1416 18.3422 18.3422 k = 0.5000 0.0097-0.0000 ( 2648 PWs) bands (ev): -44.7454 -44.7454 -44.7275 -44.7275 -19.1877 -19.1877 -19.1199 -19.1199 -11.6801 -11.6801 -11.6425 -11.6425 -11.5017 -11.5017 -11.2317 -11.2317 12.1847 12.1847 12.9483 12.9483 12.9632 12.9632 13.0490 13.0490 13.2164 13.2164 13.4682 13.4682 13.8383 13.8383 14.3428 14.3428 14.6128 14.6128 14.9724 14.9724 15.6696 15.6696 15.7214 15.7214 15.9904 15.9904 16.8235 16.8235 17.0606 17.0606 18.1419 18.1419 18.3395 18.3395 k = 0.5000 0.0193-0.0000 ( 2652 PWs) bands (ev): -44.7453 -44.7453 -44.7276 -44.7276 -19.1876 -19.1876 -19.1200 -19.1200 -11.6800 -11.6800 -11.6425 -11.6425 -11.5012 -11.5012 -11.2321 -11.2321 12.1831 12.1831 12.9400 12.9400 12.9517 12.9517 13.0482 13.0482 13.2183 13.2183 13.4657 13.4657 13.8477 13.8477 14.3445 14.3445 14.6141 14.6141 14.9552 14.9552 15.6519 15.6519 15.7376 15.7376 15.9876 15.9876 16.8367 16.8367 17.0719 17.0719 18.1428 18.1428 18.3319 18.3319 k = 0.5000 0.0290-0.0000 ( 2648 PWs) bands (ev): -44.7453 -44.7453 -44.7276 -44.7276 -19.1873 -19.1873 -19.1201 -19.1201 -11.6798 -11.6798 -11.6426 -11.6426 -11.5003 -11.5003 -11.2327 -11.2327 12.1804 12.1804 12.9261 12.9261 12.9335 12.9335 13.0473 13.0473 13.2210 13.2210 13.4616 13.4616 13.8624 13.8624 14.3465 14.3465 14.6168 14.6168 14.9282 14.9282 15.6285 15.6285 15.7554 15.7554 15.9865 15.9865 16.8578 16.8578 17.0902 17.0902 18.1444 18.1444 18.3208 18.3208 k = 0.5000 0.0387-0.0000 ( 2644 PWs) bands (ev): -44.7452 -44.7452 -44.7277 -44.7277 -19.1869 -19.1869 -19.1203 -19.1203 -11.6795 -11.6795 -11.6426 -11.6426 -11.4990 -11.4990 -11.2335 -11.2335 12.1766 12.1766 12.9057 12.9057 12.9110 12.9110 13.0469 13.0469 13.2242 13.2242 13.4554 13.4554 13.8813 13.8813 14.3481 14.3481 14.6219 14.6219 14.8932 14.8932 15.6001 15.6001 15.7693 15.7693 15.9921 15.9921 16.8858 16.8858 17.1147 17.1147 18.1464 18.1464 18.3076 18.3076 k = 0.5000 0.0483-0.0000 ( 2640 PWs) bands (ev): -44.7451 -44.7451 -44.7278 -44.7278 -19.1865 -19.1865 -19.1205 -19.1205 -11.6791 -11.6791 -11.6427 -11.6427 -11.4974 -11.4974 -11.2346 -11.2346 12.1719 12.1719 12.8774 12.8774 12.8873 12.8873 13.0470 13.0470 13.2276 13.2276 13.4472 13.4472 13.9028 13.9028 14.3482 14.3482 14.6301 14.6301 14.8523 14.8523 15.5671 15.5671 15.7743 15.7743 16.0100 16.0100 16.9196 16.9196 17.1444 17.1444 18.1489 18.1489 18.2934 18.2934 k = 0.5000 0.0580-0.0000 ( 2638 PWs) bands (ev): -44.7450 -44.7450 -44.7279 -44.7279 -19.1860 -19.1860 -19.1207 -19.1207 -11.6787 -11.6787 -11.6428 -11.6428 -11.4955 -11.4955 -11.2359 -11.2359 12.1662 12.1662 12.8442 12.8442 12.8612 12.8612 13.0477 13.0477 13.2310 13.2310 13.4364 13.4364 13.9255 13.9255 14.3460 14.3460 14.6418 14.6418 14.8080 14.8080 15.5297 15.5297 15.7689 15.7689 16.0423 16.0423 16.9580 16.9580 17.1782 17.1782 18.1517 18.1517 18.2791 18.2791 k = 0.5000 0.0677-0.0000 ( 2644 PWs) bands (ev): -44.7449 -44.7449 -44.7280 -44.7280 -19.1855 -19.1855 -19.1210 -19.1210 -11.6782 -11.6782 -11.6429 -11.6429 -11.4934 -11.4934 -11.2375 -11.2375 12.1596 12.1596 12.8078 12.8078 12.8325 12.8325 13.0490 13.0490 13.2342 13.2342 13.4228 13.4228 13.9479 13.9479 14.3413 14.3413 14.6560 14.6560 14.7633 14.7633 15.4885 15.4885 15.7561 15.7561 16.0869 16.0869 17.0002 17.0002 17.2151 17.2151 18.1548 18.1548 18.2651 18.2651 k = 0.5000 0.0773-0.0000 ( 2650 PWs) bands (ev): -44.7448 -44.7448 -44.7282 -44.7282 -19.1849 -19.1849 -19.1215 -19.1215 -11.6776 -11.6776 -11.6430 -11.6430 -11.4909 -11.4909 -11.2394 -11.2394 12.1522 12.1522 12.7694 12.7694 12.8017 12.8017 13.0509 13.0509 13.2374 13.2374 13.4061 13.4061 13.9687 13.9687 14.3341 14.3341 14.6640 14.6640 14.7281 14.7281 15.4437 15.4437 15.7403 15.7403 16.1404 16.1404 17.0452 17.0452 17.2541 17.2541 18.1580 18.1580 18.2517 18.2517 k = 0.5000 0.0870-0.0000 ( 2650 PWs) bands (ev): -44.7447 -44.7447 -44.7284 -44.7284 -19.1841 -19.1841 -19.1219 -19.1219 -11.6770 -11.6770 -11.6432 -11.6432 -11.4881 -11.4881 -11.2414 -11.2414 12.1441 12.1441 12.7297 12.7297 12.7695 12.7695 13.0534 13.0534 13.2405 13.2405 13.3861 13.3861 13.9868 13.9868 14.3246 14.3246 14.6404 14.6404 14.7287 14.7287 15.3955 15.3955 15.7251 15.7251 16.2004 16.2004 17.0925 17.0925 17.2944 17.2944 18.1612 18.1612 18.2390 18.2390 k = 0.5000 0.0966-0.0000 ( 2656 PWs) bands (ev): -44.7445 -44.7445 -44.7285 -44.7285 -19.1833 -19.1833 -19.1225 -19.1225 -11.6763 -11.6763 -11.6434 -11.6434 -11.4849 -11.4849 -11.2438 -11.2438 12.1353 12.1353 12.6892 12.6892 12.7363 12.7363 13.0564 13.0564 13.2435 13.2435 13.3626 13.3626 14.0011 14.0011 14.3135 14.3135 14.5975 14.5975 14.7531 14.7531 15.3442 15.3442 15.7130 15.7130 16.2649 16.2649 17.1415 17.1415 17.3354 17.3354 18.1642 18.1642 18.2269 18.2269 k = 0.5000 0.1063-0.0000 ( 2656 PWs) bands (ev): -44.7443 -44.7443 -44.7287 -44.7287 -19.1824 -19.1824 -19.1230 -19.1230 -11.6755 -11.6755 -11.6435 -11.6435 -11.4815 -11.4815 -11.2463 -11.2463 12.1261 12.1261 12.6485 12.6485 12.7024 12.7024 13.0600 13.0600 13.2463 13.2463 13.3357 13.3357 14.0112 14.0112 14.3013 14.3013 14.5523 14.5523 14.7849 14.7849 15.2902 15.2902 15.7054 15.7054 16.3328 16.3328 17.1915 17.1915 17.3767 17.3767 18.1669 18.1669 18.2156 18.2156 k = 0.5000 0.1160-0.0000 ( 2652 PWs) bands (ev): -44.7441 -44.7441 -44.7290 -44.7290 -19.1813 -19.1813 -19.1236 -19.1236 -11.6746 -11.6746 -11.6437 -11.6437 -11.4777 -11.4777 -11.2491 -11.2491 12.1165 12.1165 12.6079 12.6079 12.6685 12.6685 13.0642 13.0642 13.2475 13.2475 13.3068 13.3068 14.0164 14.0164 14.2883 14.2883 14.5082 14.5082 14.8204 14.8204 15.2342 15.2342 15.7031 15.7031 16.4032 16.4032 17.2420 17.2420 17.4182 17.4182 18.1690 18.1690 18.2052 18.2052 k = 0.5000 0.1256-0.0000 ( 2648 PWs) bands (ev): -44.7439 -44.7439 -44.7292 -44.7292 -19.1802 -19.1802 -19.1242 -19.1242 -11.6736 -11.6736 -11.6439 -11.6439 -11.4737 -11.4737 -11.2520 -11.2520 12.1067 12.1067 12.5679 12.5679 12.6346 12.6346 13.0690 13.0690 13.2411 13.2411 13.2823 13.2823 14.0169 14.0169 14.2747 14.2747 14.4664 14.4664 14.8579 14.8579 15.1773 15.1773 15.7062 15.7062 16.4755 16.4755 17.2923 17.2923 17.4603 17.4603 18.1701 18.1701 18.1959 18.1959 k = 0.5000 0.1353-0.0000 ( 2656 PWs) bands (ev): -44.7437 -44.7437 -44.7295 -44.7295 -19.1791 -19.1791 -19.1251 -19.1251 -11.6727 -11.6727 -11.6442 -11.6442 -11.4695 -11.4695 -11.2553 -11.2553 12.0967 12.0967 12.5286 12.5286 12.6011 12.6011 13.0743 13.0743 13.2143 13.2143 13.2751 13.2751 14.0126 14.0126 14.2605 14.2605 14.4277 14.4277 14.8955 14.8955 15.1213 15.1213 15.7142 15.7142 16.5490 16.5490 17.3414 17.3414 17.5035 17.5035 18.1694 18.1694 18.1884 18.1884 k = 0.5000 0.1450-0.0000 ( 2660 PWs) bands (ev): -44.7435 -44.7435 -44.7297 -44.7297 -19.1779 -19.1779 -19.1259 -19.1259 -11.6717 -11.6717 -11.6444 -11.6444 -11.4651 -11.4651 -11.2587 -11.2587 12.0869 12.0869 12.4903 12.4903 12.5684 12.5684 13.0804 13.0804 13.1747 13.1747 13.2782 13.2782 14.0039 14.0039 14.2458 14.2458 14.3927 14.3927 14.9279 14.9279 15.0719 15.0719 15.7265 15.7265 16.6233 16.6233 17.3884 17.3884 17.5487 17.5487 18.1660 18.1660 18.1838 18.1838 k = 0.5000 0.1546-0.0000 ( 2664 PWs) bands (ev): -44.7432 -44.7432 -44.7300 -44.7300 -19.1766 -19.1766 -19.1268 -19.1268 -11.6707 -11.6707 -11.6446 -11.6446 -11.4605 -11.4605 -11.2624 -11.2624 12.0772 12.0772 12.4532 12.4532 12.5366 12.5366 13.0867 13.0867 13.1303 13.1303 13.2845 13.2845 13.9911 13.9911 14.2300 14.2300 14.3617 14.3617 14.9351 14.9351 15.0490 15.0490 15.7421 15.7421 16.6980 16.6980 17.4322 17.4322 17.5967 17.5967 18.1605 18.1605 18.1813 18.1813 k = 0.5000 0.1643-0.0000 ( 2660 PWs) bands (ev): -44.7429 -44.7429 -44.7303 -44.7303 -19.1753 -19.1753 -19.1275 -19.1275 -11.6697 -11.6697 -11.6448 -11.6448 -11.4556 -11.4556 -11.2662 -11.2662 12.0680 12.0680 12.4174 12.4174 12.5059 12.5059 13.0791 13.0791 13.0975 13.0975 13.2924 13.2924 13.9747 13.9747 14.2130 14.2130 14.3352 14.3352 14.9004 14.9004 15.0696 15.0696 15.7600 15.7600 16.7727 16.7727 17.4722 17.4722 17.6479 17.6479 18.1548 18.1548 18.1794 18.1794 k = 0.5000 0.1740-0.0000 ( 2656 PWs) bands (ev): -44.7427 -44.7427 -44.7306 -44.7306 -19.1739 -19.1739 -19.1284 -19.1284 -11.6686 -11.6686 -11.6450 -11.6450 -11.4505 -11.4505 -11.2702 -11.2702 12.0593 12.0593 12.3830 12.3830 12.4766 12.4766 13.0307 13.0307 13.1042 13.1042 13.3017 13.3017 13.9550 13.9550 14.1945 14.1945 14.3134 14.3134 14.8486 14.8486 15.1091 15.1091 15.7793 15.7793 16.8471 16.8471 17.5083 17.5083 17.7021 17.7021 18.1504 18.1504 18.1772 18.1772 k = 0.5000 0.1836-0.0000 ( 2664 PWs) bands (ev): -44.7424 -44.7424 -44.7309 -44.7309 -19.1725 -19.1725 -19.1295 -19.1295 -11.6675 -11.6675 -11.6454 -11.6454 -11.4453 -11.4453 -11.2745 -11.2745 12.0512 12.0512 12.3502 12.3502 12.4489 12.4489 12.9792 12.9792 13.1133 13.1133 13.3121 13.3121 13.9325 13.9325 14.1746 14.1746 14.2961 14.2961 14.7934 14.7934 15.1540 15.1540 15.7990 15.7990 16.9207 16.9207 17.5408 17.5408 17.7579 17.7579 18.1486 18.1486 18.1744 18.1744 k = 0.5000 0.1933-0.0000 ( 2672 PWs) bands (ev): -44.7421 -44.7421 -44.7313 -44.7313 -19.1712 -19.1712 -19.1305 -19.1305 -11.6665 -11.6665 -11.6457 -11.6457 -11.4400 -11.4400 -11.2789 -11.2789 12.0440 12.0440 12.3189 12.3189 12.4229 12.4229 12.9269 12.9269 13.1233 13.1233 13.3236 13.3236 13.9078 13.9078 14.1537 14.1537 14.2825 14.2825 14.7384 14.7384 15.2008 15.2008 15.8181 15.8181 16.9933 16.9933 17.5703 17.5703 17.8128 17.8128 18.1508 18.1508 18.1718 18.1718 k = 0.5000 0.2030-0.0000 ( 2672 PWs) bands (ev): -44.7418 -44.7418 -44.7316 -44.7316 -19.1697 -19.1697 -19.1316 -19.1316 -11.6654 -11.6654 -11.6459 -11.6459 -11.4345 -11.4345 -11.2835 -11.2835 12.0377 12.0377 12.2894 12.2894 12.3989 12.3989 12.8743 12.8743 13.1344 13.1344 13.3360 13.3360 13.8813 13.8813 14.1321 14.1321 14.2721 14.2721 14.6848 14.6848 15.2484 15.2484 15.8359 15.8359 17.0647 17.0647 17.5974 17.5974 17.8630 17.8630 18.1542 18.1542 18.1756 18.1756 k = 0.5000 0.2126-0.0000 ( 2668 PWs) bands (ev): -44.7414 -44.7414 -44.7320 -44.7320 -19.1681 -19.1681 -19.1326 -19.1326 -11.6642 -11.6642 -11.6462 -11.6462 -11.4288 -11.4288 -11.2883 -11.2883 12.0324 12.0324 12.2616 12.2616 12.3770 12.3770 12.8220 12.8220 13.1464 13.1464 13.3491 13.3491 13.8537 13.8537 14.1099 14.1099 14.2641 14.2641 14.6337 14.6337 15.2961 15.2961 15.8516 15.8516 17.1344 17.1344 17.6225 17.6225 17.9033 17.9033 18.1505 18.1505 18.1989 18.1989 k = 0.5000 0.2223-0.0000 ( 2668 PWs) bands (ev): -44.7411 -44.7411 -44.7324 -44.7324 -19.1666 -19.1666 -19.1338 -19.1338 -11.6631 -11.6631 -11.6465 -11.6465 -11.4231 -11.4231 -11.2932 -11.2932 12.0283 12.0283 12.2355 12.2355 12.3575 12.3575 12.7705 12.7705 13.1594 13.1594 13.3627 13.3627 13.8258 13.8258 14.0870 14.0870 14.2583 14.2583 14.5856 14.5856 15.3436 15.3436 15.8647 15.8647 17.2022 17.2022 17.6461 17.6461 17.9301 17.9301 18.1424 18.1424 18.2425 18.2425 k = 0.5000 0.2320-0.0000 ( 2678 PWs) bands (ev): -44.7407 -44.7407 -44.7328 -44.7328 -19.1651 -19.1651 -19.1351 -19.1351 -11.6621 -11.6621 -11.6469 -11.6469 -11.4173 -11.4173 -11.2984 -11.2984 12.0252 12.0252 12.2111 12.2111 12.3405 12.3405 12.7203 12.7203 13.1734 13.1734 13.3765 13.3765 13.7984 13.7984 14.0631 14.0631 14.2541 14.2541 14.5408 14.5408 15.3904 15.3904 15.8747 15.8747 17.2679 17.2679 17.6683 17.6683 17.9438 17.9438 18.1319 18.1319 18.3036 18.3036 k = 0.5000 0.2416-0.0000 ( 2682 PWs) bands (ev): -44.7404 -44.7404 -44.7331 -44.7331 -19.1636 -19.1636 -19.1363 -19.1363 -11.6610 -11.6610 -11.6473 -11.6473 -11.4114 -11.4114 -11.3036 -11.3036 12.0234 12.0234 12.1885 12.1885 12.3263 12.3263 12.6717 12.6717 13.1883 13.1883 13.3898 13.3898 13.7724 13.7724 14.0380 14.0380 14.2516 14.2516 14.4999 14.4999 15.4363 15.4363 15.8814 15.8814 17.3313 17.3313 17.6894 17.6894 17.9478 17.9478 18.1194 18.1194 18.3783 18.3783 k = 0.5000 0.2513-0.0000 ( 2674 PWs) bands (ev): -44.7400 -44.7400 -44.7335 -44.7335 -19.1619 -19.1619 -19.1375 -19.1375 -11.6599 -11.6599 -11.6477 -11.6477 -11.4053 -11.4053 -11.3089 -11.3089 12.0227 12.0227 12.1676 12.1676 12.3151 12.3151 12.6250 12.6250 13.2043 13.2043 13.4020 13.4020 13.7491 13.7491 14.0116 14.0116 14.2505 14.2505 14.4629 14.4629 15.4812 15.4812 15.8844 15.8844 17.3920 17.3920 17.7094 17.7094 17.9457 17.9457 18.1049 18.1049 18.4629 18.4629 k = 0.5000 0.2609-0.0000 ( 2678 PWs) bands (ev): -44.7396 -44.7396 -44.7339 -44.7339 -19.1604 -19.1604 -19.1388 -19.1388 -11.6589 -11.6589 -11.6482 -11.6482 -11.3992 -11.3992 -11.3144 -11.3144 12.0232 12.0232 12.1484 12.1484 12.3070 12.3070 12.5806 12.5806 13.2212 13.2212 13.4119 13.4119 13.7296 13.7296 13.9837 13.9837 14.2508 14.2508 14.4299 14.4299 15.5247 15.5247 15.8837 15.8837 17.4498 17.4498 17.7283 17.7283 17.9400 17.9400 18.0887 18.0887 18.5548 18.5548 k = 0.5000 0.2706-0.0000 ( 2690 PWs) bands (ev): -44.7392 -44.7392 -44.7344 -44.7344 -19.1589 -19.1589 -19.1403 -19.1403 -11.6580 -11.6580 -11.6487 -11.6487 -11.3932 -11.3932 -11.3201 -11.3201 12.0248 12.0248 12.1307 12.1307 12.3023 12.3023 12.5388 12.5388 13.2390 13.2390 13.4184 13.4184 13.7156 13.7156 13.9545 13.9545 14.2524 14.2524 14.4009 14.4009 15.5668 15.5668 15.8791 15.8791 17.5044 17.5044 17.7456 17.7456 17.9325 17.9325 18.0707 18.0707 18.6524 18.6524 k = 0.5000 0.2803-0.0000 ( 2688 PWs) bands (ev): -44.7388 -44.7388 -44.7348 -44.7348 -19.1572 -19.1572 -19.1417 -19.1417 -11.6570 -11.6570 -11.6493 -11.6493 -11.3869 -11.3869 -11.3258 -11.3258 12.0276 12.0276 12.1148 12.1148 12.3012 12.3012 12.4997 12.4997 13.2576 13.2576 13.4200 13.4200 13.7084 13.7084 13.9243 13.9243 14.2554 14.2554 14.3755 14.3755 15.6070 15.6070 15.8707 15.8707 17.5554 17.5554 17.7606 17.7606 17.9246 17.9246 18.0512 18.0512 18.7547 18.7547 k = 0.5000 0.2899-0.0000 ( 2688 PWs) bands (ev): -44.7384 -44.7384 -44.7352 -44.7352 -19.1556 -19.1556 -19.1431 -19.1431 -11.6560 -11.6560 -11.6498 -11.6498 -11.3807 -11.3807 -11.3316 -11.3316 12.0313 12.0313 12.1003 12.1003 12.3038 12.3038 12.4637 12.4637 13.2770 13.2770 13.4162 13.4162 13.7089 13.7089 13.8935 13.8935 14.2598 14.2598 14.3535 14.3535 15.6454 15.6454 15.8586 15.8586 17.6026 17.6026 17.7720 17.7720 17.9184 17.9184 18.0303 18.0303 18.8610 18.8610 k = 0.5000 0.2996-0.0000 ( 2684 PWs) bands (ev): -44.7380 -44.7380 -44.7356 -44.7356 -19.1539 -19.1539 -19.1446 -19.1446 -11.6551 -11.6551 -11.6505 -11.6505 -11.3744 -11.3744 -11.3376 -11.3376 12.0361 12.0361 12.0874 12.0874 12.3104 12.3104 12.4309 12.4309 13.2970 13.2970 13.4070 13.4070 13.7170 13.7170 13.8626 13.8626 14.2656 14.2656 14.3345 14.3345 15.6816 15.6816 15.8429 15.8429 17.6455 17.6455 17.7775 17.7775 17.9161 17.9161 18.0087 18.0087 18.9707 18.9707 k = 0.5000 0.3093-0.0000 ( 2688 PWs) bands (ev): -44.7376 -44.7376 -44.7360 -44.7360 -19.1523 -19.1523 -19.1461 -19.1461 -11.6542 -11.6542 -11.6512 -11.6512 -11.3682 -11.3682 -11.3436 -11.3436 12.0419 12.0419 12.0758 12.0758 12.3208 12.3208 12.4014 12.4014 13.3173 13.3173 13.3933 13.3933 13.7318 13.7318 13.8322 13.8322 14.2728 14.2728 14.3181 14.3181 15.7155 15.7155 15.8236 15.8236 17.6837 17.6837 17.7748 17.7748 17.9199 17.9199 17.9868 17.9868 19.0833 19.0833 k = 0.5000 0.3189-0.0000 ( 2684 PWs) bands (ev): -44.7372 -44.7372 -44.7364 -44.7364 -19.1507 -19.1507 -19.1476 -19.1476 -11.6533 -11.6533 -11.6519 -11.6519 -11.3620 -11.3620 -11.3497 -11.3497 12.0487 12.0487 12.0656 12.0656 12.3352 12.3352 12.3756 12.3756 13.3377 13.3377 13.3765 13.3765 13.7519 13.7519 13.8031 13.8031 14.2815 14.2815 14.3039 14.3039 15.7468 15.7468 15.8011 15.8011 17.7165 17.7165 17.7632 17.7632 17.9304 17.9304 17.9656 17.9656 19.1985 19.1985 k = 0.5000 0.3286-0.0000 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1492 -19.1492 -19.1492 -19.1492 -11.6526 -11.6526 -11.6526 -11.6526 -11.3558 -11.3558 -11.3558 -11.3558 12.0565 12.0565 12.0565 12.0565 12.3535 12.3535 12.3535 12.3535 13.3577 13.3577 13.3577 13.3577 13.7761 13.7761 13.7761 13.7761 14.2918 14.2918 14.2918 14.2918 15.7754 15.7754 15.7754 15.7754 17.7433 17.7433 17.7433 17.7433 17.9462 17.9462 17.9462 17.9462 19.3157 19.3157 k = 0.5000 0.3286-0.0000 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1492 -19.1492 -19.1492 -19.1492 -11.6526 -11.6526 -11.6526 -11.6526 -11.3558 -11.3558 -11.3558 -11.3558 12.0565 12.0565 12.0565 12.0565 12.3535 12.3535 12.3535 12.3535 13.3577 13.3577 13.3577 13.3577 13.7761 13.7761 13.7761 13.7761 14.2918 14.2918 14.2918 14.2918 15.7754 15.7754 15.7754 15.7754 17.7433 17.7433 17.7433 17.7433 17.9462 17.9462 17.9462 17.9462 19.3157 19.3157 k = 0.4904 0.3286-0.0000 ( 2684 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1491 -19.1491 -19.1490 -19.1490 -11.6523 -11.6523 -11.6521 -11.6521 -11.3560 -11.3560 -11.3558 -11.3558 12.0521 12.0521 12.0600 12.0600 12.3501 12.3501 12.3603 12.3603 13.3565 13.3565 13.3593 13.3593 13.7760 13.7760 13.7763 13.7763 14.2865 14.2865 14.2935 14.2935 15.7665 15.7665 15.7686 15.7686 17.7420 17.7420 17.7474 17.7474 17.9499 17.9499 17.9566 17.9566 19.3103 19.3103 k = 0.4808 0.3286-0.0000 ( 2688 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1488 -19.1488 -19.1488 -19.1488 -11.6512 -11.6512 -11.6509 -11.6509 -11.3563 -11.3563 -11.3560 -11.3560 12.0470 12.0470 12.0625 12.0625 12.3502 12.3502 12.3704 12.3704 13.3558 13.3558 13.3616 13.3616 13.7760 13.7760 13.7769 13.7769 14.2777 14.2777 14.2916 14.2916 15.7423 15.7423 15.7465 15.7465 17.7430 17.7430 17.7541 17.7541 17.9674 17.9674 17.9809 17.9809 19.3065 19.3065 k = 0.4712 0.3286-0.0000 ( 2692 PWs) bands (ev): -44.7371 -44.7371 -44.7371 -44.7371 -19.1484 -19.1484 -19.1484 -19.1484 -11.6494 -11.6494 -11.6490 -11.6490 -11.3568 -11.3568 -11.3563 -11.3563 12.0412 12.0412 12.0638 12.0638 12.3539 12.3539 12.3837 12.3837 13.3554 13.3554 13.3645 13.3645 13.7761 13.7761 13.7777 13.7777 14.2655 14.2655 14.2862 14.2862 15.7041 15.7041 15.7099 15.7099 17.7458 17.7458 17.7627 17.7627 17.9984 17.9984 18.0185 18.0185 19.3042 19.3042 k = 0.4615 0.3286-0.0000 ( 2692 PWs) bands (ev): -44.7373 -44.7373 -44.7373 -44.7373 -19.1478 -19.1478 -19.1477 -19.1477 -11.6468 -11.6468 -11.6463 -11.6463 -11.3575 -11.3575 -11.3568 -11.3568 12.0349 12.0349 12.0639 12.0639 12.3610 12.3610 12.3999 12.3999 13.3552 13.3552 13.3680 13.3680 13.7762 13.7762 13.7789 13.7789 14.2502 14.2502 14.2775 14.2775 15.6536 15.6536 15.6607 15.6607 17.7498 17.7498 17.7727 17.7727 18.0418 18.0418 18.0680 18.0680 19.3034 19.3034 k = 0.4519 0.3286-0.0000 ( 2692 PWs) bands (ev): -44.7376 -44.7376 -44.7376 -44.7376 -19.1470 -19.1470 -19.1469 -19.1469 -11.6435 -11.6435 -11.6429 -11.6429 -11.3582 -11.3582 -11.3574 -11.3574 12.0282 12.0282 12.0627 12.0627 12.3715 12.3715 12.4188 12.4188 13.3548 13.3548 13.3721 13.3721 13.7762 13.7762 13.7805 13.7805 14.2322 14.2322 14.2658 14.2658 15.5927 15.5927 15.6008 15.6008 17.7549 17.7549 17.7836 17.7836 18.0960 18.0960 18.1278 18.1278 19.3041 19.3041 k = 0.4423 0.3286-0.0000 ( 2692 PWs) bands (ev): -44.7379 -44.7379 -44.7379 -44.7379 -19.1460 -19.1460 -19.1459 -19.1459 -11.6395 -11.6395 -11.6387 -11.6387 -11.3592 -11.3592 -11.3581 -11.3581 12.0210 12.0210 12.0604 12.0604 12.3849 12.3849 12.4402 12.4402 13.3540 13.3540 13.3767 13.3767 13.7760 13.7760 13.7827 13.7827 14.2118 14.2118 14.2515 14.2515 15.5235 15.5235 15.5321 15.5321 17.7609 17.7609 17.7953 17.7953 18.1592 18.1592 18.1959 18.1959 19.3063 19.3063 k = 0.4327 0.3286-0.0000 ( 2680 PWs) bands (ev): -44.7383 -44.7383 -44.7382 -44.7382 -19.1448 -19.1448 -19.1446 -19.1446 -11.6346 -11.6346 -11.6337 -11.6337 -11.3602 -11.3602 -11.3590 -11.3590 12.0134 12.0134 12.0568 12.0568 12.4012 12.4012 12.4641 12.4641 13.3525 13.3525 13.3815 13.3815 13.7756 13.7756 13.7855 13.7855 14.1897 14.1897 14.2350 14.2350 15.4477 15.4477 15.4568 15.4568 17.7679 17.7679 17.8078 17.8078 18.2293 18.2293 18.2703 18.2703 19.3098 19.3098 k = 0.4231 0.3286-0.0000 ( 2680 PWs) bands (ev): -44.7387 -44.7387 -44.7387 -44.7387 -19.1435 -19.1435 -19.1433 -19.1433 -11.6292 -11.6292 -11.6281 -11.6281 -11.3615 -11.3615 -11.3600 -11.3600 12.0052 12.0052 12.0519 12.0519 12.4199 12.4199 12.4902 12.4902 13.3498 13.3498 13.3865 13.3865 13.7749 13.7749 13.7890 13.7890 14.1663 14.1663 14.2170 14.2170 15.3671 15.3671 15.3765 15.3765 17.7758 17.7758 17.8211 17.8211 18.3044 18.3044 18.3492 18.3492 19.3145 19.3145 k = 0.4135 0.3286-0.0000 ( 2672 PWs) bands (ev): -44.7392 -44.7392 -44.7391 -44.7391 -19.1419 -19.1419 -19.1417 -19.1417 -11.6230 -11.6230 -11.6217 -11.6217 -11.3628 -11.3628 -11.3611 -11.3611 11.9962 11.9962 12.0456 12.0456 12.4408 12.4408 12.5184 12.5184 13.3456 13.3456 13.3914 13.3914 13.7739 13.7739 13.7934 13.7934 14.1424 14.1424 14.1980 14.1980 15.2830 15.2830 15.2928 15.2928 17.7847 17.7847 17.8351 17.8351 18.3828 18.3828 18.4310 18.4310 19.3202 19.3202 k = 0.4038 0.3286-0.0000 ( 2668 PWs) bands (ev): -44.7397 -44.7397 -44.7397 -44.7397 -19.1403 -19.1403 -19.1400 -19.1400 -11.6162 -11.6162 -11.6147 -11.6147 -11.3642 -11.3642 -11.3624 -11.3624 11.9862 11.9862 12.0377 12.0377 12.4635 12.4635 12.5486 12.5486 13.3396 13.3396 13.3959 13.3959 13.7725 13.7725 13.7988 13.7988 14.1187 14.1187 14.1788 14.1788 15.1967 15.1967 15.2073 15.2073 17.7944 17.7944 17.8499 17.8499 18.4630 18.4630 18.5141 18.5141 19.3269 19.3269 k = 0.3942 0.3286-0.0000 ( 2672 PWs) bands (ev): -44.7403 -44.7403 -44.7403 -44.7403 -19.1385 -19.1385 -19.1383 -19.1383 -11.6088 -11.6088 -11.6071 -11.6071 -11.3659 -11.3659 -11.3638 -11.3638 11.9748 11.9748 12.0280 12.0280 12.4878 12.4878 12.5805 12.5805 13.3313 13.3313 13.3998 13.3998 13.7710 13.7710 13.8052 13.8052 14.0956 14.0956 14.1600 14.1600 15.1093 15.1093 15.1212 15.1212 17.8049 17.8049 17.8653 17.8653 18.5436 18.5436 18.5974 18.5974 19.3343 19.3343 k = 0.3846 0.3286-0.0000 ( 2668 PWs) bands (ev): -44.7409 -44.7409 -44.7409 -44.7409 -19.1366 -19.1366 -19.1363 -19.1363 -11.6008 -11.6008 -11.5989 -11.5989 -11.3676 -11.3676 -11.3652 -11.3652 11.9619 11.9619 12.0161 12.0161 12.5133 12.5133 12.6140 12.6140 13.3205 13.3205 13.4028 13.4028 13.7697 13.7697 13.8128 13.8128 14.0737 14.0737 14.1425 14.1425 15.0216 15.0216 15.0357 15.0357 17.8160 17.8160 17.8812 17.8812 18.6232 18.6232 18.6795 18.6795 19.3423 19.3423 k = 0.3750 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7416 -44.7416 -44.7415 -44.7415 -19.1344 -19.1344 -19.1341 -19.1341 -11.5921 -11.5921 -11.5899 -11.5899 -11.3693 -11.3693 -11.3667 -11.3667 11.9469 11.9469 12.0017 12.0017 12.5397 12.5397 12.6490 12.6490 13.3073 13.3073 13.4045 13.4045 13.7689 13.7689 13.8216 13.8216 14.0532 14.0532 14.1266 14.1266 14.9346 14.9346 14.9519 14.9519 17.8276 17.8276 17.8973 17.8973 18.7006 18.7006 18.7594 18.7594 19.3506 19.3506 k = 0.3654 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7423 -44.7423 -44.7423 -44.7423 -19.1323 -19.1323 -19.1320 -19.1320 -11.5830 -11.5830 -11.5805 -11.5805 -11.3713 -11.3713 -11.3683 -11.3683 11.9296 11.9296 11.9844 11.9844 12.5667 12.5667 12.6851 12.6851 13.2917 13.2917 13.4049 13.4049 13.7693 13.7693 13.8315 13.8315 14.0339 14.0339 14.1131 14.1131 14.8491 14.8491 14.8712 14.8712 17.8393 17.8393 17.9134 17.9134 18.7746 18.7746 18.8359 18.8359 19.3590 19.3590 k = 0.3558 0.3286-0.0000 ( 2648 PWs) bands (ev): -44.7430 -44.7430 -44.7430 -44.7430 -19.1299 -19.1299 -19.1296 -19.1296 -11.5733 -11.5733 -11.5705 -11.5705 -11.3733 -11.3733 -11.3700 -11.3700 11.9094 11.9094 11.9637 11.9637 12.5940 12.5940 12.7222 12.7222 13.2743 13.2743 13.4041 13.4041 13.7715 13.7715 13.8421 13.8421 14.0152 14.0152 14.1020 14.1020 14.7658 14.7658 14.7946 14.7946 17.8509 17.8509 17.9292 17.9292 18.8440 18.8440 18.9079 18.9079 19.3673 19.3673 k = 0.3462 0.3286-0.0000 ( 2648 PWs) bands (ev): -44.7438 -44.7438 -44.7438 -44.7438 -19.1275 -19.1275 -19.1272 -19.1272 -11.5633 -11.5633 -11.5601 -11.5601 -11.3754 -11.3754 -11.3716 -11.3716 11.8859 11.8859 11.9392 11.9392 12.6212 12.6212 12.7597 12.7597 13.2556 13.2556 13.4023 13.4023 13.7759 13.7759 13.8533 13.8533 13.9963 13.9963 14.0936 14.0936 14.6859 14.6859 14.7236 14.7236 17.8620 17.8620 17.9441 17.9441 18.9074 18.9074 18.9741 18.9741 19.3754 19.3754 k = 0.3365 0.3286-0.0000 ( 2644 PWs) bands (ev): -44.7447 -44.7447 -44.7446 -44.7446 -19.1250 -19.1250 -19.1247 -19.1247 -11.5528 -11.5528 -11.5493 -11.5493 -11.3774 -11.3774 -11.3733 -11.3733 11.8588 11.8588 11.9106 11.9106 12.6480 12.6480 12.7972 12.7972 13.2367 13.2367 13.4000 13.4000 13.7831 13.7831 13.8643 13.8643 13.9761 13.9761 14.0877 14.0877 14.6104 14.6104 14.6597 14.6597 17.8721 17.8721 17.9576 17.9576 18.9639 18.9639 19.0332 19.0332 19.3834 19.3834 k = 0.3269 0.3286-0.0000 ( 2652 PWs) bands (ev): -44.7455 -44.7455 -44.7455 -44.7455 -19.1225 -19.1225 -19.1222 -19.1222 -11.5421 -11.5421 -11.5381 -11.5381 -11.3796 -11.3796 -11.3749 -11.3749 11.8278 11.8278 11.8777 11.8777 12.6740 12.6740 12.8340 12.8340 13.2186 13.2186 13.3979 13.3979 13.7929 13.7929 13.8742 13.8742 13.9533 13.9533 14.0838 14.0838 14.5412 14.5412 14.6045 14.6045 17.8806 17.8806 17.9691 17.9691 19.0120 19.0120 19.0835 19.0835 19.3916 19.3916 k = 0.3173 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7464 -44.7464 -44.7464 -44.7464 -19.1199 -19.1199 -19.1196 -19.1196 -11.5312 -11.5312 -11.5266 -11.5266 -11.3817 -11.3817 -11.3765 -11.3765 11.7926 11.7926 11.8401 11.8401 12.6988 12.6988 12.8690 12.8690 13.2027 13.2027 13.3966 13.3966 13.8050 13.8050 13.8817 13.8817 13.9274 13.9274 14.0814 14.0814 14.4805 14.4805 14.5593 14.5593 17.8869 17.8869 17.9778 17.9778 19.0511 19.0511 19.1232 19.1232 19.4010 19.4010 k = 0.3077 0.3286-0.0000 ( 2652 PWs) bands (ev): -44.7473 -44.7473 -44.7473 -44.7473 -19.1172 -19.1172 -19.1168 -19.1168 -11.5200 -11.5200 -11.5147 -11.5147 -11.3838 -11.3838 -11.3779 -11.3779 11.7531 11.7531 11.7980 11.7980 12.7222 12.7222 12.9008 12.9008 13.1906 13.1906 13.3964 13.3964 13.8170 13.8170 13.8847 13.8847 13.9001 13.9001 14.0798 14.0798 14.4311 14.4311 14.5251 14.5251 17.8904 17.8904 17.9828 17.9828 19.0808 19.0808 19.1505 19.1505 19.4130 19.4130 k = 0.2981 0.3286-0.0000 ( 2652 PWs) bands (ev): -44.7483 -44.7483 -44.7482 -44.7482 -19.1144 -19.1144 -19.1140 -19.1140 -11.5087 -11.5087 -11.5027 -11.5027 -11.3858 -11.3858 -11.3790 -11.3790 11.7093 11.7093 11.7514 11.7514 12.7439 12.7439 12.9277 12.9277 13.1840 13.1840 13.3972 13.3972 13.8196 13.8196 13.8808 13.8808 13.8811 13.8811 14.0792 14.0792 14.3958 14.3958 14.5020 14.5020 17.8902 17.8902 17.9833 17.9833 19.1012 19.1012 19.1646 19.1646 19.4285 19.4285 k = 0.2885 0.3286-0.0000 ( 2646 PWs) bands (ev): -44.7492 -44.7492 -44.7491 -44.7491 -19.1116 -19.1116 -19.1112 -19.1112 -11.4976 -11.4976 -11.4906 -11.4906 -11.3875 -11.3875 -11.3798 -11.3798 11.6614 11.6614 11.7005 11.7005 12.7637 12.7637 12.9478 12.9478 13.1844 13.1844 13.3982 13.3982 13.7977 13.7977 13.8677 13.8677 13.8870 13.8870 14.0809 14.0809 14.3763 14.3763 14.4895 14.4895 17.8856 17.8856 17.9784 17.9784 19.1133 19.1133 19.1662 19.1662 19.4475 19.4475 k = 0.2788 0.3286-0.0000 ( 2646 PWs) bands (ev): -44.7502 -44.7502 -44.7501 -44.7501 -19.1087 -19.1087 -19.1083 -19.1083 -11.4867 -11.4867 -11.4786 -11.4786 -11.3890 -11.3890 -11.3801 -11.3801 11.6095 11.6095 11.6458 11.6458 12.7813 12.7813 12.9600 12.9600 13.1919 13.1919 13.3978 13.3978 13.7640 13.7640 13.8453 13.8453 13.9080 13.9080 14.0864 14.0864 14.3718 14.3718 14.4865 14.4865 17.8760 17.8760 17.9673 17.9673 19.1190 19.1190 19.1579 19.1579 19.4687 19.4687 k = 0.2692 0.3286-0.0000 ( 2644 PWs) bands (ev): -44.7511 -44.7511 -44.7511 -44.7511 -19.1058 -19.1058 -19.1054 -19.1054 -11.4764 -11.4764 -11.4669 -11.4669 -11.3900 -11.3900 -11.3798 -11.3798 11.5543 11.5543 11.5876 11.5876 12.7965 12.7965 12.9649 12.9649 13.2044 13.2044 13.3932 13.3932 13.7317 13.7317 13.8163 13.8163 13.9351 13.9351 14.0966 14.0966 14.3801 14.3801 14.4915 14.4915 17.8608 17.8608 17.9493 17.9493 19.1200 19.1200 19.1428 19.1428 19.4905 19.4905 k = 0.2596 0.3286-0.0000 ( 2644 PWs) bands (ev): -44.7521 -44.7521 -44.7521 -44.7521 -19.1030 -19.1030 -19.1025 -19.1025 -11.4668 -11.4668 -11.4559 -11.4559 -11.3901 -11.3901 -11.3784 -11.3784 11.4960 11.4960 11.5265 11.5265 12.8093 12.8093 12.9640 12.9640 13.2181 13.2181 13.3808 13.3808 13.7074 13.7074 13.7859 13.7859 13.9659 13.9659 14.1113 14.1113 14.3984 14.3984 14.5034 14.5034 17.8396 17.8396 17.9242 17.9242 19.1184 19.1184 19.1236 19.1236 19.5116 19.5116 k = 0.2500 0.3286-0.0000 ( 2646 PWs) bands (ev): -44.7531 -44.7531 -44.7530 -44.7530 -19.1001 -19.1001 -19.0997 -19.0997 -11.4585 -11.4585 -11.4462 -11.4462 -11.3888 -11.3888 -11.3759 -11.3759 11.4352 11.4352 11.4631 11.4631 12.8194 12.8194 12.9589 12.9589 13.2286 13.2286 13.3581 13.3581 13.6956 13.6956 13.7594 13.7594 13.9997 13.9997 14.1297 14.1297 14.4242 14.4242 14.5211 14.5211 17.8124 17.8124 17.8921 17.8921 19.1024 19.1024 19.1158 19.1158 19.5303 19.5303 k = 0.2404 0.3286-0.0000 ( 2652 PWs) bands (ev): -44.7541 -44.7541 -44.7540 -44.7540 -19.0973 -19.0973 -19.0969 -19.0969 -11.4516 -11.4516 -11.4385 -11.4385 -11.3856 -11.3856 -11.3718 -11.3718 11.3724 11.3724 11.3980 11.3980 12.8265 12.8265 12.9506 12.9506 13.2321 13.2321 13.3253 13.3253 13.6970 13.6970 13.7417 13.7417 14.0362 14.0362 14.1513 14.1513 14.4558 14.4558 14.5435 14.5435 17.7794 17.7794 17.8534 17.8534 19.0804 19.0804 19.1133 19.1133 19.5454 19.5454 k = 0.2308 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7551 -44.7551 -44.7550 -44.7550 -19.0945 -19.0945 -19.0941 -19.0941 -11.4465 -11.4465 -11.4334 -11.4334 -11.3798 -11.3798 -11.3660 -11.3660 11.3083 11.3083 11.3316 11.3316 12.8301 12.8301 12.9394 12.9394 13.2261 13.2261 13.2852 13.2852 13.7097 13.7097 13.7361 13.7361 14.0751 14.0751 14.1756 14.1756 14.4920 14.4920 14.5700 14.5700 17.7409 17.7409 17.8090 17.8090 19.0582 19.0582 19.1111 19.1111 19.5552 19.5552 k = 0.2212 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7560 -44.7560 -44.7560 -44.7560 -19.0917 -19.0917 -19.0913 -19.0913 -11.4429 -11.4429 -11.4307 -11.4307 -11.3715 -11.3715 -11.3586 -11.3586 11.2433 11.2433 11.2646 11.2646 12.8295 12.8295 12.9251 12.9251 13.2110 13.2110 13.2418 13.2418 13.7309 13.7309 13.7433 13.7433 14.1160 14.1160 14.2023 14.2023 14.5319 14.5319 14.6001 14.6001 17.6978 17.6978 17.7597 17.7597 19.0355 19.0355 19.1089 19.1089 19.5581 19.5581 k = 0.2115 0.3286-0.0000 ( 2660 PWs) bands (ev): -44.7570 -44.7570 -44.7569 -44.7569 -19.0889 -19.0889 -19.0885 -19.0885 -11.4408 -11.4408 -11.4298 -11.4298 -11.3614 -11.3614 -11.3497 -11.3497 11.1780 11.1780 11.1974 11.1974 12.8238 12.8238 12.9068 12.9068 13.1893 13.1893 13.1985 13.1985 13.7581 13.7581 13.7619 13.7619 14.1587 14.1587 14.2311 14.2311 14.5750 14.5750 14.6333 14.6333 17.6509 17.6509 17.7067 17.7067 19.0117 19.0117 19.1057 19.1057 19.5525 19.5525 k = 0.2019 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7579 -44.7579 -44.7579 -44.7579 -19.0862 -19.0862 -19.0858 -19.0858 -11.4398 -11.4398 -11.4301 -11.4301 -11.3503 -11.3503 -11.3399 -11.3399 11.1128 11.1128 11.1306 11.1306 12.8120 12.8120 12.8838 12.8838 13.1584 13.1584 13.1646 13.1646 13.7892 13.7892 13.7896 13.7896 14.2028 14.2028 14.2616 14.2616 14.6207 14.6207 14.6693 14.6693 17.6010 17.6010 17.6512 17.6512 18.9857 18.9857 19.0998 19.0998 19.5379 19.5379 k = 0.1923 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7589 -44.7589 -44.7588 -44.7588 -19.0834 -19.0834 -19.0830 -19.0830 -11.4395 -11.4395 -11.4310 -11.4310 -11.3385 -11.3385 -11.3293 -11.3293 11.0483 11.0483 11.0645 11.0645 12.7931 12.7931 12.8555 12.8555 13.1237 13.1237 13.1402 13.1402 13.8227 13.8227 13.8241 13.8241 14.2478 14.2478 14.2937 14.2937 14.6689 14.6689 14.7080 14.7080 17.5490 17.5490 17.5940 17.5940 18.9560 18.9560 19.0884 19.0884 19.4951 19.4951 k = 0.1827 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7598 -44.7598 -44.7597 -44.7597 -19.0808 -19.0808 -19.0804 -19.0804 -11.4399 -11.4399 -11.4325 -11.4325 -11.3264 -11.3264 -11.3184 -11.3184 10.9848 10.9848 10.9996 10.9996 12.7669 12.7669 12.8216 12.8216 13.0956 13.0956 13.1183 13.1183 13.8603 13.8603 13.8607 13.8607 14.2934 14.2934 14.3270 14.3270 14.7191 14.7191 14.7491 14.7491 17.4958 17.4958 17.5363 17.5363 18.9212 18.9212 19.0676 19.0676 19.4369 19.4369 k = 0.1731 0.3286-0.0000 ( 2656 PWs) bands (ev): -44.7606 -44.7606 -44.7606 -44.7606 -19.0783 -19.0783 -19.0779 -19.0779 -11.4407 -11.4407 -11.4342 -11.4342 -11.3144 -11.3144 -11.3073 -11.3073 10.9227 10.9227 10.9363 10.9363 12.7340 12.7340 12.7828 12.7828 13.0742 13.0742 13.1000 13.1000 13.8988 13.8988 13.9004 13.9004 14.3389 14.3389 14.3612 14.3612 14.7713 14.7713 14.7925 14.7925 17.4421 17.4421 17.4788 17.4788 18.8799 18.8799 19.0327 19.0327 19.3867 19.3867 k = 0.1635 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7615 -44.7615 -44.7615 -44.7615 -19.0759 -19.0759 -19.0755 -19.0755 -11.4418 -11.4418 -11.4360 -11.4360 -11.3026 -11.3026 -11.2963 -11.2963 10.8624 10.8624 10.8748 10.8748 12.6961 12.6961 12.7404 12.7404 13.0584 13.0584 13.0850 13.0850 13.9378 13.9378 13.9419 13.9419 14.3840 14.3840 14.3959 14.3959 14.8251 14.8251 14.8381 14.8381 17.3887 17.3887 17.4221 17.4221 18.8312 18.8312 18.9808 18.9808 19.3491 19.3491 k = 0.1538 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7623 -44.7623 -44.7623 -44.7623 -19.0735 -19.0735 -19.0732 -19.0732 -11.4430 -11.4430 -11.4379 -11.4379 -11.2910 -11.2910 -11.2853 -11.2853 10.8042 10.8042 10.8155 10.8155 12.6548 12.6548 12.6956 12.6956 13.0471 13.0471 13.0730 13.0730 13.9773 13.9773 13.9839 13.9839 14.4281 14.4281 14.4308 14.4308 14.8805 14.8805 14.8859 14.8859 17.3360 17.3360 17.3669 17.3669 18.7749 18.7749 18.9130 18.9130 19.3244 19.3244 k = 0.1442 0.3286-0.0000 ( 2666 PWs) bands (ev): -44.7631 -44.7631 -44.7631 -44.7631 -19.0713 -19.0713 -19.0710 -19.0710 -11.4443 -11.4443 -11.4398 -11.4398 -11.2797 -11.2797 -11.2746 -11.2746 10.7483 10.7483 10.7586 10.7586 12.6118 12.6118 12.6498 12.6498 13.0390 13.0390 13.0634 13.0634 14.0169 14.0169 14.0257 14.0257 14.4656 14.4656 14.4708 14.4708 14.9356 14.9356 14.9372 14.9372 17.2846 17.2846 17.3137 17.3137 18.7116 18.7116 18.8336 18.8336 19.3096 19.3096 k = 0.1346 0.3286-0.0000 ( 2662 PWs) bands (ev): -44.7639 -44.7639 -44.7638 -44.7638 -19.0691 -19.0691 -19.0688 -19.0688 -11.4457 -11.4457 -11.4416 -11.4416 -11.2688 -11.2688 -11.2642 -11.2642 10.6950 10.6950 10.7043 10.7043 12.5685 12.5685 12.6040 12.6040 13.0330 13.0330 13.0554 13.0554 14.0562 14.0562 14.0669 14.0669 14.4998 14.4998 14.5115 14.5115 14.9871 14.9871 14.9949 14.9949 17.2348 17.2348 17.2627 17.2627 18.6424 18.6424 18.7470 18.7470 19.3012 19.3012 k = 0.1250 0.3286-0.0000 ( 2658 PWs) bands (ev): -44.7646 -44.7646 -44.7645 -44.7645 -19.0670 -19.0670 -19.0667 -19.0667 -11.4470 -11.4470 -11.4434 -11.4434 -11.2583 -11.2583 -11.2542 -11.2542 10.6445 10.6445 10.6530 10.6530 12.5260 12.5260 12.5590 12.5590 13.0285 13.0285 13.0488 13.0488 14.0949 14.0949 14.1069 14.1069 14.5332 14.5332 14.5500 14.5500 15.0402 15.0402 15.0532 15.0532 17.1871 17.1871 17.2144 17.2144 18.5690 18.5690 18.6568 18.6568 19.2966 19.2966 k = 0.1154 0.3286-0.0000 ( 2662 PWs) bands (ev): -44.7652 -44.7652 -44.7652 -44.7652 -19.0652 -19.0652 -19.0649 -19.0649 -11.4484 -11.4484 -11.4452 -11.4452 -11.2485 -11.2485 -11.2449 -11.2449 10.5970 10.5970 10.6047 10.6047 12.4849 12.4849 12.5155 12.5155 13.0250 13.0250 13.0432 13.0432 14.1326 14.1326 14.1456 14.1456 14.5653 14.5653 14.5859 14.5859 15.0945 15.0945 15.1119 15.1119 17.1418 17.1418 17.1689 17.1689 18.4929 18.4929 18.5655 18.5655 19.2942 19.2942 k = 0.1058 0.3286-0.0000 ( 2654 PWs) bands (ev): -44.7659 -44.7659 -44.7658 -44.7658 -19.0633 -19.0633 -19.0630 -19.0630 -11.4496 -11.4496 -11.4468 -11.4468 -11.2392 -11.2392 -11.2359 -11.2359 10.5528 10.5528 10.5597 10.5597 12.4458 12.4458 12.4741 12.4741 13.0223 13.0223 13.0384 13.0384 14.1690 14.1690 14.1824 14.1824 14.5959 14.5959 14.6189 14.6189 15.1494 15.1494 15.1705 15.1705 17.0990 17.0990 17.1264 17.1264 18.4158 18.4158 18.4749 18.4749 19.2931 19.2931 k = 0.0962 0.3286-0.0000 ( 2658 PWs) bands (ev): -44.7664 -44.7664 -44.7664 -44.7664 -19.0617 -19.0617 -19.0614 -19.0614 -11.4509 -11.4509 -11.4484 -11.4484 -11.2306 -11.2306 -11.2277 -11.2277 10.5119 10.5119 10.5181 10.5181 12.4092 12.4092 12.4351 12.4351 13.0200 13.0200 13.0342 13.0342 14.2038 14.2038 14.2172 14.2172 14.6247 14.6247 14.6490 14.6490 15.2045 15.2045 15.2283 15.2283 17.0592 17.0592 17.0870 17.0870 18.3391 18.3391 18.3864 18.3864 19.2926 19.2926 k = 0.0865 0.3286-0.0000 ( 2646 PWs) bands (ev): -44.7670 -44.7670 -44.7669 -44.7669 -19.0601 -19.0601 -19.0598 -19.0598 -11.4519 -11.4519 -11.4498 -11.4498 -11.2225 -11.2225 -11.2199 -11.2199 10.4746 10.4746 10.4801 10.4801 12.3755 12.3755 12.3989 12.3989 13.0181 13.0181 13.0305 13.0305 14.2366 14.2366 14.2496 14.2496 14.6516 14.6516 14.6760 14.6760 15.2592 15.2592 15.2848 15.2848 17.0224 17.0224 17.0508 17.0508 18.2643 18.2643 18.3013 18.3013 19.2926 19.2929 k = 0.0769 0.3286-0.0000 ( 2658 PWs) bands (ev): -44.7675 -44.7675 -44.7674 -44.7674 -19.0588 -19.0588 -19.0586 -19.0586 -11.4530 -11.4530 -11.4511 -11.4511 -11.2154 -11.2154 -11.2131 -11.2131 10.4409 10.4409 10.4457 10.4457 12.3448 12.3448 12.3657 12.3657 13.0166 13.0166 13.0273 13.0273 14.2672 14.2672 14.2795 14.2795 14.6761 14.6761 14.6999 14.6999 15.3125 15.3125 15.3391 15.3391 16.9890 16.9890 17.0177 17.0177 18.1925 18.1925 18.2208 18.2208 19.2912 19.2912 k = 0.0673 0.3286-0.0000 ( 2666 PWs) bands (ev): -44.7679 -44.7679 -44.7679 -44.7679 -19.0577 -19.0577 -19.0575 -19.0575 -11.4540 -11.4540 -11.4524 -11.4524 -11.2090 -11.2090 -11.2070 -11.2070 10.4109 10.4109 10.4151 10.4151 12.3174 12.3174 12.3358 12.3358 13.0153 13.0153 13.0244 13.0244 14.2952 14.2952 14.3064 14.3064 14.6983 14.6983 14.7206 14.7206 15.3637 15.3637 15.3903 15.3903 16.9592 16.9592 16.9878 16.9878 18.1251 18.1251 18.1461 18.1461 19.2883 19.2883 k = 0.0577 0.3286-0.0000 ( 2666 PWs) bands (ev): -44.7683 -44.7683 -44.7682 -44.7682 -19.0566 -19.0566 -19.0565 -19.0565 -11.4548 -11.4548 -11.4534 -11.4534 -11.2033 -11.2033 -11.2016 -11.2016 10.3848 10.3848 10.3883 10.3883 12.2936 12.2936 12.3094 12.3094 13.0143 13.0143 13.0219 13.0219 14.3203 14.3203 14.3302 14.3302 14.7180 14.7180 14.7381 14.7381 15.4119 15.4119 15.4375 15.4375 16.9332 16.9332 16.9611 16.9611 18.0633 18.0633 18.0781 18.0781 19.2865 19.2868 k = 0.0481 0.3286-0.0000 ( 2666 PWs) bands (ev): -44.7686 -44.7686 -44.7686 -44.7686 -19.0557 -19.0557 -19.0556 -19.0556 -11.4555 -11.4555 -11.4544 -11.4544 -11.1984 -11.1984 -11.1970 -11.1970 10.3626 10.3626 10.3655 10.3655 12.2734 12.2734 12.2866 12.2866 13.0135 13.0135 13.0197 13.0197 14.3422 14.3422 14.3507 14.3507 14.7350 14.7350 14.7525 14.7525 15.4559 15.4559 15.4796 15.4796 16.9114 16.9114 16.9375 16.9375 18.0083 18.0083 18.0182 18.0182 19.2855 19.2856 k = 0.0385 0.3286-0.0000 ( 2662 PWs) bands (ev): -44.7688 -44.7688 -44.7688 -44.7688 -19.0549 -19.0549 -19.0548 -19.0548 -11.4560 -11.4560 -11.4551 -11.4551 -11.1943 -11.1943 -11.1932 -11.1932 10.3444 10.3444 10.3467 10.3467 12.2569 12.2569 12.2675 12.2675 13.0129 13.0129 13.0178 13.0178 14.3607 14.3607 14.3676 14.3676 14.7494 14.7494 14.7639 14.7639 15.4947 15.4947 15.5154 15.5154 16.8939 16.8939 16.9172 16.9172 17.9612 17.9612 17.9674 17.9674 19.2852 19.2853 k = 0.0288 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0543 -19.0543 -19.0543 -19.0543 -11.4564 -11.4564 -11.4558 -11.4558 -11.1911 -11.1911 -11.1903 -11.1903 10.3303 10.3303 10.3320 10.3320 12.2443 12.2443 12.2523 12.2523 13.0126 13.0126 13.0162 13.0162 14.3755 14.3755 14.3808 14.3808 14.7611 14.7611 14.7722 14.7722 15.5271 15.5271 15.5438 15.5438 16.8811 16.8811 16.9001 16.9001 17.9232 17.9232 17.9267 17.9267 19.2854 19.2855 k = 0.0192 0.3286-0.0000 ( 2672 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0540 -19.0540 -19.0539 -19.0539 -11.4567 -11.4567 -11.4563 -11.4563 -11.1888 -11.1888 -11.1883 -11.1883 10.3202 10.3202 10.3214 10.3214 12.2357 12.2357 12.2410 12.2410 13.0125 13.0125 13.0149 13.0149 14.3865 14.3865 14.3901 14.3901 14.7700 14.7700 14.7775 14.7775 15.5522 15.5522 15.5639 15.5639 16.8730 16.8730 16.8865 16.8865 17.8951 17.8951 17.8969 17.8969 19.2861 19.2867 k = 0.0096 0.3286-0.0000 ( 2672 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0537 -19.0537 -19.0537 -19.0537 -11.4568 -11.4568 -11.4566 -11.4566 -11.1874 -11.1874 -11.1871 -11.1871 10.3143 10.3143 10.3148 10.3148 12.2310 12.2310 12.2336 12.2336 13.0127 13.0127 13.0139 13.0139 14.3935 14.3935 14.3953 14.3953 14.7761 14.7761 14.7799 14.7799 15.5690 15.5690 15.5750 15.5750 16.8696 16.8696 16.8767 16.8767 17.8780 17.8780 17.8787 17.8787 19.2869 19.2875 k = 0.0000 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0536 -19.0536 -19.0536 -19.0536 -11.4567 -11.4567 -11.4567 -11.4567 -11.1868 -11.1868 -11.1868 -11.1868 10.3125 10.3125 10.3125 10.3125 12.2303 12.2303 12.2303 12.2303 13.0132 13.0132 13.0132 13.0132 14.3965 14.3965 14.3965 14.3965 14.7795 14.7795 14.7795 14.7795 15.5767 15.5767 15.5767 15.5767 16.8710 16.8710 16.8710 16.8710 17.8725 17.8725 17.8725 17.8725 19.2878 19.2878 k = 0.0000 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0536 -19.0536 -19.0536 -19.0536 -11.4567 -11.4567 -11.4567 -11.4567 -11.1868 -11.1868 -11.1868 -11.1868 10.3125 10.3125 10.3125 10.3125 12.2303 12.2303 12.2303 12.2303 13.0132 13.0132 13.0132 13.0132 14.3965 14.3965 14.3965 14.3965 14.7795 14.7795 14.7795 14.7795 15.5767 15.5767 15.5767 15.5767 16.8710 16.8710 16.8710 16.8710 17.8725 17.8725 17.8725 17.8725 19.2878 19.2878 k = 0.0000 0.3189-0.0000 ( 2666 PWs) bands (ev): -44.7697 -44.7697 -44.7689 -44.7689 -19.0554 -19.0554 -19.0518 -19.0518 -11.4631 -11.4631 -11.4503 -11.4503 -11.1881 -11.1881 -11.1855 -11.1855 10.2245 10.2245 10.3978 10.3978 12.2056 12.2056 12.2483 12.2483 12.9811 12.9811 13.0511 13.0511 14.3863 14.3863 14.4053 14.4053 14.7620 14.7620 14.7991 14.7991 15.5440 15.5440 15.6066 15.6066 16.8406 16.8406 16.9035 16.9035 17.8363 17.8363 17.9185 17.9185 19.2613 19.2613 k = 0.0000 0.3093-0.0000 ( 2668 PWs) bands (ev): -44.7702 -44.7702 -44.7684 -44.7684 -19.0570 -19.0570 -19.0501 -19.0501 -11.4692 -11.4692 -11.4439 -11.4439 -11.1893 -11.1893 -11.1842 -11.1842 10.1342 10.1342 10.4798 10.4798 12.1749 12.1749 12.2594 12.2594 12.9537 12.9537 13.0953 13.0953 14.3743 14.3743 14.4129 14.4129 14.7473 14.7473 14.8203 14.8203 15.5091 15.5091 15.6333 15.6333 16.8129 16.8129 16.9376 16.9376 17.8099 17.8099 17.9743 17.9743 19.2339 19.2339 k = 0.0000 0.2996-0.0000 ( 2666 PWs) bands (ev): -44.7706 -44.7706 -44.7680 -44.7680 -19.0587 -19.0587 -19.0483 -19.0483 -11.4752 -11.4752 -11.4374 -11.4374 -11.1905 -11.1905 -11.1827 -11.1827 10.0423 10.0423 10.5580 10.5580 12.1393 12.1393 12.2637 12.2637 12.9298 12.9298 13.1460 13.1460 14.3607 14.3607 14.4199 14.4199 14.7356 14.7356 14.8427 14.8427 15.4725 15.4725 15.6565 15.6565 16.7886 16.7886 16.9730 16.9730 17.7929 17.7929 18.0392 18.0392 19.2062 19.2062 k = 0.0000 0.2899-0.0000 ( 2668 PWs) bands (ev): -44.7711 -44.7711 -44.7676 -44.7676 -19.0603 -19.0603 -19.0466 -19.0466 -11.4811 -11.4811 -11.4308 -11.4308 -11.1916 -11.1916 -11.1814 -11.1814 9.9491 9.9491 10.6321 10.6321 12.0997 12.0997 12.2616 12.2616 12.9078 12.9078 13.2027 13.2027 14.3453 14.3453 14.4266 14.4266 14.7273 14.7273 14.8658 14.8658 15.4349 15.4349 15.6760 15.6760 16.7682 16.7682 17.0093 17.0093 17.7847 17.7847 18.1121 18.1121 19.1791 19.1791 k = 0.0000 0.2803-0.0000 ( 2670 PWs) bands (ev): -44.7715 -44.7715 -44.7672 -44.7672 -19.0620 -19.0620 -19.0448 -19.0448 -11.4870 -11.4870 -11.4242 -11.4242 -11.1928 -11.1928 -11.1799 -11.1799 9.8552 9.8552 10.7014 10.7014 12.0574 12.0574 12.2540 12.2540 12.8861 12.8861 13.2648 13.2648 14.3285 14.3285 14.4336 14.4336 14.7225 14.7225 14.8893 14.8893 15.3971 15.3971 15.6917 15.6917 16.7521 16.7521 17.0464 17.0464 17.7846 17.7846 18.1911 18.1911 19.1540 19.1540 k = 0.0000 0.2706-0.0000 ( 2678 PWs) bands (ev): -44.7720 -44.7720 -44.7668 -44.7668 -19.0636 -19.0636 -19.0431 -19.0431 -11.4926 -11.4926 -11.4176 -11.4176 -11.1938 -11.1938 -11.1785 -11.1785 9.7610 9.7610 10.7658 10.7658 12.0134 12.0134 12.2415 12.2415 12.8634 12.8634 13.3317 13.3317 14.3105 14.3105 14.4413 14.4413 14.7211 14.7211 14.9131 14.9131 15.3598 15.3598 15.7035 15.7035 16.7408 16.7408 17.0843 17.0843 17.7919 17.7919 18.2732 18.2732 19.1329 19.1329 k = 0.0000 0.2609-0.0000 ( 2674 PWs) bands (ev): -44.7724 -44.7724 -44.7664 -44.7664 -19.0652 -19.0652 -19.0412 -19.0412 -11.4981 -11.4981 -11.4108 -11.4108 -11.1948 -11.1948 -11.1770 -11.1770 9.6670 9.6670 10.8249 10.8249 11.9686 11.9686 12.2250 12.2250 12.8385 12.8385 13.4024 13.4024 14.2917 14.2917 14.4498 14.4498 14.7229 14.7229 14.9372 14.9372 15.3241 15.3241 15.7116 15.7116 16.7344 16.7344 17.1228 17.1228 17.8059 17.8059 18.3543 18.3543 19.1193 19.1193 k = 0.0000 0.2513-0.0000 ( 2678 PWs) bands (ev): -44.7729 -44.7729 -44.7660 -44.7660 -19.0667 -19.0667 -19.0395 -19.0395 -11.5035 -11.5035 -11.4042 -11.4042 -11.1957 -11.1957 -11.1755 -11.1755 9.5735 9.5735 10.8784 10.8784 11.9238 11.9238 12.2053 12.2053 12.8104 12.8104 13.4761 13.4761 14.2724 14.2724 14.4591 14.4591 14.7276 14.7276 14.9618 14.9618 15.2908 15.2908 15.7162 15.7162 16.7330 16.7330 17.1619 17.1619 17.8259 17.8259 18.4281 18.4281 19.1184 19.1184 k = 0.0000 0.2416-0.0000 ( 2678 PWs) bands (ev): -44.7733 -44.7733 -44.7656 -44.7656 -19.0681 -19.0681 -19.0377 -19.0377 -11.5086 -11.5086 -11.3976 -11.3976 -11.1966 -11.1966 -11.1740 -11.1740 9.4810 9.4810 10.9263 10.9263 11.8797 11.8797 12.1830 12.1830 12.7787 12.7787 13.5520 13.5520 14.2529 14.2529 14.4687 14.4687 14.7350 14.7350 14.9874 14.9874 15.2611 15.2611 15.7174 15.7174 16.7367 16.7367 17.2015 17.2015 17.8511 17.8511 18.4868 18.4868 19.1365 19.1365 k = 0.0000 0.2320-0.0000 ( 2676 PWs) bands (ev): -44.7737 -44.7737 -44.7652 -44.7652 -19.0695 -19.0695 -19.0360 -19.0360 -11.5135 -11.5135 -11.3909 -11.3909 -11.1975 -11.1975 -11.1725 -11.1725 9.3898 9.3898 10.9684 10.9684 11.8368 11.8368 12.1587 12.1587 12.7429 12.7429 13.6291 13.6291 14.2334 14.2334 14.4777 14.4777 14.7450 14.7450 15.0147 15.0147 15.2357 15.2357 15.7157 15.7157 16.7454 16.7454 17.2416 17.2416 17.8809 17.8809 18.5235 18.5235 19.1786 19.1786 k = 0.0000 0.2223-0.0000 ( 2676 PWs) bands (ev): -44.7741 -44.7741 -44.7648 -44.7648 -19.0708 -19.0708 -19.0343 -19.0343 -11.5183 -11.5183 -11.3844 -11.3844 -11.1982 -11.1982 -11.1710 -11.1710 9.3002 9.3002 11.0049 11.0049 11.7955 11.7955 12.1328 12.1328 12.7031 12.7031 13.7065 13.7065 14.2140 14.2140 14.4852 14.4852 14.7574 14.7574 15.0447 15.0447 15.2153 15.2153 15.7114 15.7114 16.7589 16.7589 17.2818 17.2818 17.9145 17.9145 18.5362 18.5362 19.2429 19.2429 k = 0.0000 0.2126-0.0000 ( 2668 PWs) bands (ev): -44.7745 -44.7745 -44.7645 -44.7645 -19.0720 -19.0720 -19.0325 -19.0325 -11.5229 -11.5229 -11.3779 -11.3779 -11.1989 -11.1989 -11.1694 -11.1694 9.2126 9.2126 11.0358 11.0358 11.7563 11.7563 12.1059 12.1059 12.6596 12.6596 13.7832 13.7832 14.1950 14.1950 14.4898 14.4898 14.7723 14.7723 15.0787 15.0787 15.2003 15.2003 15.7050 15.7050 16.7771 16.7771 17.3220 17.3220 17.9511 17.9511 18.5285 18.5285 19.3166 19.3166 k = 0.0000 0.2030-0.0000 ( 2670 PWs) bands (ev): -44.7749 -44.7749 -44.7642 -44.7642 -19.0733 -19.0733 -19.0309 -19.0309 -11.5273 -11.5273 -11.3715 -11.3715 -11.1996 -11.1996 -11.1679 -11.1679 9.1272 9.1272 11.0614 11.0614 11.7195 11.7195 12.0783 12.0783 12.6127 12.6127 13.8580 13.8580 14.1763 14.1763 14.4907 14.4907 14.7899 14.7899 15.1179 15.1179 15.1903 15.1903 15.6971 15.6971 16.7997 16.7997 17.3617 17.3617 17.9900 17.9900 18.5063 18.5063 19.3766 19.3766 k = 0.0000 0.1933-0.0000 ( 2673 PWs) bands (ev): -44.7753 -44.7753 -44.7638 -44.7638 -19.0746 -19.0746 -19.0293 -19.0293 -11.5316 -11.5316 -11.3652 -11.3652 -11.2004 -11.2004 -11.1664 -11.1664 9.0442 9.0442 11.0818 11.0818 11.6853 11.6853 12.0503 12.0503 12.5629 12.5629 13.9292 13.9292 14.1584 14.1584 14.4873 14.4873 14.8108 14.8108 15.1625 15.1625 15.1852 15.1852 15.6881 15.6881 16.8265 16.8265 17.4003 17.4003 18.0301 18.0301 18.4751 18.4751 19.4095 19.4095 k = 0.0000 0.1836-0.0000 ( 2675 PWs) bands (ev): -44.7757 -44.7757 -44.7635 -44.7635 -19.0757 -19.0757 -19.0277 -19.0277 -11.5356 -11.5356 -11.3591 -11.3591 -11.2011 -11.2011 -11.1650 -11.1650 8.9640 8.9640 11.0973 11.0973 11.6540 11.6540 12.0223 12.0223 12.5108 12.5108 13.9946 13.9946 14.1425 14.1425 14.4797 14.4797 14.8356 14.8356 15.1825 15.1825 15.2147 15.2147 15.6785 15.6785 16.8572 16.8572 17.4372 17.4372 18.0702 18.0702 18.4394 18.4394 19.4243 19.4243 k = 0.0000 0.1740-0.0000 ( 2669 PWs) bands (ev): -44.7760 -44.7760 -44.7632 -44.7632 -19.0768 -19.0768 -19.0261 -19.0261 -11.5393 -11.5393 -11.3530 -11.3530 -11.2016 -11.2016 -11.1635 -11.1635 8.8867 8.8867 11.1084 11.1084 11.6256 11.6256 11.9945 11.9945 12.4571 12.4571 14.0475 14.0475 14.1340 14.1340 14.4685 14.4685 14.8647 14.8647 15.1843 15.1843 15.2711 15.2711 15.6691 15.6691 16.8915 16.8915 17.4713 17.4713 18.1081 18.1081 18.4036 18.4036 19.4304 19.4304 k = 0.0000 0.1643-0.0000 ( 2671 PWs) bands (ev): -44.7764 -44.7764 -44.7629 -44.7629 -19.0778 -19.0778 -19.0247 -19.0247 -11.5429 -11.5429 -11.3472 -11.3472 -11.2023 -11.2023 -11.1622 -11.1622 8.8125 8.8125 11.1155 11.1155 11.6002 11.6002 11.9671 11.9671 12.4023 12.4023 14.0690 14.0690 14.1509 14.1509 14.4546 14.4546 14.8979 14.8979 15.1894 15.1894 15.3324 15.3324 15.6601 15.6601 16.9290 16.9290 17.5013 17.5013 18.1402 18.1402 18.3732 18.3732 19.4320 19.4320 k = 0.0000 0.1546-0.0000 ( 2667 PWs) bands (ev): -44.7767 -44.7767 -44.7627 -44.7627 -19.0788 -19.0788 -19.0232 -19.0232 -11.5463 -11.5463 -11.3415 -11.3415 -11.2029 -11.2029 -11.1608 -11.1608 8.7416 8.7416 11.1190 11.1190 11.5778 11.5778 11.9404 11.9404 12.3470 12.3470 14.0610 14.0610 14.1904 14.1904 14.4391 14.4391 14.9338 14.9338 15.1988 15.1988 15.3972 15.3972 15.6522 15.6522 16.9694 16.9694 17.5257 17.5257 18.1603 18.1603 18.3560 18.3560 19.4308 19.4308 k = 0.0000 0.1450-0.0000 ( 2667 PWs) bands (ev): -44.7771 -44.7771 -44.7624 -44.7624 -19.0797 -19.0797 -19.0218 -19.0218 -11.5495 -11.5495 -11.3361 -11.3361 -11.2034 -11.2034 -11.1595 -11.1595 8.6743 8.6743 11.1196 11.1196 11.5582 11.5582 11.9144 11.9144 12.2919 12.2919 14.0449 14.0449 14.2309 14.2309 14.4228 14.4228 14.9694 14.9694 15.2150 15.2150 15.4642 15.4642 15.6459 15.6459 17.0122 17.0122 17.5424 17.5424 18.1635 18.1635 18.3592 18.3592 19.4278 19.4278 k = 0.0000 0.1353-0.0000 ( 2667 PWs) bands (ev): -44.7774 -44.7774 -44.7622 -44.7622 -19.0806 -19.0806 -19.0205 -19.0205 -11.5525 -11.5525 -11.3308 -11.3308 -11.2039 -11.2039 -11.1582 -11.1582 8.6106 8.6106 11.1176 11.1176 11.5414 11.5414 11.8895 11.8895 12.2374 12.2374 14.0267 14.0267 14.2666 14.2666 14.4067 14.4067 15.0003 15.0003 15.2417 15.2417 15.5319 15.5319 15.6416 15.6416 17.0569 17.0569 17.5491 17.5491 18.1541 18.1541 18.3802 18.3802 19.4235 19.4235 k = 0.0000 0.1256-0.0000 ( 2665 PWs) bands (ev): -44.7776 -44.7776 -44.7619 -44.7619 -19.0814 -19.0814 -19.0193 -19.0193 -11.5552 -11.5552 -11.3259 -11.3259 -11.2044 -11.2044 -11.1570 -11.1570 8.5507 8.5507 11.1138 11.1138 11.5271 11.5271 11.8657 11.8657 12.1840 12.1840 14.0078 14.0078 14.2965 14.2965 14.3915 14.3915 15.0223 15.0223 15.2819 15.2819 15.5972 15.5972 15.6416 15.6416 17.1026 17.1026 17.5439 17.5439 18.1421 18.1421 18.4109 18.4109 19.4183 19.4183 k = 0.0000 0.1160-0.0000 ( 2665 PWs) bands (ev): -44.7779 -44.7779 -44.7617 -44.7617 -19.0821 -19.0821 -19.0181 -19.0181 -11.5578 -11.5578 -11.3212 -11.3212 -11.2049 -11.2049 -11.1559 -11.1559 8.4948 8.4948 11.1087 11.1087 11.5151 11.5151 11.8432 11.8432 12.1322 12.1322 13.9889 13.9889 14.3203 14.3203 14.3780 14.3780 15.0345 15.0345 15.3352 15.3352 15.6317 15.6317 15.6739 15.6739 17.1482 17.1482 17.5262 17.5262 18.1346 18.1346 18.4452 18.4452 19.4125 19.4125 k = 0.0000 0.1063-0.0000 ( 2665 PWs) bands (ev): -44.7782 -44.7782 -44.7615 -44.7615 -19.0828 -19.0828 -19.0171 -19.0171 -11.5602 -11.5602 -11.3167 -11.3167 -11.2054 -11.2054 -11.1548 -11.1548 8.4429 8.4429 11.1027 11.1027 11.5052 11.5052 11.8221 11.8221 12.0824 12.0824 13.9702 13.9702 14.3367 14.3367 14.3687 14.3687 15.0387 15.0387 15.3979 15.3979 15.6378 15.6378 15.7357 15.7357 17.1920 17.1920 17.4974 17.4974 18.1339 18.1339 18.4801 18.4801 19.4063 19.4063 k = 0.0000 0.0966-0.0000 ( 2673 PWs) bands (ev): -44.7784 -44.7784 -44.7614 -44.7614 -19.0835 -19.0835 -19.0162 -19.0162 -11.5624 -11.5624 -11.3127 -11.3127 -11.2059 -11.2059 -11.1538 -11.1538 8.3952 8.3952 11.0963 11.0963 11.4971 11.4971 11.8024 11.8024 12.0349 12.0349 13.9521 13.9521 14.3399 14.3399 14.3702 14.3702 15.0375 15.0375 15.4639 15.4639 15.6473 15.6473 15.7970 15.7970 17.2298 17.2298 17.4623 17.4623 18.1398 18.1398 18.5138 18.5138 19.4000 19.4000 k = 0.0000 0.0870-0.0000 ( 2681 PWs) bands (ev): -44.7786 -44.7786 -44.7612 -44.7612 -19.0841 -19.0841 -19.0154 -19.0154 -11.5644 -11.5644 -11.3090 -11.3090 -11.2063 -11.2063 -11.1530 -11.1530 8.3517 8.3517 11.0898 11.0898 11.4908 11.4908 11.7844 11.7844 11.9902 11.9902 13.9349 13.9349 14.3333 14.3333 14.3796 14.3796 15.0330 15.0330 15.5240 15.5240 15.6685 15.6685 15.8550 15.8550 17.2517 17.2517 17.4324 17.4324 18.1509 18.1509 18.5455 18.5455 19.3936 19.3936 k = 0.0000 0.0773-0.0000 ( 2679 PWs) bands (ev): -44.7788 -44.7788 -44.7610 -44.7610 -19.0846 -19.0846 -19.0146 -19.0146 -11.5661 -11.5661 -11.3055 -11.3055 -11.2067 -11.2067 -11.1521 -11.1521 8.3125 8.3125 11.0835 11.0835 11.4860 11.4860 11.7680 11.7680 11.9485 11.9485 13.9188 13.9188 14.3254 14.3254 14.3891 14.3891 15.0265 15.0265 15.5656 15.5656 15.7118 15.7118 15.9091 15.9091 17.2408 17.2408 17.4262 17.4262 18.1651 18.1651 18.5746 18.5746 19.3873 19.3873 k = 0.0000 0.0677-0.0000 ( 2681 PWs) bands (ev): -44.7790 -44.7790 -44.7609 -44.7609 -19.0850 -19.0850 -19.0139 -19.0139 -11.5676 -11.5676 -11.3024 -11.3024 -11.2070 -11.2070 -11.1515 -11.1515 8.2778 8.2778 11.0777 11.0777 11.4826 11.4826 11.7534 11.7534 11.9104 11.9104 13.9040 13.9040 14.3182 14.3182 14.3972 14.3972 15.0190 15.0190 15.5871 15.5871 15.7764 15.7764 15.9590 15.9590 17.1964 17.1964 17.4456 17.4456 18.1809 18.1809 18.6009 18.6009 19.3813 19.3813 k = 0.0000 0.0580-0.0000 ( 2675 PWs) bands (ev): -44.7791 -44.7791 -44.7608 -44.7608 -19.0853 -19.0853 -19.0132 -19.0132 -11.5689 -11.5689 -11.2997 -11.2997 -11.2074 -11.2074 -11.1508 -11.1508 8.2476 8.2476 11.0724 11.0724 11.4804 11.4804 11.7406 11.7406 11.8760 11.8760 13.8908 13.8908 14.3120 14.3120 14.4037 14.4037 15.0114 15.0114 15.5981 15.5981 15.8503 15.8503 16.0053 16.0053 17.1348 17.1348 17.4753 17.4753 18.1968 18.1968 18.6240 18.6240 19.3756 19.3756 k = 0.0000 0.0483-0.0000 ( 2675 PWs) bands (ev): -44.7793 -44.7793 -44.7607 -44.7607 -19.0856 -19.0856 -19.0127 -19.0127 -11.5700 -11.5700 -11.2973 -11.2973 -11.2077 -11.2077 -11.1502 -11.1502 8.2220 8.2220 11.0679 11.0679 11.4792 11.4792 11.7296 11.7296 11.8459 11.8459 13.8793 13.8793 14.3068 14.3068 14.4089 14.4089 15.0041 15.0041 15.6046 15.6046 15.9234 15.9234 16.0493 16.0493 17.0663 17.0663 17.5062 17.5062 18.2117 18.2117 18.6438 18.6438 19.3704 19.3704 k = 0.0000 0.0387-0.0000 ( 2673 PWs) bands (ev): -44.7794 -44.7794 -44.7606 -44.7606 -19.0858 -19.0858 -19.0122 -19.0122 -11.5710 -11.5710 -11.2954 -11.2954 -11.2079 -11.2079 -11.1497 -11.1497 8.2009 8.2009 11.0641 11.0641 11.4789 11.4789 11.7205 11.7205 11.8204 11.8204 13.8697 13.8697 14.3027 14.3027 14.4129 14.4129 14.9976 14.9976 15.6089 15.6089 15.9875 15.9875 16.0948 16.0948 16.9965 16.9965 17.5343 17.5343 18.2249 18.2249 18.6603 18.6603 19.3659 19.3659 k = 0.0000 0.0290-0.0000 ( 2673 PWs) bands (ev): -44.7794 -44.7794 -44.7606 -44.7606 -19.0860 -19.0860 -19.0119 -19.0119 -11.5717 -11.5717 -11.2938 -11.2938 -11.2081 -11.2081 -11.1494 -11.1494 8.1845 8.1845 11.0612 11.0612 11.4791 11.4791 11.7134 11.7134 11.7999 11.7999 13.8621 13.8621 14.2996 14.2996 14.4158 14.4158 14.9922 14.9922 15.6119 15.6119 16.0344 16.0344 16.1454 16.1454 16.9298 16.9298 17.5577 17.5577 18.2357 18.2357 18.6732 18.6732 19.3621 19.3621 k = 0.0000 0.0193-0.0000 ( 2677 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0862 -19.0862 -19.0117 -19.0117 -11.5722 -11.5722 -11.2928 -11.2928 -11.2083 -11.2083 -11.1492 -11.1492 8.1727 8.1727 11.0591 11.0591 11.4795 11.4795 11.7083 11.7083 11.7849 11.7849 13.8566 13.8566 14.2975 14.2975 14.4178 14.4178 14.9882 14.9882 15.6139 15.6139 16.0635 16.0635 16.1961 16.1961 16.8720 16.8720 17.5751 17.5751 18.2437 18.2437 18.6825 18.6825 19.3592 19.3592 k = 0.0000 0.0097-0.0000 ( 2677 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0863 -19.0863 -19.0115 -19.0115 -11.5725 -11.5725 -11.2921 -11.2921 -11.2084 -11.2084 -11.1490 -11.1490 8.1657 8.1657 11.0578 11.0578 11.4799 11.4799 11.7052 11.7052 11.7758 11.7758 13.8533 13.8533 14.2962 14.2962 14.4190 14.4190 14.9858 14.9858 15.6151 15.6151 16.0790 16.0790 16.2349 16.2349 16.8310 16.8310 17.5858 17.5858 18.2486 18.2486 18.6882 18.6882 19.3575 19.3575 k = 0.0000 0.0000 0.0000 ( 2675 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0864 -19.0864 -19.0114 -19.0114 -11.5726 -11.5726 -11.2918 -11.2918 -11.2084 -11.2084 -11.1489 -11.1489 8.1633 8.1633 11.0574 11.0574 11.4800 11.4800 11.7042 11.7042 11.7727 11.7727 13.8522 13.8522 14.2958 14.2958 14.4193 14.4193 14.9849 14.9849 15.6155 15.6155 16.0839 16.0839 16.2495 16.2495 16.8158 16.8158 17.5894 17.5894 18.2503 18.2503 18.6900 18.6900 19.3569 19.3569 k = 0.0000 0.0000 0.0000 ( 2675 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0864 -19.0864 -19.0114 -19.0114 -11.5726 -11.5726 -11.2918 -11.2918 -11.2084 -11.2084 -11.1489 -11.1489 8.1633 8.1633 11.0574 11.0574 11.4800 11.4800 11.7042 11.7042 11.7727 11.7727 13.8522 13.8522 14.2958 14.2958 14.4193 14.4193 14.9849 14.9849 15.6155 15.6155 16.0839 16.0839 16.2495 16.2495 16.8158 16.8158 17.5894 17.5894 18.2503 18.2503 18.6900 18.6900 19.3569 19.3569 k = 0.0000 0.0000 0.0097 ( 2673 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0863 -19.0863 -19.0114 -19.0114 -11.5725 -11.5725 -11.2920 -11.2920 -11.2084 -11.2084 -11.1489 -11.1489 8.1656 8.1656 11.0579 11.0579 11.4808 11.4808 11.7050 11.7050 11.7741 11.7741 13.8527 13.8527 14.2965 14.2965 14.4191 14.4191 14.9847 14.9847 15.6154 15.6154 16.0774 16.0774 16.2427 16.2427 16.8174 16.8174 17.5947 17.5947 18.2490 18.2490 18.6884 18.6884 19.3564 19.3564 k = 0.0000 0.0000 0.0193 ( 2669 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0861 -19.0861 -19.0116 -19.0116 -11.5721 -11.5721 -11.2926 -11.2926 -11.2082 -11.2082 -11.1491 -11.1491 8.1724 8.1724 11.0594 11.0594 11.4832 11.4832 11.7074 11.7074 11.7785 11.7785 13.8542 13.8542 14.2988 14.2988 14.4183 14.4183 14.9840 14.9840 15.6151 15.6151 16.0584 16.0584 16.2225 16.2225 16.8219 16.8219 17.6103 17.6103 18.2450 18.2450 18.6834 18.6834 19.3550 19.3550 k = 0.0000 0.0000 0.0290 ( 2665 PWs) bands (ev): -44.7795 -44.7795 -44.7605 -44.7605 -19.0859 -19.0859 -19.0118 -19.0118 -11.5714 -11.5714 -11.2935 -11.2935 -11.2081 -11.2081 -11.1493 -11.1493 8.1836 8.1836 11.0618 11.0618 11.4873 11.4873 11.7115 11.7115 11.7858 11.7858 13.8568 13.8568 14.3022 14.3022 14.4171 14.4171 14.9828 14.9828 15.6143 15.6143 16.0280 16.0280 16.1901 16.1901 16.8285 16.8285 17.6352 17.6352 18.2385 18.2385 18.6752 18.6752 19.3526 19.3526 k = 0.0000 0.0000 0.0387 ( 2673 PWs) bands (ev): -44.7794 -44.7794 -44.7606 -44.7606 -19.0858 -19.0858 -19.0121 -19.0121 -11.5707 -11.5707 -11.2948 -11.2948 -11.2080 -11.2080 -11.1497 -11.1497 8.1994 8.1994 11.0649 11.0649 11.4930 11.4930 11.7172 11.7172 11.7960 11.7960 13.8602 13.8602 14.3065 14.3065 14.4158 14.4158 14.9811 14.9811 15.6127 15.6127 15.9880 15.9880 16.1471 16.1471 16.8360 16.8360 17.6677 17.6677 18.2296 18.2296 18.6638 18.6638 19.3493 19.3493 k = 0.0000 0.0000 0.0483 ( 2679 PWs) bands (ev): -44.7793 -44.7793 -44.7607 -44.7607 -19.0856 -19.0856 -19.0126 -19.0126 -11.5697 -11.5697 -11.2965 -11.2965 -11.2079 -11.2079 -11.1502 -11.1502 8.2196 8.2196 11.0683 11.0683 11.5007 11.5007 11.7244 11.7244 11.8091 11.8091 13.8646 13.8646 14.3110 14.3110 14.4150 14.4150 14.9788 14.9788 15.6096 15.6096 15.9403 15.9403 16.0956 16.0956 16.8436 16.8436 17.7062 17.7062 18.2184 18.2184 18.6494 18.6494 19.3451 19.3451 k = 0.0000 0.0000 0.0580 ( 2675 PWs) bands (ev): -44.7792 -44.7792 -44.7608 -44.7608 -19.0852 -19.0852 -19.0130 -19.0130 -11.5683 -11.5683 -11.2985 -11.2985 -11.2077 -11.2077 -11.1507 -11.1507 8.2443 8.2443 11.0718 11.0718 11.5105 11.5105 11.7331 11.7331 11.8251 11.8251 13.8699 13.8699 14.3146 14.3146 14.4155 14.4155 14.9759 14.9759 15.6038 15.6038 15.8876 15.8876 16.0377 16.0377 16.8502 16.8502 17.7492 17.7492 18.2051 18.2051 18.6321 18.6321 19.3401 19.3401 k = 0.0000 0.0000 0.0677 ( 2675 PWs) bands (ev): -44.7791 -44.7791 -44.7609 -44.7609 -19.0848 -19.0848 -19.0136 -19.0136 -11.5668 -11.5668 -11.3008 -11.3008 -11.2074 -11.2074 -11.1513 -11.1513 8.2733 8.2733 11.0749 11.0749 11.5225 11.5225 11.7433 11.7433 11.8440 11.8440 13.8759 13.8759 14.3161 14.3161 14.4184 14.4184 14.9723 14.9723 15.5930 15.5930 15.8324 15.8324 15.9759 15.9759 16.8552 16.8552 17.7950 17.7950 18.1899 18.1899 18.6122 18.6122 19.3341 19.3341 k = 0.0000 0.0000 0.0773 ( 2669 PWs) bands (ev): -44.7789 -44.7789 -44.7610 -44.7610 -19.0843 -19.0843 -19.0141 -19.0141 -11.5650 -11.5650 -11.3034 -11.3034 -11.2071 -11.2071 -11.1520 -11.1520 8.3066 8.3066 11.0772 11.0772 11.5369 11.5369 11.7548 11.7548 11.8656 11.8656 13.8826 13.8826 14.3140 14.3140 14.4247 14.4247 14.9679 14.9679 15.5740 15.5740 15.7774 15.7774 15.9138 15.9138 16.8580 16.8580 17.8425 17.8425 18.1731 18.1731 18.5899 18.5899 19.3274 19.3274 k = 0.0000 0.0000 0.0870 ( 2669 PWs) bands (ev): -44.7788 -44.7788 -44.7611 -44.7611 -19.0838 -19.0838 -19.0148 -19.0148 -11.5630 -11.5630 -11.3064 -11.3064 -11.2068 -11.2068 -11.1528 -11.1528 8.3441 8.3441 11.0782 11.0782 11.5538 11.5538 11.7677 11.7677 11.8901 11.8901 13.8898 13.8898 14.3078 14.3078 14.4349 14.4349 14.9628 14.9628 15.5427 15.5427 15.7235 15.7235 15.8572 15.8572 16.8583 16.8583 17.8904 17.8904 18.1549 18.1549 18.5655 18.5655 19.3199 19.3199 k = 0.0000 0.0000 0.0966 ( 2673 PWs) bands (ev): -44.7786 -44.7786 -44.7613 -44.7613 -19.0833 -19.0833 -19.0156 -19.0156 -11.5609 -11.5609 -11.3097 -11.3097 -11.2065 -11.2065 -11.1537 -11.1537 8.3857 8.3857 11.0774 11.0774 11.5735 11.5735 11.7819 11.7819 11.9174 11.9174 13.8975 13.8975 14.2974 14.2974 14.4484 14.4484 14.9568 14.9568 15.4977 15.4977 15.6667 15.6667 15.8137 15.8137 16.8560 16.8560 17.9378 17.9378 18.1357 18.1357 18.5393 18.5393 19.3117 19.3117 k = 0.0000 0.0000 0.1063 ( 2679 PWs) bands (ev): -44.7785 -44.7785 -44.7614 -44.7614 -19.0827 -19.0827 -19.0166 -19.0166 -11.5585 -11.5585 -11.3134 -11.3134 -11.2061 -11.2061 -11.1547 -11.1547 8.4314 8.4314 11.0744 11.0744 11.5958 11.5958 11.7972 11.7972 11.9473 11.9473 13.9053 13.9053 14.2831 14.2831 14.4646 14.4646 14.9500 14.9500 15.4419 15.4419 15.6026 15.6026 15.7872 15.7872 16.8511 16.8511 17.9836 17.9836 18.1160 18.1160 18.5120 18.5120 19.3028 19.3028 k = 0.0000 0.0000 0.1160 ( 2683 PWs) bands (ev): -44.7783 -44.7783 -44.7616 -44.7616 -19.0821 -19.0821 -19.0175 -19.0175 -11.5559 -11.5559 -11.3173 -11.3173 -11.2057 -11.2057 -11.1557 -11.1557 8.4810 8.4810 11.0688 11.0688 11.6208 11.6208 11.8135 11.8135 11.9799 11.9799 13.9131 13.9131 14.2654 14.2654 14.4827 14.4827 14.9422 14.9422 15.3795 15.3795 15.5323 15.5323 15.7743 15.7743 16.8436 16.8436 18.0263 18.0263 18.0967 18.0967 18.4840 18.4840 19.2933 19.2933 k = 0.0000 0.0000 0.1256 ( 2685 PWs) bands (ev): -44.7781 -44.7781 -44.7618 -44.7618 -19.0813 -19.0813 -19.0185 -19.0185 -11.5530 -11.5530 -11.3215 -11.3215 -11.2051 -11.2051 -11.1568 -11.1568 8.5345 8.5345 11.0601 11.0601 11.6483 11.6483 11.8309 11.8309 12.0150 12.0150 13.9203 13.9203 14.2447 14.2447 14.5016 14.5016 14.9335 14.9335 15.3142 15.3142 15.4595 15.4595 15.7696 15.7696 16.8338 16.8338 18.0566 18.0566 18.0866 18.0866 18.4562 18.4562 19.2832 19.2832 k = 0.0000 0.0000 0.1353 ( 2679 PWs) bands (ev): -44.7778 -44.7778 -44.7620 -44.7620 -19.0805 -19.0805 -19.0195 -19.0195 -11.5500 -11.5500 -11.3258 -11.3258 -11.2046 -11.2046 -11.1579 -11.1579 8.5916 8.5916 11.0482 11.0482 11.6782 11.6782 11.8491 11.8491 12.0527 12.0527 13.9266 13.9266 14.2217 14.2217 14.5203 14.5203 14.9239 14.9239 15.2481 15.2481 15.3876 15.3876 15.7697 15.7697 16.8218 16.8218 18.0473 18.0473 18.1117 18.1117 18.4298 18.4298 19.2725 19.2725 k = 0.0000 0.0000 0.1450 ( 2681 PWs) bands (ev): -44.7776 -44.7776 -44.7622 -44.7622 -19.0797 -19.0797 -19.0206 -19.0206 -11.5468 -11.5468 -11.3304 -11.3304 -11.2041 -11.2041 -11.1590 -11.1590 8.6523 8.6523 11.0326 11.0326 11.7100 11.7100 11.8682 11.8682 12.0928 12.0928 13.9309 13.9309 14.1973 14.1973 14.5376 14.5376 14.9134 14.9134 15.1823 15.1823 15.3196 15.3196 15.7725 15.7725 16.8080 16.8080 18.0280 18.0280 18.1410 18.1410 18.4066 18.4066 19.2614 19.2614 k = 0.0000 0.0000 0.1546 ( 2675 PWs) bands (ev): -44.7773 -44.7773 -44.7624 -44.7624 -19.0788 -19.0788 -19.0216 -19.0216 -11.5433 -11.5433 -11.3351 -11.3351 -11.2035 -11.2035 -11.1603 -11.1603 8.7163 8.7163 11.0131 11.0131 11.7435 11.7435 11.8878 11.8878 12.1351 12.1351 13.9320 13.9320 14.1727 14.1727 14.5518 14.5518 14.9020 14.9020 15.1179 15.1179 15.2579 15.2579 15.7770 15.7770 16.7928 16.7928 18.0081 18.0081 18.1626 18.1626 18.3895 18.3895 19.2497 19.2497 k = 0.0000 0.0000 0.1643 ( 2675 PWs) bands (ev): -44.7771 -44.7771 -44.7626 -44.7626 -19.0779 -19.0779 -19.0228 -19.0228 -11.5397 -11.5397 -11.3400 -11.3400 -11.2028 -11.2028 -11.1615 -11.1615 8.7835 8.7835 10.9896 10.9896 11.7781 11.7781 11.9081 11.9081 12.1796 12.1796 13.9282 13.9282 14.1501 14.1501 14.5605 14.5605 14.8898 14.8898 15.0561 15.0561 15.2049 15.2049 15.7822 15.7822 16.7764 16.7764 17.9885 17.9885 18.1723 18.1723 18.3818 18.3818 19.2373 19.2373 k = 0.0000 0.0000 0.1740 ( 2683 PWs) bands (ev): -44.7768 -44.7768 -44.7629 -44.7629 -19.0771 -19.0771 -19.0240 -19.0240 -11.5361 -11.5361 -11.3451 -11.3451 -11.2023 -11.2023 -11.1628 -11.1628 8.8538 8.8538 10.9618 10.9618 11.8133 11.8133 11.9288 11.9288 12.2261 12.2261 13.9176 13.9176 14.1315 14.1315 14.5611 14.5611 14.8768 14.8768 14.9990 14.9990 15.1619 15.1619 15.7877 15.7877 16.7593 16.7593 17.9697 17.9697 18.1686 18.1686 18.3849 18.3849 19.2236 19.2236 k = 0.0000 0.0000 0.1836 ( 2679 PWs) bands (ev): -44.7766 -44.7766 -44.7631 -44.7631 -19.0761 -19.0761 -19.0252 -19.0252 -11.5322 -11.5322 -11.3503 -11.3503 -11.2015 -11.2015 -11.1641 -11.1641 8.9268 8.9268 10.9296 10.9296 11.8487 11.8487 11.9500 11.9500 12.2745 12.2745 13.8989 13.8989 14.1185 14.1185 14.5506 14.5506 14.8633 14.8633 14.9492 14.9492 15.1301 15.1301 15.7929 15.7929 16.7420 16.7420 17.9520 17.9520 18.1538 18.1538 18.3965 18.3965 19.2057 19.2057 k = 0.0000 0.0000 0.1933 ( 2678 PWs) bands (ev): -44.7763 -44.7763 -44.7633 -44.7633 -19.0752 -19.0752 -19.0264 -19.0264 -11.5283 -11.5283 -11.3555 -11.3555 -11.2008 -11.2008 -11.1654 -11.1654 9.0023 9.0023 10.8929 10.8929 11.8834 11.8834 11.9715 11.9715 12.3244 12.3244 13.8727 13.8727 14.1109 14.1109 14.5275 14.5275 14.8492 14.8492 14.9084 14.9084 15.1097 15.1097 15.7976 15.7976 16.7247 16.7247 17.9353 17.9353 18.1319 18.1319 18.4124 18.4124 19.1578 19.1578 k = 0.0000 0.0000 0.2030 ( 2678 PWs) bands (ev): -44.7761 -44.7761 -44.7635 -44.7635 -19.0742 -19.0742 -19.0276 -19.0276 -11.5242 -11.5242 -11.3608 -11.3608 -11.2000 -11.2000 -11.1667 -11.1667 9.0800 9.0800 10.8517 10.8517 11.9168 11.9168 11.9935 11.9935 12.3757 12.3757 13.8408 13.8408 14.1069 14.1069 14.4929 14.4929 14.8348 14.8348 14.8762 14.8762 15.1004 15.1004 15.8013 15.8013 16.7078 16.7078 17.9200 17.9200 18.1062 18.1062 18.4288 18.4288 19.0509 19.0509 k = 0.0000 0.0000 0.2126 ( 2682 PWs) bands (ev): -44.7758 -44.7758 -44.7638 -44.7638 -19.0733 -19.0733 -19.0288 -19.0288 -11.5202 -11.5202 -11.3662 -11.3662 -11.1993 -11.1993 -11.1679 -11.1679 9.1597 9.1597 10.8060 10.8060 11.9480 11.9480 12.0160 12.0160 12.4280 12.4280 13.8052 13.8052 14.1040 14.1040 14.4510 14.4510 14.8199 14.8199 14.8510 14.8510 15.1011 15.1011 15.8041 15.8041 16.6918 16.6918 17.9060 17.9060 18.0787 18.0787 18.4429 18.4429 18.9400 18.9400 k = 0.0000 0.0000 0.2223 ( 2674 PWs) bands (ev): -44.7756 -44.7756 -44.7640 -44.7640 -19.0722 -19.0722 -19.0299 -19.0299 -11.5161 -11.5161 -11.3713 -11.3713 -11.1984 -11.1984 -11.1692 -11.1692 9.2409 9.2409 10.7559 10.7559 11.9762 11.9762 12.0392 12.0392 12.4810 12.4810 13.7681 13.7681 14.0993 14.0993 14.4073 14.4073 14.8044 14.8044 14.8309 14.8309 15.1098 15.1098 15.8056 15.8056 16.6769 16.6769 17.8934 17.8934 18.0509 18.0509 18.4513 18.4513 18.8409 18.8409 k = 0.0000 0.0000 0.2319 ( 2670 PWs) bands (ev): -44.7753 -44.7753 -44.7642 -44.7642 -19.0713 -19.0713 -19.0310 -19.0310 -11.5120 -11.5120 -11.3763 -11.3763 -11.1976 -11.1976 -11.1704 -11.1704 9.3232 9.3232 10.7018 10.7018 12.0010 12.0010 12.0627 12.0627 12.5339 12.5339 13.7306 13.7306 14.0898 14.0898 14.3673 14.3673 14.7886 14.7886 14.8145 14.8145 15.1241 15.1241 15.8059 15.8059 16.6634 16.6634 17.8820 17.8820 18.0236 18.0236 18.4500 18.4500 18.7596 18.7596 k = 0.0000 0.0000 0.2416 ( 2666 PWs) bands (ev): -44.7751 -44.7751 -44.7644 -44.7644 -19.0704 -19.0704 -19.0320 -19.0320 -11.5080 -11.5080 -11.3812 -11.3812 -11.1967 -11.1967 -11.1716 -11.1716 9.4060 9.4060 10.6440 10.6440 12.0223 12.0223 12.0859 12.0859 12.5863 12.5863 13.6939 13.6939 14.0732 14.0732 14.3358 14.3358 14.7728 14.7728 14.8008 14.8008 15.1420 15.1420 15.8050 15.8050 16.6514 16.6514 17.8716 17.8716 17.9978 17.9978 18.4340 18.4340 18.7019 18.7019 k = 0.0000 0.0000 0.2513 ( 2666 PWs) bands (ev): -44.7749 -44.7749 -44.7646 -44.7646 -19.0695 -19.0695 -19.0330 -19.0330 -11.5042 -11.5042 -11.3858 -11.3858 -11.1959 -11.1959 -11.1728 -11.1728 9.4886 9.4886 10.5832 10.5832 12.0403 12.0403 12.1079 12.1079 12.6371 12.6371 13.6587 13.6587 14.0491 14.0491 14.3147 14.3147 14.7578 14.7578 14.7892 14.7892 15.1614 15.1614 15.8030 15.8030 16.6411 16.6411 17.8620 17.8620 17.9744 17.9744 18.4022 18.4022 18.6693 18.6693 k = 0.0000 0.0000 0.2609 ( 2666 PWs) bands (ev): -44.7747 -44.7747 -44.7648 -44.7648 -19.0687 -19.0687 -19.0339 -19.0339 -11.5007 -11.5007 -11.3900 -11.3900 -11.1952 -11.1952 -11.1738 -11.1738 9.5700 9.5700 10.5203 10.5203 12.0553 12.0553 12.1279 12.1279 12.6853 12.6853 13.6257 13.6257 14.0200 14.0200 14.3032 14.3032 14.7440 14.7440 14.7795 14.7795 15.1808 15.1808 15.8002 15.8002 16.6325 16.6325 17.8529 17.8529 17.9542 17.9542 18.3614 18.3614 18.6553 18.6553 k = 0.0000 0.0000 0.2706 ( 2666 PWs) bands (ev): -44.7746 -44.7746 -44.7649 -44.7649 -19.0681 -19.0681 -19.0347 -19.0347 -11.4976 -11.4976 -11.3937 -11.3937 -11.1945 -11.1945 -11.1748 -11.1748 9.6486 9.6486 10.4567 10.4567 12.0675 12.0675 12.1450 12.1450 12.7292 12.7292 13.5956 13.5956 13.9901 13.9901 14.2983 14.2983 14.7320 14.7320 14.7716 14.7716 15.1988 15.1988 15.7970 15.7970 16.6257 16.6257 17.8439 17.8439 17.9380 17.9380 18.3203 18.3203 18.6514 18.6514 k = 0.0000 0.0000 0.2803 ( 2666 PWs) bands (ev): -44.7744 -44.7744 -44.7650 -44.7650 -19.0675 -19.0675 -19.0353 -19.0353 -11.4950 -11.4950 -11.3968 -11.3968 -11.1939 -11.1939 -11.1756 -11.1756 9.7219 9.7219 10.3951 10.3951 12.0770 12.0770 12.1589 12.1589 12.7671 12.7671 13.5696 13.5696 13.9632 13.9632 14.2973 14.2973 14.7221 14.7221 14.7654 14.7654 15.2141 15.2141 15.7939 15.7939 16.6205 16.6205 17.8354 17.8354 17.9262 17.9262 18.2850 18.2850 18.6518 18.6518 k = 0.0000 0.0000 0.2899 ( 2664 PWs) bands (ev): -44.7743 -44.7743 -44.7651 -44.7651 -19.0672 -19.0672 -19.0357 -19.0357 -11.4930 -11.4930 -11.3991 -11.3991 -11.1934 -11.1934 -11.1762 -11.1762 9.7855 9.7855 10.3399 10.3399 12.0838 12.0838 12.1690 12.1690 12.7967 12.7967 13.5491 13.5491 13.9423 13.9423 14.2978 14.2978 14.7146 14.7146 14.7609 14.7609 15.2259 15.2259 15.7912 15.7912 16.6169 16.6169 17.8281 17.8281 17.9186 17.9186 18.2583 18.2583 18.6535 18.6535 k = 0.0000 0.0000 0.2996 ( 2668 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0361 -19.0361 -11.4918 -11.4918 -11.4005 -11.4005 -11.1932 -11.1932 -11.1766 -11.1766 9.8314 9.8314 10.2990 10.2990 12.0879 12.0879 12.1752 12.1752 12.8156 12.8156 13.5357 13.5357 13.9290 13.9290 14.2987 14.2987 14.7100 14.7100 14.7582 14.7582 15.2332 15.2332 15.7893 15.7893 16.6148 16.6148 17.8232 17.8232 17.9144 17.9144 18.2418 18.2418 18.6551 18.6551 k = 0.0000 0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0362 -19.0362 -11.4914 -11.4914 -11.4010 -11.4010 -11.1931 -11.1931 -11.1768 -11.1768 9.8487 9.8487 10.2834 10.2834 12.0893 12.0893 12.1772 12.1772 12.8221 12.8221 13.5311 13.5311 13.9245 13.9245 14.2990 14.2990 14.7084 14.7084 14.7573 14.7573 15.2358 15.2358 15.7887 15.7887 16.6141 16.6141 17.8214 17.8214 17.9131 17.9131 18.2363 18.2363 18.6556 18.6556 k = 0.0000 0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0362 -19.0362 -11.4914 -11.4914 -11.4010 -11.4010 -11.1931 -11.1931 -11.1768 -11.1768 9.8487 9.8487 10.2834 10.2834 12.0893 12.0893 12.1772 12.1772 12.8221 12.8221 13.5311 13.5311 13.9245 13.9245 14.2990 14.2990 14.7084 14.7084 14.7573 14.7573 15.2358 15.2358 15.7887 15.7887 16.6141 16.6141 17.8214 17.8214 17.9131 17.9131 18.2363 18.2363 18.6556 18.6556 k = 0.0096-0.0000 0.3093 ( 2668 PWs) bands (ev): -44.7742 -44.7742 -44.7651 -44.7651 -19.0670 -19.0670 -19.0362 -19.0362 -11.4913 -11.4913 -11.4009 -11.4009 -11.1935 -11.1935 -11.1772 -11.1772 9.8508 9.8508 10.2855 10.2855 12.0912 12.0912 12.1794 12.1794 12.8225 12.8225 13.5300 13.5300 13.9241 13.9241 14.2979 14.2979 14.7075 14.7075 14.7566 14.7566 15.2271 15.2271 15.7848 15.7848 16.6236 16.6236 17.8247 17.8247 17.9156 17.9156 18.2391 18.2391 18.6548 18.6548 k = 0.0192-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7741 -44.7741 -44.7651 -44.7651 -19.0673 -19.0673 -19.0365 -19.0365 -11.4911 -11.4911 -11.4007 -11.4007 -11.1950 -11.1950 -11.1786 -11.1786 9.8572 9.8572 10.2921 10.2921 12.0970 12.0970 12.1860 12.1860 12.8235 12.8235 13.5266 13.5266 13.9228 13.9228 14.2946 14.2946 14.7048 14.7048 14.7543 14.7543 15.2019 15.2019 15.7733 15.7733 16.6517 16.6517 17.8343 17.8343 17.9233 17.9233 18.2476 18.2476 18.6524 18.6524 k = 0.0288-0.0000 0.3093 ( 2674 PWs) bands (ev): -44.7740 -44.7740 -44.7649 -44.7649 -19.0677 -19.0677 -19.0370 -19.0370 -11.4907 -11.4907 -11.4004 -11.4004 -11.1973 -11.1973 -11.1809 -11.1809 9.8677 9.8677 10.3030 10.3030 12.1067 12.1067 12.1969 12.1969 12.8252 12.8252 13.5210 13.5210 13.9207 13.9207 14.2891 14.2891 14.7003 14.7003 14.7506 14.7506 15.1622 15.1622 15.7542 15.7542 16.6962 16.6962 17.8500 17.8500 17.9360 17.9360 18.2618 18.2618 18.6484 18.6484 k = 0.0385-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7738 -44.7738 -44.7647 -44.7647 -19.0683 -19.0683 -19.0376 -19.0376 -11.4901 -11.4901 -11.4000 -11.4000 -11.2004 -11.2004 -11.1841 -11.1841 9.8824 9.8824 10.3182 10.3182 12.1202 12.1202 12.2122 12.2122 12.8275 12.8275 13.5131 13.5131 13.9178 13.9178 14.2815 14.2815 14.6940 14.6940 14.7452 14.7452 15.1109 15.1109 15.7282 15.7282 16.7546 16.7546 17.8714 17.8714 17.9537 17.9537 18.2817 18.2817 18.6430 18.6430 k = 0.0481-0.0000 0.3093 ( 2674 PWs) bands (ev): -44.7735 -44.7735 -44.7644 -44.7644 -19.0690 -19.0690 -19.0384 -19.0384 -11.4894 -11.4894 -11.3994 -11.3994 -11.2045 -11.2045 -11.1882 -11.1882 9.9012 9.9012 10.3378 10.3378 12.1374 12.1374 12.2317 12.2317 12.8305 12.8305 13.5029 13.5029 13.9141 13.9141 14.2718 14.2718 14.6858 14.6858 14.7381 14.7381 15.0508 15.0508 15.6957 15.6957 16.8242 16.8242 17.8978 17.8978 17.9762 17.9762 18.3070 18.3070 18.6364 18.6364 k = 0.0577-0.0000 0.3093 ( 2674 PWs) bands (ev): -44.7732 -44.7732 -44.7641 -44.7641 -19.0699 -19.0699 -19.0394 -19.0394 -11.4886 -11.4886 -11.3987 -11.3987 -11.2094 -11.2094 -11.1932 -11.1932 9.9241 9.9241 10.3615 10.3615 12.1582 12.1582 12.2554 12.2554 12.8341 12.8341 13.4906 13.4906 13.9098 13.9098 14.2602 14.2602 14.6757 14.6757 14.7289 14.7289 14.9848 14.9848 15.6575 15.6575 16.9025 16.9025 17.9287 17.9287 18.0032 18.0032 18.3375 18.3375 18.6290 18.6290 k = 0.0673-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7728 -44.7728 -44.7637 -44.7637 -19.0710 -19.0710 -19.0406 -19.0406 -11.4876 -11.4876 -11.3979 -11.3979 -11.2152 -11.2152 -11.1990 -11.1990 9.9510 9.9510 10.3894 10.3894 12.1827 12.1827 12.2831 12.2831 12.8383 12.8383 13.4760 13.4760 13.9049 13.9049 14.2468 14.2468 14.6637 14.6637 14.7168 14.7168 14.9160 14.9160 15.6143 15.6143 16.9874 16.9874 17.9637 17.9637 18.0346 18.0346 18.3721 18.3721 18.6217 18.6217 k = 0.0769-0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7724 -44.7724 -44.7633 -44.7633 -19.0721 -19.0721 -19.0419 -19.0419 -11.4864 -11.4864 -11.3969 -11.3969 -11.2218 -11.2218 -11.2057 -11.2057 9.9819 9.9819 10.4214 10.4214 12.2107 12.2107 12.3148 12.3148 12.8430 12.8430 13.4593 13.4593 13.8995 13.8995 14.2316 14.2316 14.6492 14.6492 14.6998 14.6998 14.8484 14.8484 15.5670 15.5670 17.0772 17.0772 18.0023 18.0023 18.0700 18.0700 18.4090 18.4090 18.6166 18.6166 k = 0.0865-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7719 -44.7719 -44.7628 -44.7628 -19.0736 -19.0736 -19.0434 -19.0434 -11.4852 -11.4852 -11.3958 -11.3958 -11.2292 -11.2292 -11.2131 -11.2131 10.0167 10.0167 10.4573 10.4573 12.2421 12.2421 12.3503 12.3503 12.8483 12.8483 13.4405 13.4405 13.8935 13.8935 14.2148 14.2148 14.6309 14.6309 14.6737 14.6737 14.7891 14.7891 15.5164 15.5164 17.1704 17.1704 18.0439 18.0439 18.1092 18.1092 18.4437 18.4437 18.6179 18.6179 k = 0.0962-0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7714 -44.7714 -44.7622 -44.7622 -19.0751 -19.0751 -19.0449 -19.0449 -11.4838 -11.4838 -11.3946 -11.3946 -11.2374 -11.2374 -11.2212 -11.2212 10.0553 10.0553 10.4971 10.4971 12.2767 12.2767 12.3893 12.3893 12.8541 12.8541 13.4198 13.4198 13.8871 13.8871 14.1965 14.1965 14.6009 14.6009 14.6391 14.6391 14.7467 14.7467 15.4632 15.4632 17.2659 17.2659 18.0880 18.0880 18.1520 18.1520 18.4693 18.4693 18.6328 18.6328 k = 0.1058-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7708 -44.7708 -44.7617 -44.7617 -19.0768 -19.0768 -19.0467 -19.0467 -11.4823 -11.4823 -11.3933 -11.3933 -11.2463 -11.2463 -11.2301 -11.2301 10.0975 10.0975 10.5407 10.5407 12.3145 12.3145 12.4318 12.4318 12.8604 12.8604 13.3973 13.3973 13.8803 13.8803 14.1768 14.1768 14.5460 14.5460 14.6116 14.6116 14.7197 14.7197 15.4081 15.4081 17.3627 17.3627 18.1338 18.1338 18.1975 18.1975 18.4810 18.4810 18.6667 18.6667 k = 0.1154-0.0000 0.3093 ( 2680 PWs) bands (ev): -44.7702 -44.7702 -44.7610 -44.7610 -19.0786 -19.0786 -19.0487 -19.0487 -11.4806 -11.4806 -11.3920 -11.3920 -11.2558 -11.2558 -11.2398 -11.2398 10.1433 10.1433 10.5879 10.5879 12.3552 12.3552 12.4773 12.4773 12.8671 12.8671 13.3730 13.3730 13.8731 13.8731 14.1555 14.1555 14.4773 14.4773 14.5890 14.5890 14.7000 14.7000 15.3518 15.3518 17.4600 17.4600 18.1805 18.1805 18.2432 18.2432 18.4847 18.4847 18.7159 18.7159 k = 0.1250-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7695 -44.7695 -44.7603 -44.7603 -19.0805 -19.0805 -19.0507 -19.0507 -11.4788 -11.4788 -11.3906 -11.3906 -11.2659 -11.2659 -11.2500 -11.2500 10.1926 10.1926 10.6385 10.6385 12.3987 12.3987 12.5256 12.5256 12.8743 12.8743 13.3473 13.3473 13.8655 13.8655 14.1327 14.1327 14.4053 14.4053 14.5665 14.5665 14.6832 14.6832 15.2951 15.2951 17.5572 17.5572 18.2272 18.2272 18.2830 18.2830 18.4925 18.4925 18.7735 18.7735 k = 0.1346-0.0000 0.3093 ( 2688 PWs) bands (ev): -44.7688 -44.7688 -44.7596 -44.7596 -19.0827 -19.0827 -19.0530 -19.0530 -11.4771 -11.4771 -11.3892 -11.3892 -11.2767 -11.2767 -11.2609 -11.2609 10.2451 10.2451 10.6923 10.6923 12.4448 12.4448 12.5761 12.5761 12.8820 12.8820 13.3203 13.3203 13.8575 13.8575 14.1077 14.1077 14.3342 14.3342 14.5431 14.5431 14.6676 14.6676 15.2384 15.2384 17.6535 17.6535 18.2701 18.2701 18.3103 18.3103 18.5186 18.5186 18.8333 18.8333 k = 0.1442-0.0000 0.3093 ( 2684 PWs) bands (ev): -44.7680 -44.7680 -44.7588 -44.7588 -19.0848 -19.0848 -19.0553 -19.0553 -11.4751 -11.4751 -11.3876 -11.3876 -11.2878 -11.2878 -11.2722 -11.2722 10.3008 10.3008 10.7493 10.7493 12.4934 12.4934 12.6283 12.6283 12.8903 12.8903 13.2923 13.2923 13.8493 13.8493 14.0796 14.0796 14.2665 14.2665 14.5183 14.5183 14.6524 14.6524 15.1826 15.1826 17.7482 17.7482 18.2885 18.2885 18.3415 18.3415 18.5689 18.5689 18.8885 18.8885 k = 0.1538-0.0000 0.3093 ( 2688 PWs) bands (ev): -44.7672 -44.7672 -44.7580 -44.7580 -19.0872 -19.0872 -19.0577 -19.0577 -11.4731 -11.4731 -11.3861 -11.3861 -11.2995 -11.2995 -11.2840 -11.2840 10.3594 10.3594 10.8091 10.8091 12.5441 12.5441 12.6811 12.6811 12.8994 12.8994 13.2635 13.2635 13.8410 13.8410 14.0468 14.0468 14.2052 14.2052 14.4920 14.4920 14.6375 14.6375 15.1280 15.1280 17.8402 17.8402 18.2777 18.2777 18.3881 18.3881 18.6378 18.6378 18.9313 18.9313 k = 0.1635-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7664 -44.7664 -44.7572 -44.7572 -19.0894 -19.0894 -19.0602 -19.0602 -11.4708 -11.4708 -11.3846 -11.3846 -11.3115 -11.3115 -11.2962 -11.2962 10.4207 10.4207 10.8715 10.8715 12.5968 12.5968 12.7332 12.7332 12.9099 12.9099 13.2346 13.2346 13.8327 13.8327 14.0070 14.0070 14.1531 14.1531 14.4644 14.4644 14.6227 14.6227 15.0754 15.0754 17.9269 17.9269 18.2581 18.2581 18.4390 18.4390 18.7185 18.7185 18.9565 18.9565 k = 0.1731-0.0000 0.3093 ( 2676 PWs) bands (ev): -44.7655 -44.7655 -44.7563 -44.7563 -19.0919 -19.0919 -19.0628 -19.0628 -11.4685 -11.4685 -11.3834 -11.3834 -11.3238 -11.3238 -11.3087 -11.3087 10.4846 10.4846 10.9363 10.9363 12.6513 12.6513 12.7821 12.7821 12.9228 12.9228 13.2060 13.2060 13.8247 13.8247 13.9600 13.9600 14.1115 14.1115 14.4354 14.4354 14.6083 14.6083 15.0251 15.0251 18.0016 18.0016 18.2426 18.2426 18.4915 18.4915 18.8069 18.8069 18.9669 18.9669 k = 0.1827-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7646 -44.7646 -44.7554 -44.7554 -19.0945 -19.0945 -19.0654 -19.0654 -11.4662 -11.4662 -11.3824 -11.3824 -11.3362 -11.3362 -11.3213 -11.3213 10.5508 10.5508 11.0031 11.0031 12.7072 12.7072 12.8241 12.8241 12.9398 12.9398 13.1792 13.1792 13.8175 13.8175 13.9081 13.9081 14.0788 14.0788 14.4051 14.4051 14.5941 14.5941 14.9777 14.9777 18.0464 18.0464 18.2513 18.2513 18.5445 18.5445 18.9002 18.9002 18.9689 18.9689 k = 0.1923-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7637 -44.7637 -44.7545 -44.7545 -19.0971 -19.0971 -19.0683 -19.0683 -11.4638 -11.4638 -11.3824 -11.3824 -11.3483 -11.3483 -11.3339 -11.3339 10.6190 10.6190 11.0715 11.0715 12.7643 12.7643 12.8552 12.8552 12.9611 12.9611 13.1568 13.1568 13.8117 13.8117 13.8551 13.8551 14.0520 14.0520 14.3737 14.3737 14.5804 14.5804 14.9335 14.9335 18.0467 18.0467 18.3002 18.3002 18.5973 18.5973 18.9623 18.9623 19.0009 19.0009 k = 0.2019-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7627 -44.7627 -44.7535 -44.7535 -19.0999 -19.0999 -19.0712 -19.0712 -11.4615 -11.4615 -11.3844 -11.3844 -11.3598 -11.3598 -11.3457 -11.3457 10.6890 10.6890 11.1414 11.1414 12.8221 12.8221 12.8751 12.8751 12.9803 12.9803 13.1438 13.1438 13.8031 13.8031 13.8088 13.8088 14.0291 14.0291 14.3416 14.3416 14.5671 14.5671 14.8929 14.8929 18.0181 18.0181 18.3740 18.3740 18.6487 18.6487 18.9581 18.9581 19.0996 19.0996 k = 0.2115-0.0000 0.3093 ( 2682 PWs) bands (ev): -44.7618 -44.7618 -44.7526 -44.7526 -19.1028 -19.1028 -19.0742 -19.0742 -11.4590 -11.4590 -11.3902 -11.3902 -11.3707 -11.3707 -11.3546 -11.3546 10.7605 10.7605 11.2122 11.2122 12.8798 12.8798 12.8869 12.8869 12.9863 12.9863 13.1469 13.1469 13.7565 13.7565 13.8083 13.8083 14.0087 14.0087 14.3093 14.3093 14.5545 14.5545 14.8561 14.8561 17.9771 17.9771 18.4561 18.4561 18.6969 18.6969 18.9528 18.9528 19.2005 19.2005 k = 0.2212-0.0000 0.3093 ( 2686 PWs) bands (ev): -44.7608 -44.7608 -44.7516 -44.7516 -19.1057 -19.1057 -19.0772 -19.0772 -11.4566 -11.4566 -11.4001 -11.4001 -11.3824 -11.3824 -11.3588 -11.3588 10.8331 10.8331 11.2835 11.2835 12.8928 12.8928 12.9358 12.9358 12.9776 12.9776 13.1642 13.1642 13.7152 13.7152 13.8133 13.8133 13.9904 13.9904 14.2773 14.2773 14.5427 14.5427 14.8232 14.8232 17.9302 17.9302 18.5397 18.5397 18.7391 18.7391 18.9506 18.9506 19.3010 19.3010 k = 0.2308-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7598 -44.7598 -44.7506 -44.7506 -19.1084 -19.1084 -19.0802 -19.0802 -11.4540 -11.4540 -11.4121 -11.4121 -11.3953 -11.3953 -11.3597 -11.3597 10.9065 10.9065 11.3548 11.3548 12.8936 12.8936 12.9517 12.9517 12.9985 12.9985 13.1861 13.1861 13.6807 13.6807 13.8249 13.8249 13.9740 13.9740 14.2466 14.2466 14.5318 14.5318 14.7943 14.7943 17.8800 17.8800 18.6208 18.6208 18.7713 18.7713 18.9557 18.9557 19.3987 19.3987 k = 0.2404-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7588 -44.7588 -44.7496 -44.7496 -19.1113 -19.1113 -19.0834 -19.0834 -11.4515 -11.4515 -11.4251 -11.4251 -11.4089 -11.4089 -11.3590 -11.3590 10.9803 10.9803 11.4256 11.4256 12.8861 12.8861 12.9342 12.9342 13.0488 13.0488 13.2068 13.2068 13.6534 13.6534 13.8440 13.8440 13.9601 13.9601 14.2179 14.2179 14.5220 14.5220 14.7695 14.7695 17.8278 17.8278 18.6946 18.6946 18.7917 18.7917 18.9716 18.9716 19.4895 19.4895 k = 0.2500-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7579 -44.7579 -44.7486 -44.7486 -19.1142 -19.1142 -19.0864 -19.0864 -11.4492 -11.4492 -11.4384 -11.4384 -11.4226 -11.4226 -11.3576 -11.3576 11.0542 11.0542 11.4955 11.4955 12.8664 12.8664 12.9227 12.9227 13.0905 13.0905 13.2283 13.2283 13.6329 13.6329 13.8677 13.8677 13.9520 13.9520 14.1928 14.1928 14.5135 14.5135 14.7487 14.7487 17.7742 17.7742 18.7468 18.7468 18.8129 18.8129 18.9971 18.9971 19.5615 19.5615 k = 0.2596-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7569 -44.7569 -44.7476 -44.7476 -19.1171 -19.1171 -19.0895 -19.0895 -11.4527 -11.4527 -11.4465 -11.4465 -11.4359 -11.4359 -11.3559 -11.3559 11.1277 11.1277 11.5637 11.5637 12.8379 12.8379 12.9163 12.9163 13.1137 13.1137 13.2592 13.2592 13.6177 13.6177 13.8836 13.8836 13.9608 13.9608 14.1727 14.1727 14.5066 14.5066 14.7318 14.7318 17.7199 17.7199 18.7570 18.7570 18.8570 18.8570 19.0268 19.0268 19.5873 19.5873 k = 0.2692-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7559 -44.7559 -44.7465 -44.7465 -19.1200 -19.1200 -19.0925 -19.0925 -11.4659 -11.4659 -11.4520 -11.4520 -11.4421 -11.4421 -11.3540 -11.3540 11.2003 11.2003 11.6297 11.6297 12.8058 12.8058 12.9106 12.9106 13.1161 13.1161 13.3033 13.3033 13.6064 13.6064 13.8813 13.8813 13.9937 13.9937 14.1604 14.1604 14.5020 14.5020 14.7190 14.7190 17.6653 17.6653 18.7464 18.7464 18.9043 18.9043 19.0555 19.0555 19.5686 19.5686 k = 0.2788-0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7549 -44.7549 -44.7456 -44.7456 -19.1230 -19.1230 -19.0956 -19.0956 -11.4795 -11.4795 -11.4650 -11.4650 -11.4403 -11.4403 -11.3519 -11.3519 11.2717 11.2717 11.6930 11.6930 12.7720 12.7720 12.9038 12.9038 13.1051 13.1051 13.3556 13.3556 13.5978 13.5978 13.8696 13.8696 14.0346 14.0346 14.1609 14.1609 14.5008 14.5008 14.7101 14.7101 17.6108 17.6108 18.7291 18.7291 18.9415 18.9415 19.0795 19.0795 19.5350 19.5350 k = 0.2885-0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7539 -44.7539 -44.7446 -44.7446 -19.1259 -19.1259 -19.0987 -19.0987 -11.4928 -11.4928 -11.4785 -11.4785 -11.4380 -11.4380 -11.3499 -11.3499 11.3414 11.3414 11.7530 11.7530 12.7377 12.7377 12.8951 12.8951 13.0876 13.0876 13.4112 13.4112 13.5913 13.5913 13.8550 13.8550 14.0670 14.0670 14.1816 14.1816 14.5051 14.5051 14.7050 14.7050 17.5568 17.5568 18.7087 18.7087 18.9650 18.9650 19.0962 19.0962 19.4983 19.4983 k = 0.2981-0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7529 -44.7529 -44.7436 -44.7436 -19.1287 -19.1287 -19.1017 -19.1017 -11.5059 -11.5059 -11.4918 -11.4918 -11.4355 -11.4355 -11.3478 -11.3478 11.4090 11.4090 11.8091 11.8091 12.7034 12.7034 12.8840 12.8840 13.0674 13.0674 13.4676 13.4676 13.5865 13.5865 13.8396 13.8396 14.0868 14.0868 14.2202 14.2202 14.5184 14.5184 14.7036 14.7036 17.5034 17.5034 18.6869 18.6869 18.9742 18.9742 19.1041 19.1041 19.4613 19.4613 k = 0.3077-0.0000 0.3093 ( 2674 PWs) bands (ev): -44.7520 -44.7520 -44.7427 -44.7427 -19.1316 -19.1316 -19.1046 -19.1046 -11.5187 -11.5187 -11.5048 -11.5048 -11.4332 -11.4332 -11.3457 -11.3457 11.4741 11.4741 11.8610 11.8610 12.6693 12.6693 12.8702 12.8702 13.0468 13.0468 13.5230 13.5230 13.5832 13.5832 13.8247 13.8247 14.1028 14.1028 14.2614 14.2614 14.5459 14.5459 14.7059 14.7059 17.4511 17.4511 18.6642 18.6642 18.9700 18.9700 19.1019 19.1019 19.4248 19.4248 k = 0.3173-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7511 -44.7511 -44.7418 -44.7418 -19.1346 -19.1346 -19.1074 -19.1074 -11.5314 -11.5314 -11.5175 -11.5175 -11.4309 -11.4309 -11.3436 -11.3436 11.5363 11.5363 11.9083 11.9083 12.6361 12.6361 12.8533 12.8533 13.0272 13.0272 13.5733 13.5733 13.5841 13.5841 13.8116 13.8116 14.1215 14.1215 14.2934 14.2934 14.5918 14.5918 14.7117 14.7117 17.4000 17.4000 18.6413 18.6413 18.9536 18.9536 19.0894 19.0894 19.3891 19.3891 k = 0.3269-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7502 -44.7502 -44.7408 -44.7408 -19.1372 -19.1372 -19.1103 -19.1103 -11.5435 -11.5435 -11.5298 -11.5298 -11.4285 -11.4285 -11.3415 -11.3415 11.5952 11.5952 11.9507 11.9507 12.6038 12.6038 12.8336 12.8336 13.0091 13.0091 13.5789 13.5789 13.6264 13.6264 13.8023 13.8023 14.1454 14.1454 14.3135 14.3135 14.6554 14.6554 14.7215 14.7215 17.3504 17.3504 18.6183 18.6183 18.9268 18.9268 19.0664 19.0664 19.3543 19.3543 k = 0.3365-0.0000 0.3093 ( 2678 PWs) bands (ev): -44.7493 -44.7493 -44.7400 -44.7400 -19.1399 -19.1399 -19.1130 -19.1130 -11.5551 -11.5551 -11.5417 -11.5417 -11.4263 -11.4263 -11.3396 -11.3396 11.6506 11.6506 11.9881 11.9881 12.5729 12.5729 12.8112 12.8112 12.9928 12.9928 13.5790 13.5790 13.6667 13.6667 13.8005 13.8005 14.1747 14.1747 14.3254 14.3254 14.7203 14.7203 14.7470 14.7470 17.3025 17.3025 18.5950 18.5950 18.8913 18.8913 19.0336 19.0336 19.3206 19.3206 k = 0.3462-0.0000 0.3093 ( 2674 PWs) bands (ev): -44.7485 -44.7485 -44.7391 -44.7391 -19.1424 -19.1424 -19.1157 -19.1157 -11.5663 -11.5663 -11.5532 -11.5532 -11.4241 -11.4241 -11.3376 -11.3376 11.7023 11.7023 12.0207 12.0207 12.5436 12.5436 12.7867 12.7867 12.9781 12.9781 13.5797 13.5797 13.6924 13.6924 13.8125 13.8125 14.2075 14.2075 14.3345 14.3345 14.7426 14.7426 14.8274 14.8274 17.2565 17.2565 18.5710 18.5710 18.8490 18.8490 18.9918 18.9918 19.2880 19.2880 k = 0.3558-0.0000 0.3093 ( 2670 PWs) bands (ev): -44.7476 -44.7476 -44.7383 -44.7383 -19.1448 -19.1448 -19.1182 -19.1182 -11.5770 -11.5770 -11.5641 -11.5641 -11.4220 -11.4220 -11.3357 -11.3357 11.7501 11.7501 12.0483 12.0483 12.5163 12.5163 12.7605 12.7605 12.9648 12.9648 13.5810 13.5810 13.7015 13.7015 13.8401 13.8401 14.2391 14.2391 14.3477 14.3477 14.7604 14.7604 14.9212 14.9212 17.2127 17.2127 18.5454 18.5454 18.8022 18.8022 18.9419 18.9419 19.2567 19.2567 k = 0.3654-0.0000 0.3093 ( 2666 PWs) bands (ev): -44.7469 -44.7469 -44.7375 -44.7375 -19.1471 -19.1471 -19.1206 -19.1206 -11.5872 -11.5872 -11.5745 -11.5745 -11.4200 -11.4200 -11.3340 -11.3340 11.7941 11.7941 12.0713 12.0713 12.4912 12.4912 12.7333 12.7333 12.9525 12.9525 13.5826 13.5826 13.7005 13.7005 13.8766 13.8766 14.2617 14.2617 14.3738 14.3738 14.7801 14.7801 15.0199 15.0199 17.1711 17.1711 18.5164 18.5164 18.7536 18.7536 18.8850 18.8850 19.2265 19.2265 k = 0.3750-0.0000 0.3093 ( 2662 PWs) bands (ev): -44.7461 -44.7461 -44.7368 -44.7368 -19.1493 -19.1493 -19.1229 -19.1229 -11.5968 -11.5968 -11.5843 -11.5843 -11.4181 -11.4181 -11.3322 -11.3322 11.8342 11.8342 12.0899 12.0899 12.4687 12.4687 12.7054 12.7054 12.9412 12.9412 13.5846 13.5846 13.6955 13.6955 13.9157 13.9157 14.2719 14.2719 14.4153 14.4153 14.8022 14.8022 15.1217 15.1217 17.1319 17.1319 18.4818 18.4818 18.7066 18.7066 18.8224 18.8224 19.1977 19.1977 k = 0.3846-0.0000 0.3093 ( 2648 PWs) bands (ev): -44.7455 -44.7455 -44.7361 -44.7361 -19.1511 -19.1511 -19.1250 -19.1250 -11.6056 -11.6056 -11.5935 -11.5935 -11.4162 -11.4162 -11.3306 -11.3306 11.8706 11.8706 12.1042 12.1042 12.4489 12.4489 12.6773 12.6773 12.9307 12.9307 13.5868 13.5868 13.6893 13.6893 13.9547 13.9547 14.2745 14.2745 14.4664 14.4664 14.8271 14.8271 15.2253 15.2253 17.0953 17.0953 18.4391 18.4391 18.6635 18.6635 18.7561 18.7561 19.1702 19.1702 k = 0.3942-0.0000 0.3093 ( 2644 PWs) bands (ev): -44.7448 -44.7448 -44.7354 -44.7354 -19.1530 -19.1530 -19.1270 -19.1270 -11.6139 -11.6139 -11.6021 -11.6021 -11.4145 -11.4145 -11.3291 -11.3291 11.9034 11.9034 12.1146 12.1146 12.4321 12.4321 12.6494 12.6494 12.9209 12.9209 13.5892 13.5892 13.6828 13.6828 13.9921 13.9921 14.2738 14.2738 14.5212 14.5212 14.8553 14.8553 15.3300 15.3300 17.0615 17.0615 18.3873 18.3873 18.6217 18.6217 18.6918 18.6918 19.1442 19.1442 k = 0.4038-0.0000 0.3093 ( 2644 PWs) bands (ev): -44.7442 -44.7442 -44.7348 -44.7348 -19.1548 -19.1548 -19.1289 -19.1289 -11.6217 -11.6217 -11.6101 -11.6101 -11.4130 -11.4130 -11.3277 -11.3277 11.9329 11.9329 12.1214 12.1214 12.4183 12.4183 12.6219 12.6219 12.9117 12.9117 13.5916 13.5916 13.6766 13.6766 14.0273 14.0273 14.2721 14.2721 14.5754 14.5754 14.8876 14.8876 15.4345 15.4345 17.0305 17.0305 18.3278 18.3278 18.5676 18.5676 18.6441 18.6441 19.1198 19.1198 k = 0.4135-0.0000 0.3093 ( 2650 PWs) bands (ev): -44.7437 -44.7437 -44.7343 -44.7343 -19.1565 -19.1565 -19.1308 -19.1308 -11.6288 -11.6288 -11.6174 -11.6174 -11.4116 -11.4116 -11.3265 -11.3265 11.9592 11.9592 12.1252 12.1252 12.4076 12.4076 12.5952 12.5952 12.9033 12.9033 13.5941 13.5941 13.6708 13.6708 14.0594 14.0594 14.2705 14.2705 14.6258 14.6258 14.9246 14.9246 15.5380 15.5380 17.0026 17.0026 18.2636 18.2636 18.4957 18.4957 18.6179 18.6179 19.0970 19.0970 k = 0.4231-0.0000 0.3093 ( 2650 PWs) bands (ev): -44.7432 -44.7432 -44.7338 -44.7338 -19.1580 -19.1580 -19.1324 -19.1324 -11.6351 -11.6351 -11.6240 -11.6240 -11.4102 -11.4102 -11.3254 -11.3254 11.9826 11.9826 12.1262 12.1262 12.3998 12.3998 12.5696 12.5696 12.8956 12.8956 13.5965 13.5965 13.6655 13.6655 14.0879 14.0879 14.2698 14.2698 14.6702 14.6702 14.9664 14.9664 15.6393 15.6393 16.9778 16.9778 18.1975 18.1975 18.4160 18.4160 18.6029 18.6029 19.0760 19.0760 k = 0.4327-0.0000 0.3093 ( 2654 PWs) bands (ev): -44.7428 -44.7428 -44.7334 -44.7334 -19.1593 -19.1593 -19.1339 -19.1339 -11.6408 -11.6408 -11.6300 -11.6300 -11.4091 -11.4091 -11.3244 -11.3244 12.0034 12.0034 12.1252 12.1252 12.3946 12.3946 12.5452 12.5452 12.8887 12.8887 13.5989 13.5989 13.6607 13.6607 14.1123 14.1123 14.2705 14.2705 14.7075 14.7075 15.0121 15.0121 15.7368 15.7368 16.9563 16.9563 18.1324 18.1324 18.3344 18.3344 18.5933 18.5933 19.0569 19.0569 k = 0.4423-0.0000 0.3093 ( 2654 PWs) bands (ev): -44.7424 -44.7424 -44.7330 -44.7330 -19.1605 -19.1605 -19.1351 -19.1351 -11.6458 -11.6458 -11.6351 -11.6351 -11.4081 -11.4081 -11.3235 -11.3235 12.0217 12.0217 12.1227 12.1227 12.3918 12.3918 12.5223 12.5223 12.8826 12.8826 13.6012 13.6012 13.6563 13.6563 14.1320 14.1320 14.2729 14.2729 14.7376 14.7376 15.0596 15.0596 15.8289 15.8289 16.9381 16.9381 18.0707 18.0707 18.2538 18.2538 18.5872 18.5872 19.0398 19.0398 k = 0.4519-0.0000 0.3093 ( 2650 PWs) bands (ev): -44.7421 -44.7421 -44.7326 -44.7326 -19.1614 -19.1614 -19.1362 -19.1362 -11.6499 -11.6499 -11.6394 -11.6394 -11.4072 -11.4072 -11.3227 -11.3227 12.0377 12.0377 12.1191 12.1191 12.3910 12.3910 12.5011 12.5011 12.8773 12.8773 13.6034 13.6034 13.6525 13.6525 14.1471 14.1471 14.2770 14.2770 14.7614 14.7614 15.1063 15.1063 15.9135 15.9135 16.9234 16.9234 18.0147 18.0147 18.1767 18.1767 18.5834 18.5834 19.0249 19.0249 k = 0.4615-0.0000 0.3093 ( 2640 PWs) bands (ev): -44.7418 -44.7418 -44.7323 -44.7323 -19.1622 -19.1622 -19.1370 -19.1370 -11.6533 -11.6533 -11.6429 -11.6429 -11.4064 -11.4064 -11.3220 -11.3220 12.0516 12.0516 12.1149 12.1149 12.3921 12.3921 12.4819 12.4819 12.8730 12.8730 13.6055 13.6055 13.6492 13.6492 14.1577 14.1577 14.2822 14.2822 14.7796 14.7796 15.1491 15.1491 15.9882 15.9882 16.9121 16.9121 17.9665 17.9665 18.1060 18.1060 18.5811 18.5811 19.0123 19.0123 k = 0.4712-0.0000 0.3093 ( 2644 PWs) bands (ev): -44.7416 -44.7416 -44.7322 -44.7322 -19.1629 -19.1629 -19.1376 -19.1376 -11.6562 -11.6562 -11.6457 -11.6457 -11.4059 -11.4059 -11.3215 -11.3215 12.0633 12.0633 12.1103 12.1103 12.3948 12.3948 12.4650 12.4650 12.8695 12.8695 13.6072 13.6072 13.6464 13.6464 14.1648 14.1648 14.2877 14.2877 14.7931 14.7931 15.1856 15.1856 16.0503 16.0503 16.9039 16.9039 17.9280 17.9280 18.0446 18.0446 18.5798 18.5798 19.0023 19.0023 k = 0.4808-0.0000 0.3093 ( 2640 PWs) bands (ev): -44.7414 -44.7414 -44.7320 -44.7320 -19.1634 -19.1634 -19.1380 -19.1380 -11.6581 -11.6581 -11.6477 -11.6477 -11.4055 -11.4055 -11.3211 -11.3211 12.0731 12.0731 12.1056 12.1056 12.3987 12.3987 12.4508 12.4508 12.8671 12.8671 13.6087 13.6087 13.6443 13.6443 14.1691 14.1691 14.2924 14.2924 14.8024 14.8024 15.2134 15.2134 16.0971 16.0971 16.8987 16.8987 17.9007 17.9007 17.9960 17.9960 18.5791 18.5791 18.9951 18.9951 k = 0.4904-0.0000 0.3093 ( 2636 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1635 -19.1635 -19.1383 -19.1383 -11.6592 -11.6592 -11.6489 -11.6489 -11.4052 -11.4052 -11.3209 -11.3209 12.0804 12.0804 12.1013 12.1013 12.4030 12.4030 12.4404 12.4404 12.8656 12.8656 13.6096 13.6096 13.6430 13.6430 14.1714 14.1714 14.2956 14.2956 14.8078 14.8078 15.2308 15.2308 16.1264 16.1264 16.8958 16.8958 17.8851 17.8851 17.9641 17.9641 18.5789 18.5789 18.9906 18.9906 k = 0.5000-0.0000 0.3093 ( 2640 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1637 -19.1637 -19.1384 -19.1384 -11.6596 -11.6596 -11.6493 -11.6493 -11.4052 -11.4052 -11.3208 -11.3208 12.0836 12.0836 12.0991 12.0991 12.4051 12.4051 12.4361 12.4361 12.8651 12.8651 13.6099 13.6099 13.6425 13.6425 14.1721 14.1721 14.2967 14.2967 14.8096 14.8096 15.2367 15.2367 16.1363 16.1363 16.8949 16.8949 17.8802 17.8802 17.9527 17.9527 18.5788 18.5788 18.9891 18.9891 k = 0.5000-0.0000 0.3093 ( 2640 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1637 -19.1637 -19.1384 -19.1384 -11.6596 -11.6596 -11.6493 -11.6493 -11.4052 -11.4052 -11.3208 -11.3208 12.0836 12.0836 12.0991 12.0991 12.4051 12.4051 12.4361 12.4361 12.8651 12.8651 13.6099 13.6099 13.6425 13.6425 14.1721 14.1721 14.2967 14.2967 14.8096 14.8096 15.2367 15.2367 16.1363 16.1363 16.8949 16.8949 17.8802 17.8802 17.9527 17.9527 18.5788 18.5788 18.9891 18.9891 k = 0.5000 0.0097 0.3093 ( 2640 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1637 -19.1637 -19.1384 -19.1384 -11.6596 -11.6596 -11.6494 -11.6494 -11.4050 -11.4050 -11.3208 -11.3208 12.0792 12.0792 12.0987 12.0987 12.3892 12.3892 12.4423 12.4423 12.8721 12.8721 13.6048 13.6048 13.6472 13.6472 14.1568 14.1568 14.3075 14.3075 14.8108 14.8108 15.2481 15.2481 16.1380 16.1380 16.8983 16.8983 17.8803 17.8803 17.9528 17.9528 18.5807 18.5807 18.9878 18.9878 k = 0.5000 0.0193 0.3093 ( 2644 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1637 -19.1637 -19.1385 -19.1385 -11.6597 -11.6597 -11.6495 -11.6495 -11.4047 -11.4047 -11.3207 -11.3207 12.0668 12.0668 12.0970 12.0970 12.3555 12.3555 12.4478 12.4478 12.8915 12.8915 13.5900 13.5900 13.6607 13.6607 14.1197 14.1197 14.3315 14.3315 14.8146 14.8146 15.2810 15.2810 16.1430 16.1430 16.9084 16.9084 17.8806 17.8806 17.9532 17.9532 18.5864 18.5864 18.9838 18.9838 k = 0.5000 0.0290 0.3093 ( 2652 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1636 -19.1636 -19.1386 -19.1386 -11.6598 -11.6598 -11.6498 -11.6498 -11.4040 -11.4040 -11.3206 -11.3206 12.0472 12.0472 12.0936 12.0936 12.3128 12.3128 12.4476 12.4476 12.9200 12.9200 13.5672 13.5672 13.6810 13.6810 14.0719 14.0719 14.3599 14.3599 14.8221 14.8221 15.3324 15.3324 16.1514 16.1514 16.9251 16.9251 17.8810 17.8810 17.9537 17.9537 18.5959 18.5959 18.9770 18.9770 k = 0.5000 0.0387 0.3093 ( 2652 PWs) bands (ev): -44.7412 -44.7412 -44.7320 -44.7320 -19.1635 -19.1635 -19.1386 -19.1386 -11.6600 -11.6600 -11.6501 -11.6501 -11.4031 -11.4031 -11.3203 -11.3203 12.0213 12.0213 12.0887 12.0887 12.2640 12.2640 12.4421 12.4421 12.9537 12.9537 13.5380 13.5380 13.7054 13.7054 14.0197 14.0197 14.3897 14.3897 14.8342 14.8342 15.3987 15.3987 16.1633 16.1633 16.9480 16.9480 17.8815 17.8815 17.9544 17.9544 18.6091 18.6091 18.9676 18.9676 k = 0.5000 0.0483 0.3093 ( 2656 PWs) bands (ev): -44.7412 -44.7412 -44.7320 -44.7320 -19.1633 -19.1633 -19.1387 -19.1387 -11.6602 -11.6602 -11.6506 -11.6506 -11.4018 -11.4018 -11.3201 -11.3201 11.9898 11.9898 12.0821 12.0821 12.2113 12.2113 12.4321 12.4321 12.9894 12.9894 13.5047 13.5047 13.7281 13.7281 13.9694 13.9694 14.4202 14.4202 14.8518 14.8518 15.4764 15.4764 16.1788 16.1788 16.9767 16.9767 17.8822 17.8822 17.9554 17.9554 18.6260 18.6260 18.9553 18.9553 k = 0.5000 0.0580 0.3093 ( 2648 PWs) bands (ev): -44.7411 -44.7411 -44.7321 -44.7321 -19.1630 -19.1630 -19.1386 -19.1386 -11.6603 -11.6603 -11.6510 -11.6510 -11.4003 -11.4003 -11.3196 -11.3196 11.9539 11.9539 12.0737 12.0737 12.1566 12.1566 12.4179 12.4179 13.0247 13.0247 13.4693 13.4693 13.7379 13.7379 13.9322 13.9322 14.4517 14.4517 14.8754 14.8754 15.5627 15.5627 16.1982 16.1982 17.0109 17.0109 17.8830 17.8830 17.9567 17.9567 18.6465 18.6465 18.9403 18.9403 k = 0.5000 0.0677 0.3093 ( 2652 PWs) bands (ev): -44.7411 -44.7411 -44.7322 -44.7322 -19.1627 -19.1627 -19.1387 -19.1387 -11.6606 -11.6606 -11.6516 -11.6516 -11.3986 -11.3986 -11.3193 -11.3193 11.9146 11.9146 12.0632 12.0632 12.1014 12.1014 12.3998 12.3998 13.0572 13.0572 13.4341 13.4341 13.7205 13.7205 13.9212 13.9212 14.4852 14.4852 14.9051 14.9051 15.6554 15.6554 16.2215 16.2215 17.0498 17.0498 17.8838 17.8838 17.9582 17.9582 18.6705 18.6705 18.9224 18.9224 k = 0.5000 0.0773 0.3093 ( 2652 PWs) bands (ev): -44.7410 -44.7410 -44.7322 -44.7322 -19.1624 -19.1624 -19.1388 -19.1388 -11.6608 -11.6608 -11.6523 -11.6523 -11.3966 -11.3966 -11.3188 -11.3188 11.8726 11.8726 12.0404 12.0404 12.0567 12.0567 12.3778 12.3778 13.0850 13.0850 13.4015 13.4015 13.6777 13.6777 13.9330 13.9330 14.5222 14.5222 14.9408 14.9408 15.7529 15.7529 16.2489 16.2489 17.0928 17.0928 17.8848 17.8848 17.9599 17.9599 18.6978 18.6978 18.9017 18.9017 k = 0.5000 0.0870 0.3093 ( 2652 PWs) bands (ev): -44.7410 -44.7410 -44.7323 -44.7323 -19.1621 -19.1621 -19.1388 -19.1388 -11.6611 -11.6611 -11.6529 -11.6529 -11.3944 -11.3944 -11.3183 -11.3183 11.8289 11.8289 11.9879 11.9879 12.0405 12.0405 12.3518 12.3518 13.1058 13.1058 13.3741 13.3741 13.6231 13.6231 13.9525 13.9525 14.5645 14.5645 14.9821 14.9821 15.8537 15.8537 16.2807 16.2807 17.1393 17.1393 17.8857 17.8857 17.9620 17.9620 18.7283 18.7283 18.8782 18.8782 k = 0.5000 0.0966 0.3093 ( 2656 PWs) bands (ev): -44.7409 -44.7409 -44.7325 -44.7325 -19.1617 -19.1617 -19.1389 -19.1389 -11.6615 -11.6615 -11.6537 -11.6537 -11.3921 -11.3921 -11.3178 -11.3178 11.7842 11.7842 11.9340 11.9340 12.0249 12.0249 12.3220 12.3220 13.1174 13.1174 13.3543 13.3543 13.5652 13.5652 13.9701 13.9701 14.6139 14.6139 15.0285 15.0285 15.9567 15.9567 16.3171 16.3171 17.1884 17.1884 17.8866 17.8866 17.9643 17.9643 18.7615 18.7615 18.8522 18.8522 k = 0.5000 0.1063 0.3093 ( 2656 PWs) bands (ev): -44.7408 -44.7408 -44.7326 -44.7326 -19.1611 -19.1611 -19.1391 -19.1391 -11.6618 -11.6618 -11.6546 -11.6546 -11.3894 -11.3894 -11.3173 -11.3173 11.7391 11.7391 11.8815 11.8815 12.0076 12.0076 12.2883 12.2883 13.1190 13.1190 13.3433 13.3433 13.5079 13.5079 13.9815 13.9815 14.6711 14.6711 15.0794 15.0794 16.0609 16.0609 16.3584 16.3584 17.2395 17.2395 17.8875 17.8875 17.9669 17.9669 18.7949 18.7949 18.8261 18.8261 k = 0.5000 0.1160 0.3093 ( 2660 PWs) bands (ev): -44.7407 -44.7407 -44.7327 -44.7327 -19.1607 -19.1607 -19.1393 -19.1393 -11.6622 -11.6622 -11.6554 -11.6554 -11.3867 -11.3867 -11.3169 -11.3169 11.6941 11.6941 11.8307 11.8307 11.9884 11.9884 12.2511 12.2511 13.1117 13.1117 13.3396 13.3396 13.4536 13.4536 13.9853 13.9853 14.7363 14.7363 15.1342 15.1342 16.1652 16.1652 16.4049 16.4049 17.2917 17.2917 17.8884 17.8884 17.9697 17.9697 18.7864 18.7864 18.8419 18.8419 k = 0.5000 0.1256 0.3093 ( 2660 PWs) bands (ev): -44.7406 -44.7406 -44.7328 -44.7328 -19.1602 -19.1602 -19.1394 -19.1394 -11.6626 -11.6626 -11.6562 -11.6562 -11.3839 -11.3839 -11.3163 -11.3163 11.6499 11.6499 11.7821 11.7821 11.9671 11.9671 12.2105 12.2105 13.0988 13.0988 13.3380 13.3380 13.4055 13.4055 13.9816 13.9816 14.8085 14.8085 15.1925 15.1925 16.2685 16.2685 16.4571 16.4571 17.3443 17.3443 17.8891 17.8891 17.9727 17.9727 18.7527 18.7527 18.8828 18.8828 k = 0.5000 0.1353 0.3093 ( 2664 PWs) bands (ev): -44.7405 -44.7405 -44.7330 -44.7330 -19.1597 -19.1597 -19.1396 -19.1396 -11.6630 -11.6630 -11.6571 -11.6571 -11.3810 -11.3810 -11.3159 -11.3159 11.6067 11.6067 11.7358 11.7358 11.9438 11.9438 12.1669 12.1669 13.0833 13.0833 13.3258 13.3258 13.3740 13.3740 13.9711 13.9711 14.8866 14.8866 15.2539 15.2539 16.3691 16.3691 16.5159 16.5159 17.3965 17.3965 17.8899 17.8899 17.9759 17.9759 18.7153 18.7153 18.9272 18.9272 k = 0.5000 0.1450 0.3093 ( 2664 PWs) bands (ev): -44.7404 -44.7404 -44.7331 -44.7331 -19.1591 -19.1591 -19.1398 -19.1398 -11.6634 -11.6634 -11.6579 -11.6579 -11.3779 -11.3779 -11.3154 -11.3154 11.5650 11.5650 11.6919 11.6919 11.9185 11.9185 12.1208 12.1208 13.0674 13.0674 13.2937 13.2937 13.3670 13.3670 13.9547 13.9547 14.9694 14.9694 15.3181 15.3181 16.4645 16.4645 16.5832 16.5832 17.4475 17.4475 17.8905 17.8905 17.9792 17.9792 18.6752 18.6752 18.9741 18.9741 k = 0.5000 0.1546 0.3093 ( 2660 PWs) bands (ev): -44.7402 -44.7402 -44.7333 -44.7333 -19.1584 -19.1584 -19.1399 -19.1399 -11.6637 -11.6637 -11.6587 -11.6587 -11.3747 -11.3747 -11.3149 -11.3149 11.5252 11.5252 11.6506 11.6506 11.8912 11.8912 12.0728 12.0728 13.0523 13.0523 13.2577 13.2577 13.3673 13.3673 13.9336 13.9336 15.0554 15.0554 15.3847 15.3847 16.5524 16.5524 16.6604 16.6604 17.4966 17.4966 17.8911 17.8911 17.9826 17.9826 18.6328 18.6328 19.0232 19.0232 k = 0.5000 0.1643 0.3093 ( 2656 PWs) bands (ev): -44.7401 -44.7401 -44.7334 -44.7334 -19.1577 -19.1577 -19.1401 -19.1401 -11.6641 -11.6641 -11.6595 -11.6595 -11.3715 -11.3715 -11.3145 -11.3145 11.4874 11.4874 11.6120 11.6120 11.8621 11.8621 12.0234 12.0234 13.0386 13.0386 13.2248 13.2248 13.3675 13.3675 13.9085 13.9085 15.1436 15.1436 15.4534 15.4534 16.6327 16.6327 16.7467 16.7467 17.5430 17.5430 17.8918 17.8918 17.9859 17.9859 18.5883 18.5883 19.0742 19.0742 k = 0.5000 0.1740 0.3093 ( 2652 PWs) bands (ev): -44.7400 -44.7400 -44.7336 -44.7336 -19.1571 -19.1571 -19.1403 -19.1403 -11.6644 -11.6644 -11.6603 -11.6603 -11.3682 -11.3682 -11.3141 -11.3141 11.4520 11.4520 11.5761 11.5761 11.8312 11.8312 11.9733 11.9733 13.0265 13.0265 13.1966 13.1966 13.3661 13.3661 13.8804 13.8804 15.2330 15.2330 15.5240 15.5240 16.7087 16.7087 16.8380 16.8380 17.5861 17.5861 17.8926 17.8926 17.9889 17.9889 18.5422 18.5422 19.1268 19.1268 k = 0.5000 0.1836 0.3093 ( 2652 PWs) bands (ev): -44.7398 -44.7398 -44.7338 -44.7338 -19.1564 -19.1564 -19.1405 -19.1405 -11.6648 -11.6648 -11.6611 -11.6611 -11.3650 -11.3650 -11.3139 -11.3139 11.4191 11.4191 11.5431 11.5431 11.7987 11.7987 11.9231 11.9231 13.0161 13.0161 13.1733 13.1733 13.3626 13.3626 13.8498 13.8498 15.3227 15.3227 15.5960 15.5960 16.7829 16.7829 16.9305 16.9305 17.6251 17.6251 17.8936 17.8936 17.9916 17.9916 18.4950 18.4950 19.1809 19.1809 k = 0.5000 0.1933 0.3093 ( 2648 PWs) bands (ev): -44.7396 -44.7396 -44.7339 -44.7339 -19.1557 -19.1557 -19.1407 -19.1407 -11.6652 -11.6652 -11.6618 -11.6618 -11.3617 -11.3617 -11.3137 -11.3137 11.3890 11.3890 11.5129 11.5129 11.7648 11.7648 11.8734 11.8734 13.0074 13.0074 13.1550 13.1550 13.3571 13.3571 13.8174 13.8174 15.4118 15.4118 15.6691 15.6691 16.8568 16.8568 17.0217 17.0217 17.6594 17.6594 17.8951 17.8951 17.9939 17.9939 18.4471 18.4471 19.2362 19.2362 k = 0.5000 0.2030 0.3093 ( 2644 PWs) bands (ev): -44.7395 -44.7395 -44.7341 -44.7341 -19.1549 -19.1549 -19.1410 -19.1410 -11.6655 -11.6655 -11.6625 -11.6625 -11.3584 -11.3584 -11.3136 -11.3136 11.3618 11.3618 11.4858 11.4858 11.7297 11.7297 11.8247 11.8247 13.0003 13.0003 13.1414 13.1414 13.3497 13.3497 13.7836 13.7836 15.4998 15.4998 15.7428 15.7428 16.9307 16.9307 17.1102 17.1102 17.6882 17.6882 17.8970 17.8970 17.9955 17.9955 18.3993 18.3993 19.2925 19.2925 k = 0.5000 0.2126 0.3093 ( 2648 PWs) bands (ev): -44.7393 -44.7393 -44.7343 -44.7343 -19.1543 -19.1543 -19.1413 -19.1413 -11.6659 -11.6659 -11.6632 -11.6632 -11.3553 -11.3553 -11.3135 -11.3135 11.3376 11.3376 11.4616 11.4616 11.6935 11.6935 11.7777 11.7777 12.9949 12.9949 13.1321 13.1321 13.3407 13.3407 13.7489 13.7489 15.5861 15.5861 15.8164 15.8164 17.0044 17.0044 17.1946 17.1946 17.7110 17.7110 17.8993 17.8993 17.9964 17.9964 18.3525 18.3525 19.3495 19.3495 k = 0.5000 0.2223 0.3093 ( 2648 PWs) bands (ev): -44.7391 -44.7391 -44.7345 -44.7345 -19.1537 -19.1537 -19.1416 -19.1416 -11.6662 -11.6662 -11.6638 -11.6638 -11.3521 -11.3521 -11.3136 -11.3136 11.3166 11.3166 11.4404 11.4404 11.6565 11.6565 11.7329 11.7329 12.9913 12.9913 13.1264 13.1264 13.3307 13.3307 13.7135 13.7135 15.6703 15.6703 15.8891 15.8891 17.0776 17.0776 17.2742 17.2742 17.7276 17.7276 17.9012 17.9012 17.9969 17.9969 18.3075 18.3075 19.4071 19.4071 k = 0.5000 0.2320 0.3093 ( 2656 PWs) bands (ev): -44.7390 -44.7390 -44.7347 -44.7347 -19.1531 -19.1531 -19.1420 -19.1420 -11.6666 -11.6666 -11.6644 -11.6644 -11.3492 -11.3492 -11.3139 -11.3139 11.2988 11.2988 11.4223 11.4223 11.6188 11.6188 11.6907 11.6907 12.9896 12.9896 13.1236 13.1236 13.3201 13.3201 13.6779 13.6779 15.7520 15.7520 15.9601 15.9601 17.1496 17.1496 17.3481 17.3481 17.7383 17.7383 17.9013 17.9013 17.9976 17.9976 18.2657 18.2657 19.4650 19.4650 k = 0.5000 0.2416 0.3093 ( 2656 PWs) bands (ev): -44.7388 -44.7388 -44.7349 -44.7349 -19.1524 -19.1524 -19.1424 -19.1424 -11.6668 -11.6668 -11.6649 -11.6649 -11.3461 -11.3461 -11.3143 -11.3143 11.2843 11.2843 11.4072 11.4072 11.5810 11.5810 11.6512 11.6512 12.9899 12.9899 13.1229 13.1229 13.3097 13.3097 13.6423 13.6423 15.8307 15.8307 16.0282 16.0282 17.2197 17.2197 17.4156 17.4156 17.7437 17.7437 17.8975 17.8975 17.9996 17.9996 18.2281 18.2281 19.5230 19.5230 k = 0.5000 0.2513 0.3093 ( 2652 PWs) bands (ev): -44.7386 -44.7386 -44.7351 -44.7351 -19.1516 -19.1516 -19.1427 -19.1427 -11.6671 -11.6671 -11.6654 -11.6654 -11.3431 -11.3431 -11.3148 -11.3148 11.2731 11.2731 11.3951 11.3951 11.5437 11.5437 11.6145 11.6145 12.9922 12.9922 13.1233 13.1233 13.3003 13.3003 13.6070 13.6070 15.9061 15.9061 16.0923 16.0923 17.2872 17.2872 17.4758 17.4758 17.7449 17.7449 17.8883 17.8883 18.0037 18.0037 18.1954 18.1954 19.5810 19.5810 k = 0.5000 0.2609 0.3093 ( 2648 PWs) bands (ev): -44.7384 -44.7384 -44.7354 -44.7354 -19.1509 -19.1509 -19.1431 -19.1431 -11.6673 -11.6673 -11.6659 -11.6659 -11.3403 -11.3403 -11.3154 -11.3154 11.2654 11.2654 11.3860 11.3860 11.5074 11.5074 11.5806 11.5806 12.9964 12.9964 13.1236 13.1236 13.2932 13.2932 13.5723 13.5723 15.9777 15.9777 16.1510 16.1510 17.3512 17.3512 17.5281 17.5281 17.7429 17.7429 17.8734 17.8734 18.0100 18.0100 18.1681 18.1681 19.6386 19.6386 k = 0.5000 0.2706 0.3093 ( 2652 PWs) bands (ev): -44.7382 -44.7382 -44.7356 -44.7356 -19.1503 -19.1503 -19.1436 -19.1436 -11.6675 -11.6675 -11.6663 -11.6663 -11.3376 -11.3376 -11.3162 -11.3162 11.2611 11.2611 11.3797 11.3797 11.4729 11.4729 11.5493 11.5493 13.0024 13.0024 13.1226 13.1226 13.2894 13.2894 13.5383 13.5383 16.0450 16.0450 16.2030 16.2030 17.4109 17.4109 17.5715 17.5715 17.7392 17.7392 17.8545 17.8545 18.0178 18.0178 18.1456 18.1456 19.6958 19.6958 k = 0.5000 0.2803 0.3093 ( 2644 PWs) bands (ev): -44.7380 -44.7380 -44.7358 -44.7358 -19.1495 -19.1495 -19.1439 -19.1439 -11.6676 -11.6676 -11.6666 -11.6666 -11.3349 -11.3349 -11.3171 -11.3171 11.2602 11.2602 11.3757 11.3757 11.4412 11.4412 11.5206 11.5206 13.0102 13.0102 13.1192 13.1192 13.2901 13.2901 13.5052 13.5052 16.1072 16.1072 16.2468 16.2468 17.4653 17.4653 17.6053 17.6053 17.7350 17.7350 17.8339 17.8339 18.0264 18.0264 18.1273 18.1273 19.7522 19.7522 k = 0.5000 0.2899 0.3093 ( 2640 PWs) bands (ev): -44.7378 -44.7378 -44.7360 -44.7360 -19.1489 -19.1489 -19.1444 -19.1444 -11.6677 -11.6677 -11.6669 -11.6669 -11.3324 -11.3324 -11.3181 -11.3181 11.2627 11.2627 11.3722 11.3722 11.4143 11.4143 11.4945 11.4945 13.0196 13.0196 13.1130 13.1130 13.2959 13.2959 13.4734 13.4734 16.1634 16.1634 16.2813 16.2813 17.5135 17.5135 17.6286 17.6286 17.7322 17.7322 17.8138 17.8138 18.0352 18.0352 18.1121 18.1121 19.8078 19.8078 k = 0.5000 0.2996 0.3093 ( 2636 PWs) bands (ev): -44.7375 -44.7375 -44.7362 -44.7362 -19.1483 -19.1483 -19.1447 -19.1447 -11.6677 -11.6677 -11.6671 -11.6671 -11.3302 -11.3302 -11.3193 -11.3193 11.2687 11.2687 11.3630 11.3630 11.3988 11.3988 11.4710 11.4710 13.0303 13.0303 13.1040 13.1040 13.3066 13.3066 13.4429 13.4429 16.2128 16.2128 16.3053 16.3053 17.5545 17.5545 17.6411 17.6411 17.7325 17.7325 17.7956 17.7956 18.0439 18.0439 18.0993 18.0993 19.8622 19.8622 k = 0.5000 0.3093 0.3093 ( 2636 PWs) bands (ev): -44.7373 -44.7373 -44.7365 -44.7365 -19.1477 -19.1477 -19.1453 -19.1453 -11.6677 -11.6677 -11.6673 -11.6673 -11.3280 -11.3280 -11.3207 -11.3207 11.2780 11.2780 11.3447 11.3447 11.3984 11.3984 11.4502 11.4502 13.0421 13.0421 13.0930 13.0930 13.3217 13.3217 13.4141 13.4141 16.2541 16.2541 16.3179 16.3179 17.5873 17.5873 17.6439 17.6439 17.7367 17.7367 17.7800 17.7800 18.0524 18.0524 18.0882 18.0882 19.9153 19.9153 k = 0.5000 0.3189 0.3093 ( 2628 PWs) bands (ev): -44.7371 -44.7371 -44.7367 -44.7367 -19.1470 -19.1470 -19.1457 -19.1457 -11.6676 -11.6676 -11.6674 -11.6674 -11.3259 -11.3259 -11.3222 -11.3222 11.2905 11.2905 11.3245 11.3245 11.4057 11.4057 11.4322 11.4322 13.0546 13.0546 13.0806 13.0806 13.3406 13.3406 13.3873 13.3873 16.2862 16.2862 16.3188 16.3188 17.6118 17.6118 17.6394 17.6394 17.7443 17.7443 17.7664 17.7664 18.0608 18.0608 18.0784 18.0784 19.9668 19.9668 k = 0.5000 0.3286 0.3093 ( 2624 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1463 -19.1463 -19.1463 -19.1463 -11.6675 -11.6675 -11.6675 -11.6675 -11.3239 -11.3239 -11.3239 -11.3239 11.3061 11.3061 11.3061 11.3061 11.4173 11.4173 11.4173 11.4173 13.0677 13.0677 13.0677 13.0677 13.3626 13.3626 13.3626 13.3626 16.3081 16.3081 16.3081 16.3081 17.6288 17.6288 17.6288 17.6288 17.7545 17.7545 17.7545 17.7545 18.0694 18.0694 18.0694 18.0694 20.0166 20.0166 k = 0.5000 0.3286 0.3093 ( 2624 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1463 -19.1463 -19.1463 -19.1463 -11.6675 -11.6675 -11.6675 -11.6675 -11.3239 -11.3239 -11.3239 -11.3239 11.3061 11.3061 11.3061 11.3061 11.4173 11.4173 11.4173 11.4173 13.0677 13.0677 13.0677 13.0677 13.3626 13.3626 13.3626 13.3626 16.3081 16.3081 16.3081 16.3081 17.6288 17.6288 17.6288 17.6288 17.7545 17.7545 17.7545 17.7545 18.0694 18.0694 18.0694 18.0694 20.0166 20.0166 k = 0.4904 0.3286 0.3093 ( 2628 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1463 -19.1463 -19.1462 -19.1462 -11.6673 -11.6673 -11.6672 -11.6672 -11.3240 -11.3240 -11.3240 -11.3240 11.3064 11.3064 11.3077 11.3077 11.4174 11.4174 11.4192 11.4192 13.0672 13.0672 13.0704 13.0704 13.3611 13.3611 13.3664 13.3664 16.3016 16.3016 16.3112 16.3112 17.5129 17.5129 17.5896 17.5896 17.7706 17.7706 17.8610 17.8610 18.0743 18.0743 18.0816 18.0816 20.0028 20.0028 k = 0.4808 0.3286 0.3093 ( 2632 PWs) bands (ev): -44.7370 -44.7370 -44.7370 -44.7370 -19.1461 -19.1461 -19.1460 -19.1460 -11.6663 -11.6663 -11.6662 -11.6662 -11.3242 -11.3242 -11.3242 -11.3242 11.3084 11.3084 11.3111 11.3111 11.4195 11.4195 11.4230 11.4230 13.0691 13.0691 13.0754 13.0754 13.3618 13.3618 13.3725 13.3725 16.2913 16.2913 16.3109 16.3109 17.3772 17.3772 17.4593 17.4593 17.8336 17.8336 17.9354 17.9354 18.1158 18.1158 18.1238 18.1238 19.9890 19.9890 k = 0.4712 0.3286 0.3093 ( 2636 PWs) bands (ev): -44.7372 -44.7372 -44.7371 -44.7371 -19.1457 -19.1457 -19.1456 -19.1456 -11.6647 -11.6647 -11.6646 -11.6646 -11.3246 -11.3246 -11.3245 -11.3245 11.3121 11.3121 11.3161 11.3161 11.4235 11.4235 11.4288 11.4288 13.0732 13.0732 13.0826 13.0826 13.3648 13.3648 13.3809 13.3809 16.2765 16.2765 16.3072 16.3072 17.2360 17.2360 17.3236 17.3236 17.8481 17.8481 17.9452 17.9452 18.2066 18.2066 18.2124 18.2124 19.9748 19.9748 k = 0.4615 0.3286 0.3093 ( 2636 PWs) bands (ev): -44.7374 -44.7374 -44.7373 -44.7373 -19.1451 -19.1451 -19.1450 -19.1450 -11.6624 -11.6624 -11.6623 -11.6623 -11.3250 -11.3250 -11.3248 -11.3248 11.3177 11.3177 11.3229 11.3229 11.4296 11.4296 11.4365 11.4365 13.0795 13.0795 13.0921 13.0921 13.3701 13.3701 13.3915 13.3915 16.2558 16.2558 16.2993 16.2993 17.0932 17.0932 17.1893 17.1893 17.8255 17.8255 17.9205 17.9205 18.3142 18.3142 18.3313 18.3313 19.9598 19.9598 k = 0.4519 0.3286 0.3093 ( 2640 PWs) bands (ev): -44.7376 -44.7376 -44.7376 -44.7376 -19.1444 -19.1444 -19.1442 -19.1442 -11.6595 -11.6595 -11.6593 -11.6593 -11.3255 -11.3255 -11.3253 -11.3253 11.3249 11.3249 11.3314 11.3314 11.4376 11.4376 11.4461 11.4461 13.0881 13.0881 13.1037 13.1037 13.3777 13.3777 13.4044 13.4044 16.2276 16.2276 16.2859 16.2859 16.9517 16.9517 17.0595 17.0595 17.7816 17.7816 17.8789 17.8789 18.4301 18.4301 18.4539 18.4539 19.9430 19.9430 k = 0.4423 0.3286 0.3093 ( 2648 PWs) bands (ev): -44.7380 -44.7380 -44.7379 -44.7379 -19.1436 -19.1436 -19.1433 -19.1433 -11.6560 -11.6560 -11.6558 -11.6558 -11.3262 -11.3262 -11.3259 -11.3259 11.3339 11.3339 11.3415 11.3415 11.4475 11.4475 11.4577 11.4577 13.0989 13.0989 13.1175 13.1175 13.3875 13.3875 13.4196 13.4196 16.1892 16.1892 16.2644 16.2644 16.8151 16.8151 16.9375 16.9375 17.7242 17.7242 17.8258 17.8258 18.5468 18.5468 18.5749 18.5749 19.9235 19.9235 k = 0.4327 0.3286 0.3093 ( 2648 PWs) bands (ev): -44.7383 -44.7383 -44.7383 -44.7383 -19.1425 -19.1425 -19.1422 -19.1422 -11.6519 -11.6519 -11.6516 -11.6516 -11.3269 -11.3269 -11.3266 -11.3266 11.3445 11.3445 11.3532 11.3532 11.4595 11.4595 11.4711 11.4711 13.1119 13.1119 13.1335 13.1335 13.3995 13.3995 13.4369 13.4369 16.1377 16.1377 16.2302 16.2302 16.6886 16.6886 16.8271 16.8271 17.6569 17.6569 17.7634 17.7634 18.6611 18.6611 18.6923 18.6923 19.9001 19.9001 k = 0.4231 0.3286 0.3093 ( 2652 PWs) bands (ev): -44.7388 -44.7388 -44.7387 -44.7387 -19.1413 -19.1413 -19.1410 -19.1410 -11.6472 -11.6472 -11.6469 -11.6469 -11.3277 -11.3277 -11.3273 -11.3273 11.3567 11.3567 11.3663 11.3663 11.4734 11.4734 11.4863 11.4863 13.1270 13.1270 13.1514 13.1514 13.4138 13.4138 13.4564 13.4564 16.0701 16.0701 16.1757 16.1757 16.5803 16.5803 16.7315 16.7315 17.5819 17.5819 17.6934 17.6934 18.7714 18.7714 18.8052 18.8052 19.8719 19.8719 k = 0.4135 0.3286 0.3093 ( 2648 PWs) bands (ev): -44.7392 -44.7392 -44.7392 -44.7392 -19.1399 -19.1399 -19.1395 -19.1395 -11.6419 -11.6419 -11.6415 -11.6415 -11.3284 -11.3284 -11.3280 -11.3280 11.3705 11.3705 11.3809 11.3809 11.4893 11.4893 11.5034 11.5034 13.1441 13.1441 13.1714 13.1714 13.4302 13.4302 13.4782 13.4782 15.9851 15.9851 16.0942 16.0942 16.4974 16.4974 16.6523 16.6523 17.5008 17.5008 17.6171 17.6171 18.8765 18.8765 18.9129 18.9129 19.8379 19.8379 k = 0.4038 0.3286 0.3093 ( 2648 PWs) bands (ev): -44.7398 -44.7398 -44.7397 -44.7397 -19.1384 -19.1384 -19.1380 -19.1380 -11.6360 -11.6360 -11.6357 -11.6357 -11.3293 -11.3293 -11.3288 -11.3288 11.3857 11.3857 11.3968 11.3968 11.5070 11.5070 11.5223 11.5223 13.1633 13.1633 13.1932 13.1932 13.4488 13.4488 13.5020 13.5020 15.8840 15.8840 15.9866 15.9866 16.4390 16.4390 16.5883 16.5883 17.4150 17.4150 17.5360 17.5360 18.9758 18.9758 19.0148 19.0148 19.7976 19.7976 k = 0.3942 0.3286 0.3093 ( 2652 PWs) bands (ev): -44.7403 -44.7403 -44.7403 -44.7403 -19.1368 -19.1368 -19.1363 -19.1363 -11.6297 -11.6297 -11.6294 -11.6294 -11.3302 -11.3302 -11.3297 -11.3297 11.4023 11.4023 11.4139 11.4139 11.5267 11.5267 11.5428 11.5428 13.1843 13.1843 13.2168 13.2168 13.4695 13.4695 13.5280 13.5280 15.7701 15.7701 15.8612 15.8612 16.3970 16.3970 16.5365 16.5365 17.3259 17.3259 17.4514 17.4514 19.0686 19.0686 19.1106 19.1106 19.7504 19.7504 k = 0.3846 0.3286 0.3093 ( 2652 PWs) bands (ev): -44.7410 -44.7410 -44.7409 -44.7409 -19.1350 -19.1350 -19.1345 -19.1345 -11.6230 -11.6230 -11.6226 -11.6226 -11.3310 -11.3310 -11.3304 -11.3304 11.4202 11.4202 11.4320 11.4320 11.5482 11.5482 11.5650 11.5650 13.2072 13.2072 13.2421 13.2421 13.4923 13.4923 13.5560 13.5560 15.6473 15.6473 15.7260 15.7260 16.3633 16.3633 16.4929 16.4929 17.2349 17.2349 17.3647 17.3647 19.1543 19.1543 19.1999 19.1999 19.6962 19.6962 k = 0.3750 0.3286 0.3093 ( 2652 PWs) bands (ev): -44.7416 -44.7416 -44.7416 -44.7416 -19.1331 -19.1331 -19.1325 -19.1325 -11.6158 -11.6158 -11.6155 -11.6155 -11.3319 -11.3319 -11.3312 -11.3312 11.4393 11.4393 11.4512 11.4512 11.5716 11.5716 11.5889 11.5889 13.2318 13.2318 13.2689 13.2689 13.5171 13.5171 13.5861 13.5861 15.5189 15.5189 15.5862 15.5862 16.3326 16.3326 16.4537 16.4537 17.1433 17.1433 17.2773 17.2773 19.2320 19.2320 19.2823 19.2823 19.6353 19.6353 k = 0.3654 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7423 -44.7423 -44.7423 -44.7423 -19.1311 -19.1311 -19.1305 -19.1305 -11.6082 -11.6082 -11.6079 -11.6079 -11.3326 -11.3326 -11.3319 -11.3319 11.4594 11.4594 11.4712 11.4712 11.5967 11.5967 11.6143 11.6143 13.2579 13.2579 13.2970 13.2970 13.5439 13.5439 13.6182 13.6182 15.3877 15.3877 15.4447 15.4447 16.3016 16.3016 16.4158 16.4158 17.0530 17.0530 17.1908 17.1908 19.3004 19.3004 19.3569 19.3569 19.5687 19.5687 k = 0.3558 0.3286 0.3093 ( 2648 PWs) bands (ev): -44.7431 -44.7431 -44.7430 -44.7430 -19.1288 -19.1288 -19.1282 -19.1282 -11.6003 -11.6003 -11.6000 -11.6000 -11.3333 -11.3333 -11.3325 -11.3325 11.4805 11.4805 11.4919 11.4919 11.6236 11.6236 11.6412 11.6412 13.2854 13.2854 13.3263 13.3263 13.5725 13.5725 13.6522 13.6522 15.2558 15.2558 15.3034 15.3034 16.2679 16.2679 16.3761 16.3761 16.9660 16.9660 17.1070 17.1070 19.3566 19.3566 19.4169 19.4169 19.5036 19.5036 k = 0.3462 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7439 -44.7439 -44.7438 -44.7438 -19.1267 -19.1267 -19.1261 -19.1261 -11.5922 -11.5922 -11.5920 -11.5920 -11.3338 -11.3338 -11.3329 -11.3329 11.5024 11.5024 11.5132 11.5132 11.6521 11.6521 11.6695 11.6695 13.3142 13.3142 13.3565 13.3565 13.6028 13.6028 13.6880 13.6880 15.1247 15.1247 15.1634 15.1634 16.2299 16.2299 16.3318 16.3318 16.8846 16.8846 17.0274 17.0274 19.3948 19.3948 19.3955 19.3955 19.5072 19.5072 k = 0.3365 0.3286 0.3093 ( 2652 PWs) bands (ev): -44.7447 -44.7447 -44.7446 -44.7446 -19.1243 -19.1243 -19.1237 -19.1237 -11.5839 -11.5839 -11.5837 -11.5837 -11.3341 -11.3341 -11.3331 -11.3331 11.5249 11.5249 11.5349 11.5349 11.6822 11.6822 11.6992 11.6992 13.3440 13.3440 13.3873 13.3873 13.6346 13.6346 13.7256 13.7256 14.9959 14.9959 15.0256 15.0256 16.1859 16.1859 16.2805 16.2805 16.8113 16.8113 16.9538 16.9538 19.3149 19.3149 19.4037 19.4037 19.5579 19.5579 k = 0.3269 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7455 -44.7455 -44.7455 -44.7455 -19.1219 -19.1219 -19.1213 -19.1213 -11.5755 -11.5755 -11.5754 -11.5754 -11.3343 -11.3343 -11.3331 -11.3331 11.5478 11.5478 11.5568 11.5568 11.7138 11.7138 11.7300 11.7300 13.3745 13.3745 13.4185 13.4185 13.6674 13.6674 13.7648 13.7648 14.8707 14.8707 14.8910 14.8910 16.1350 16.1350 16.2202 16.2202 16.7479 16.7479 16.8877 16.8877 19.2248 19.2248 19.3732 19.3732 19.6069 19.6069 k = 0.3173 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7464 -44.7464 -44.7464 -44.7464 -19.1194 -19.1194 -19.1187 -19.1187 -11.5670 -11.5670 -11.5670 -11.5670 -11.3341 -11.3341 -11.3328 -11.3328 11.5710 11.5710 11.5787 11.5787 11.7468 11.7468 11.7620 11.7620 13.4054 13.4054 13.4495 13.4495 13.7007 13.7007 13.8054 13.8054 14.7506 14.7506 14.7603 14.7603 16.0767 16.0767 16.1503 16.1503 16.6953 16.6953 16.8300 16.8300 19.1297 19.1297 19.3102 19.3102 19.6505 19.6505 k = 0.3077 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7473 -44.7473 -44.7473 -44.7473 -19.1169 -19.1169 -19.1162 -19.1162 -11.5587 -11.5587 -11.5586 -11.5586 -11.3335 -11.3335 -11.3321 -11.3321 11.5942 11.5942 11.6005 11.6005 11.7810 11.7810 11.7950 11.7950 13.4363 13.4363 13.4799 13.4799 13.7337 13.7337 13.8470 13.8470 14.6344 14.6344 14.6374 14.6374 16.0113 16.0113 16.0716 16.0716 16.6530 16.6530 16.7810 16.7810 19.0306 19.0306 19.2284 19.2284 19.6885 19.6885 k = 0.2981 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7482 -44.7482 -44.7482 -44.7482 -19.1143 -19.1143 -19.1135 -19.1135 -11.5506 -11.5506 -11.5504 -11.5504 -11.3325 -11.3325 -11.3310 -11.3310 11.6173 11.6173 11.6220 11.6220 11.8164 11.8164 11.8289 11.8289 13.4666 13.4666 13.5087 13.5087 13.7649 13.7649 13.8889 13.8889 14.5147 14.5147 14.5337 14.5337 15.9397 15.9397 15.9861 15.9861 16.6194 16.6194 16.7402 16.7402 18.9285 18.9285 19.1364 19.1364 19.7208 19.7208 k = 0.2885 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7492 -44.7492 -44.7491 -44.7491 -19.1117 -19.1117 -19.1109 -19.1109 -11.5428 -11.5428 -11.5425 -11.5425 -11.3311 -11.3311 -11.3294 -11.3294 11.6400 11.6400 11.6428 11.6428 11.8527 11.8527 11.8635 11.8635 13.4955 13.4955 13.5346 13.5346 13.7924 13.7924 13.9296 13.9296 14.4035 14.4035 14.4430 14.4430 15.8633 15.8633 15.8957 15.8957 16.5927 16.5927 16.7068 16.7068 18.8241 18.8241 19.0384 19.0384 19.7476 19.7476 k = 0.2788 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7501 -44.7501 -44.7501 -44.7501 -19.1089 -19.1089 -19.1082 -19.1082 -11.5353 -11.5353 -11.5348 -11.5348 -11.3290 -11.3290 -11.3272 -11.3272 11.6619 11.6619 11.6628 11.6628 11.8899 11.8899 11.8986 11.8986 13.5220 13.5220 13.5554 13.5554 13.8135 13.8135 13.9653 13.9653 14.3059 14.3059 14.3703 14.3703 15.7839 15.7839 15.8025 15.8025 16.5715 16.5715 16.6798 16.6798 18.7178 18.7178 18.9366 18.9366 19.7690 19.7690 k = 0.2692 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7511 -44.7511 -44.7510 -44.7510 -19.1063 -19.1063 -19.1055 -19.1055 -11.5282 -11.5282 -11.5277 -11.5277 -11.3264 -11.3264 -11.3244 -11.3244 11.6816 11.6816 11.6829 11.6829 11.9278 11.9278 11.9342 11.9342 13.5443 13.5443 13.5675 13.5675 13.8266 13.8266 13.9859 13.9859 14.2334 14.2334 14.3212 14.3212 15.7033 15.7033 15.7083 15.7083 16.5542 16.5542 16.6581 16.6581 18.6103 18.6103 18.8326 18.8326 19.7855 19.7855 k = 0.2596 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7520 -44.7520 -44.7520 -44.7520 -19.1035 -19.1035 -19.1028 -19.1028 -11.5217 -11.5217 -11.5211 -11.5211 -11.3230 -11.3230 -11.3209 -11.3209 11.6991 11.6991 11.7026 11.7026 11.9662 11.9662 11.9700 11.9700 13.5595 13.5595 13.5657 13.5657 13.8332 13.8332 13.9742 13.9742 14.2061 14.2061 14.2994 14.2994 15.6145 15.6145 15.6230 15.6230 16.5401 16.5401 16.6407 16.6407 18.5020 18.5020 18.7272 18.7272 19.7971 19.7971 k = 0.2500 0.3286 0.3093 ( 2664 PWs) bands (ev): -44.7530 -44.7530 -44.7530 -44.7530 -19.1009 -19.1009 -19.1001 -19.1001 -11.5159 -11.5159 -11.5151 -11.5151 -11.3190 -11.3190 -11.3168 -11.3168 11.7148 11.7148 11.7206 11.7206 12.0048 12.0048 12.0057 12.0057 13.5455 13.5455 13.5633 13.5633 13.8395 13.8395 13.9347 13.9347 14.2235 14.2235 14.3033 14.3033 15.5222 15.5222 15.5447 15.5447 16.5282 16.5282 16.6266 16.6266 18.3934 18.3934 18.6213 18.6213 19.8022 19.8022 k = 0.2404 0.3286 0.3093 ( 2668 PWs) bands (ev): -44.7540 -44.7540 -44.7539 -44.7539 -19.0982 -19.0982 -19.0975 -19.0975 -11.5107 -11.5107 -11.5098 -11.5098 -11.3142 -11.3142 -11.3119 -11.3119 11.7286 11.7286 11.7367 11.7367 12.0413 12.0413 12.0435 12.0435 13.5071 13.5071 13.5503 13.5503 13.8510 13.8510 13.8950 13.8950 14.2634 14.2634 14.3274 14.3274 15.4324 15.4324 15.4697 15.4697 16.5182 16.5182 16.6152 16.6152 18.2849 18.2849 18.5153 18.5153 19.8025 19.8025 k = 0.2308 0.3286 0.3093 ( 2664 PWs) bands (ev): -44.7550 -44.7550 -44.7549 -44.7549 -19.0955 -19.0955 -19.0947 -19.0947 -11.5061 -11.5061 -11.5052 -11.5052 -11.3087 -11.3087 -11.3063 -11.3063 11.7400 11.7400 11.7505 11.7505 12.0763 12.0763 12.0821 12.0821 13.4556 13.4556 13.5178 13.5178 13.8685 13.8685 13.8704 13.8704 14.3128 14.3128 14.3657 14.3657 15.3460 15.3460 15.3996 15.3996 16.5095 16.5095 16.6060 16.6060 18.1769 18.1769 18.4098 18.4098 19.7983 19.7987 k = 0.2212 0.3286 0.3093 ( 2664 PWs) bands (ev): -44.7559 -44.7559 -44.7559 -44.7559 -19.0928 -19.0928 -19.0921 -19.0921 -11.5022 -11.5022 -11.5012 -11.5012 -11.3025 -11.3025 -11.3000 -11.3000 11.7488 11.7488 11.7615 11.7615 12.1106 12.1106 12.1201 12.1201 13.3973 13.3973 13.4696 13.4696 13.8616 13.8616 13.8905 13.8905 14.3668 14.3668 14.4137 14.4137 15.2637 15.2637 15.3356 15.3356 16.5017 16.5017 16.5982 16.5982 18.0699 18.0699 18.3052 18.3052 19.7896 19.7896 k = 0.2115 0.3286 0.3093 ( 2668 PWs) bands (ev): -44.7569 -44.7569 -44.7568 -44.7568 -19.0902 -19.0902 -19.0895 -19.0895 -11.4991 -11.4991 -11.4980 -11.4980 -11.2956 -11.2956 -11.2932 -11.2932 11.7547 11.7547 11.7695 11.7695 12.1439 12.1439 12.1574 12.1574 13.3371 13.3371 13.4127 13.4127 13.8631 13.8631 13.9150 13.9150 14.4233 14.4233 14.4684 14.4684 15.1864 15.1864 15.2788 15.2788 16.4947 16.4947 16.5915 16.5915 17.9641 17.9641 18.2020 18.2020 19.7758 19.7758 k = 0.2019 0.3286 0.3093 ( 2676 PWs) bands (ev): -44.7578 -44.7578 -44.7577 -44.7577 -19.0877 -19.0877 -19.0870 -19.0870 -11.4965 -11.4965 -11.4955 -11.4955 -11.2883 -11.2883 -11.2858 -11.2858 11.7575 11.7575 11.7742 11.7742 12.1759 12.1759 12.1937 12.1937 13.2781 13.2781 13.3534 13.3534 13.8696 13.8696 13.9405 13.9405 14.4811 14.4811 14.5280 14.5280 15.1147 15.1147 15.2306 15.2306 16.4880 16.4880 16.5854 16.5854 17.8601 17.8601 18.1003 18.1003 19.7564 19.7564 k = 0.1923 0.3286 0.3093 ( 2684 PWs) bands (ev): -44.7587 -44.7587 -44.7587 -44.7587 -19.0853 -19.0853 -19.0846 -19.0846 -11.4945 -11.4945 -11.4935 -11.4935 -11.2804 -11.2804 -11.2780 -11.2780 11.7570 11.7570 11.7753 11.7753 12.2063 12.2063 12.2285 12.2285 13.2223 13.2223 13.2953 13.2953 13.8778 13.8778 13.9662 13.9662 14.5391 14.5391 14.5911 14.5911 15.0492 15.0492 15.1921 15.1921 16.4815 16.4815 16.5793 16.5793 17.7582 17.7582 18.0006 18.0006 19.7302 19.7302 k = 0.1827 0.3286 0.3093 ( 2680 PWs) bands (ev): -44.7596 -44.7596 -44.7596 -44.7596 -19.0828 -19.0828 -19.0821 -19.0821 -11.4930 -11.4930 -11.4920 -11.4920 -11.2722 -11.2722 -11.2698 -11.2698 11.7531 11.7531 11.7727 11.7727 12.2349 12.2349 12.2616 12.2616 13.1711 13.1711 13.2404 13.2404 13.8858 13.8858 13.9914 13.9914 14.5963 14.5963 14.6566 14.6566 14.9909 14.9909 15.1644 15.1644 16.4748 16.4748 16.5727 16.5727 17.6590 17.6590 17.9031 17.9031 19.6953 19.6953 k = 0.1731 0.3286 0.3093 ( 2680 PWs) bands (ev): -44.7605 -44.7605 -44.7604 -44.7604 -19.0804 -19.0804 -19.0797 -19.0797 -11.4920 -11.4920 -11.4909 -11.4909 -11.2637 -11.2637 -11.2613 -11.2613 11.7458 11.7458 11.7664 11.7664 12.2613 12.2613 12.2926 12.2926 13.1250 13.1250 13.1900 13.1900 13.8928 13.8928 14.0157 14.0157 14.6515 14.6515 14.7231 14.7231 14.9409 14.9409 15.1486 15.1486 16.4676 16.4676 16.5650 16.5650 17.5630 17.5630 17.8082 17.8082 19.6495 19.6495 k = 0.1635 0.3286 0.3093 ( 2684 PWs) bands (ev): -44.7613 -44.7613 -44.7613 -44.7613 -19.0781 -19.0781 -19.0775 -19.0775 -11.4914 -11.4914 -11.4903 -11.4903 -11.2551 -11.2551 -11.2528 -11.2528 11.7354 11.7354 11.7564 11.7564 12.2853 12.2853 12.3211 12.3211 13.0845 13.0845 13.1446 13.1446 13.8987 13.8987 14.0387 14.0387 14.7033 14.7033 14.7863 14.7863 14.9035 14.9035 15.1458 15.1458 16.4598 16.4598 16.5556 16.5556 17.4708 17.4708 17.7161 17.7161 19.5914 19.5914 k = 0.1538 0.3286 0.3093 ( 2688 PWs) bands (ev): -44.7621 -44.7621 -44.7621 -44.7621 -19.0759 -19.0759 -19.0753 -19.0753 -11.4910 -11.4910 -11.4900 -11.4900 -11.2464 -11.2464 -11.2442 -11.2442 11.7219 11.7219 11.7430 11.7430 12.3067 12.3067 12.3467 12.3467 13.0497 13.0497 13.1044 13.1044 13.9037 13.9037 14.0601 14.0601 14.7502 14.7502 14.8213 14.8213 14.9033 14.9033 15.1565 15.1565 16.4510 16.4510 16.5435 16.5435 17.3833 17.3833 17.6271 17.6271 19.5220 19.5220 k = 0.1442 0.3286 0.3093 ( 2688 PWs) bands (ev): -44.7629 -44.7629 -44.7629 -44.7629 -19.0738 -19.0738 -19.0732 -19.0732 -11.4909 -11.4909 -11.4899 -11.4899 -11.2378 -11.2378 -11.2357 -11.2357 11.7059 11.7059 11.7267 11.7267 12.3254 12.3254 12.3691 12.3691 13.0203 13.0203 13.0695 13.0695 13.9083 13.9083 14.0798 14.0798 14.7915 14.7915 14.8094 14.8094 14.9586 14.9586 15.1809 15.1809 16.4409 16.4409 16.5280 16.5280 17.3011 17.3011 17.5415 17.5415 19.4446 19.4446 k = 0.1346 0.3286 0.3093 ( 2684 PWs) bands (ev): -44.7637 -44.7637 -44.7636 -44.7636 -19.0717 -19.0717 -19.0712 -19.0712 -11.4910 -11.4910 -11.4901 -11.4901 -11.2293 -11.2293 -11.2272 -11.2272 11.6877 11.6877 11.7078 11.7078 12.3412 12.3412 12.3881 12.3881 12.9962 12.9962 13.0397 13.0397 13.9133 13.9133 14.0976 14.0976 14.7915 14.7915 14.8271 14.8271 15.0283 15.0283 15.2178 15.2178 16.4293 16.4293 16.5081 16.5081 17.2253 17.2253 17.4595 17.4595 19.3629 19.3629 k = 0.1250 0.3286 0.3093 ( 2680 PWs) bands (ev): -44.7644 -44.7644 -44.7643 -44.7643 -19.0698 -19.0698 -19.0692 -19.0692 -11.4913 -11.4913 -11.4904 -11.4904 -11.2210 -11.2210 -11.2190 -11.2190 11.6679 11.6679 11.6870 11.6870 12.3542 12.3542 12.4034 12.4034 12.9768 12.9768 13.0148 13.0148 13.9191 13.9191 14.1136 14.1136 14.7784 14.7784 14.8578 14.8578 15.1008 15.1008 15.2651 15.2651 16.4160 16.4160 16.4830 16.4830 17.1566 17.1566 17.3812 17.3812 19.2798 19.2798 k = 0.1154 0.3286 0.3093 ( 2680 PWs) bands (ev): -44.7650 -44.7650 -44.7650 -44.7650 -19.0680 -19.0680 -19.0675 -19.0675 -11.4917 -11.4917 -11.4908 -11.4908 -11.2130 -11.2130 -11.2112 -11.2112 11.6471 11.6471 11.6650 11.6650 12.3645 12.3645 12.4150 12.4150 12.9617 12.9617 12.9943 12.9943 13.9264 13.9264 14.1276 14.1276 14.7715 14.7715 14.8848 14.8848 15.1740 15.1740 15.3204 15.3204 16.4007 16.4007 16.4521 16.4521 17.0955 17.0955 17.3070 17.3070 19.1975 19.1975 k = 0.1058 0.3286 0.3093 ( 2676 PWs) bands (ev): -44.7656 -44.7656 -44.7656 -44.7656 -19.0662 -19.0662 -19.0658 -19.0658 -11.4921 -11.4921 -11.4913 -11.4913 -11.2054 -11.2054 -11.2037 -11.2037 11.6257 11.6257 11.6423 11.6423 12.3722 12.3722 12.4229 12.4229 12.9502 12.9502 12.9779 12.9779 13.9356 13.9356 14.1396 14.1396 14.7708 14.7708 14.9090 14.9090 15.2469 15.2469 15.3812 15.3812 16.3835 16.3835 16.4154 16.4154 17.0423 17.0423 17.2369 17.2369 19.1175 19.1176 k = 0.0962 0.3286 0.3093 ( 2680 PWs) bands (ev): -44.7662 -44.7662 -44.7662 -44.7662 -19.0647 -19.0647 -19.0643 -19.0643 -11.4926 -11.4926 -11.4919 -11.4919 -11.1983 -11.1983 -11.1967 -11.1967 11.6044 11.6044 11.6195 11.6195 12.3776 12.3776 12.4274 12.4274 12.9419 12.9419 12.9652 12.9652 13.9468 13.9468 14.1496 14.1496 14.7759 14.7759 14.9311 14.9311 15.3189 15.3189 15.4457 15.4457 16.3644 16.3644 16.3734 16.3734 16.9965 16.9965 17.1711 17.1711 19.0416 19.0424 k = 0.0865 0.3286 0.3093 ( 2672 PWs) bands (ev): -44.7667 -44.7667 -44.7667 -44.7667 -19.0632 -19.0632 -19.0628 -19.0628 -11.4932 -11.4932 -11.4925 -11.4925 -11.1916 -11.1916 -11.1902 -11.1902 11.5836 11.5836 11.5972 11.5972 12.3811 12.3811 12.4288 12.4288 12.9362 12.9362 12.9556 12.9556 13.9601 13.9601 14.1575 14.1575 14.7863 14.7863 14.9512 14.9512 15.3893 15.3893 15.5121 15.5121 16.3272 16.3272 16.3434 16.3434 16.9572 16.9572 17.1096 17.1096 18.9693 18.9696 k = 0.0769 0.3286 0.3093 ( 2668 PWs) bands (ev): -44.7672 -44.7672 -44.7672 -44.7672 -19.0619 -19.0619 -19.0616 -19.0616 -11.4936 -11.4936 -11.4931 -11.4931 -11.1854 -11.1854 -11.1842 -11.1842 11.5639 11.5639 11.5759 11.5759 12.3830 12.3830 12.4277 12.4277 12.9325 12.9325 12.9486 12.9486 13.9753 13.9753 14.1632 14.1632 14.8012 14.8012 14.9692 14.9692 15.4575 15.4575 15.5791 15.5791 16.2785 16.2785 16.3209 16.3209 16.9234 16.9234 17.0524 17.0524 18.9023 18.9029 k = 0.0673 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7676 -44.7676 -44.7676 -44.7676 -19.0606 -19.0606 -19.0603 -19.0603 -11.4941 -11.4941 -11.4936 -11.4936 -11.1798 -11.1798 -11.1788 -11.1788 11.5456 11.5456 11.5561 11.5561 12.3838 12.3838 12.4245 12.4245 12.9304 12.9304 12.9437 12.9437 13.9922 13.9922 14.1665 14.1665 14.8200 14.8200 14.9847 14.9847 15.5227 15.5227 15.6454 15.6454 16.2290 16.2290 16.2971 16.2971 16.8940 16.8940 16.9996 16.9996 18.8416 18.8416 k = 0.0577 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7680 -44.7680 -44.7680 -44.7680 -19.0596 -19.0596 -19.0594 -19.0594 -11.4946 -11.4946 -11.4942 -11.4942 -11.1750 -11.1750 -11.1741 -11.1741 11.5292 11.5292 11.5381 11.5381 12.3839 12.3839 12.4199 12.4199 12.9296 12.9296 12.9404 12.9404 14.0103 14.0103 14.1674 14.1674 14.8418 14.8418 14.9971 14.9971 15.5843 15.5843 15.7096 15.7096 16.1807 16.1807 16.2724 16.2724 16.8680 16.8680 16.9515 16.9515 18.7862 18.7867 k = 0.0481 0.3286 0.3093 ( 2656 PWs) bands (ev): -44.7683 -44.7683 -44.7683 -44.7683 -19.0588 -19.0588 -19.0585 -19.0585 -11.4950 -11.4950 -11.4947 -11.4947 -11.1708 -11.1708 -11.1700 -11.1700 11.5149 11.5149 11.5223 11.5223 12.3837 12.3837 12.4144 12.4144 12.9295 12.9295 12.9382 12.9382 14.0293 14.0293 14.1657 14.1657 14.8657 14.8657 15.0059 15.0059 15.6416 15.6416 15.7696 15.7696 16.1358 16.1358 16.2470 16.2470 16.8451 16.8451 16.9084 16.9084 18.7387 18.7403 k = 0.0385 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7686 -44.7686 -44.7685 -44.7685 -19.0581 -19.0581 -19.0579 -19.0579 -11.4954 -11.4954 -11.4951 -11.4951 -11.1674 -11.1674 -11.1667 -11.1667 11.5030 11.5030 11.5088 11.5088 12.3835 12.3835 12.4086 12.4086 12.9301 12.9301 12.9368 12.9368 14.0485 14.0485 14.1614 14.1614 14.8908 14.8908 15.0104 15.0104 15.6941 15.6941 15.8227 15.8227 16.0973 16.0973 16.2210 16.2210 16.8252 16.8252 16.8708 16.8708 18.6990 18.6992 k = 0.0288 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7688 -44.7688 -44.7687 -44.7687 -19.0575 -19.0575 -19.0574 -19.0574 -11.4957 -11.4957 -11.4955 -11.4955 -11.1646 -11.1646 -11.1641 -11.1641 11.4937 11.4937 11.4980 11.4980 12.3838 12.3838 12.4028 12.4028 12.9309 12.9309 12.9358 12.9358 14.0676 14.0676 14.1545 14.1545 14.9159 14.9159 15.0104 15.0104 15.7416 15.7416 15.8630 15.8630 16.0705 16.0705 16.1941 16.1941 16.8088 16.8088 16.8395 16.8395 18.6680 18.6683 k = 0.0192 0.3286 0.3093 ( 2664 PWs) bands (ev): -44.7689 -44.7689 -44.7689 -44.7689 -19.0572 -19.0572 -19.0571 -19.0571 -11.4959 -11.4959 -11.4958 -11.4958 -11.1626 -11.1626 -11.1623 -11.1623 11.4871 11.4871 11.4900 11.4900 12.3848 12.3848 12.3976 12.3976 12.9318 12.9318 12.9350 12.9350 14.0861 14.0861 14.1451 14.1451 14.9400 14.9400 15.0053 15.0053 15.7839 15.7839 15.8817 15.8817 16.0636 16.0636 16.1659 16.1659 16.7969 16.7969 16.8154 16.8154 18.6459 18.6469 k = 0.0096 0.3286 0.3093 ( 2664 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0569 -19.0569 -19.0569 -19.0569 -11.4960 -11.4960 -11.4960 -11.4960 -11.1614 -11.1614 -11.1612 -11.1612 11.4834 11.4834 11.4849 11.4849 12.3866 12.3866 12.3930 12.3930 12.9327 12.9327 12.9343 12.9343 14.1034 14.1034 14.1333 14.1333 14.9619 14.9619 14.9953 14.9953 15.8211 15.8211 15.8754 15.8754 16.0786 16.0786 16.1362 16.1362 16.7905 16.7905 16.7992 16.7992 18.6327 18.6334 k = 0.0000 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0568 -19.0568 -19.0568 -19.0568 -11.4960 -11.4960 -11.4960 -11.4960 -11.1609 -11.1609 -11.1609 -11.1609 11.4827 11.4827 11.4827 11.4827 12.3893 12.3893 12.3893 12.3893 12.9336 12.9336 12.9336 12.9336 14.1193 14.1193 14.1193 14.1193 14.9807 14.9807 14.9807 14.9807 15.8526 15.8526 15.8526 15.8526 16.1059 16.1059 16.1059 16.1059 16.7910 16.7910 16.7910 16.7910 18.6287 18.6287 k = 0.0000 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0568 -19.0568 -19.0568 -19.0568 -11.4960 -11.4960 -11.4960 -11.4960 -11.1609 -11.1609 -11.1609 -11.1609 11.4827 11.4827 11.4827 11.4827 12.3893 12.3893 12.3893 12.3893 12.9336 12.9336 12.9336 12.9336 14.1193 14.1193 14.1193 14.1193 14.9807 14.9807 14.9807 14.9807 15.8526 15.8526 15.8526 15.8526 16.1059 16.1059 16.1059 16.1059 16.7910 16.7910 16.7910 16.7910 18.6287 18.6287 k = 0.0000 0.3189 0.3093 ( 2660 PWs) bands (ev): -44.7692 -44.7692 -44.7688 -44.7688 -19.0575 -19.0575 -19.0561 -19.0561 -11.4978 -11.4978 -11.4940 -11.4940 -11.1610 -11.1610 -11.1608 -11.1608 11.4475 11.4475 11.5075 11.5075 12.3636 12.3636 12.4184 12.4184 12.9239 12.9239 12.9428 12.9428 14.0793 14.0793 14.1605 14.1605 14.9775 14.9775 14.9834 14.9834 15.8311 15.8311 15.8736 15.8736 16.0856 16.0856 16.1291 16.1291 16.7830 16.7830 16.8022 16.8022 18.6012 18.6012 k = 0.0000 0.3093 0.3093 ( 2654 PWs) bands (ev): -44.7694 -44.7694 -44.7686 -44.7686 -19.0581 -19.0581 -19.0552 -19.0552 -11.4994 -11.4994 -11.4918 -11.4918 -11.1612 -11.1612 -11.1608 -11.1608 11.4036 11.4036 11.5208 11.5208 12.3429 12.3429 12.4489 12.4489 12.9147 12.9147 12.9512 12.9512 14.0409 14.0409 14.2024 14.2024 14.9738 14.9738 14.9857 14.9857 15.8096 15.8096 15.8934 15.8934 16.0681 16.0681 16.1557 16.1557 16.7781 16.7781 16.8166 16.8166 18.5786 18.5786 k = 0.0000 0.2996 0.3093 ( 2660 PWs) bands (ev): -44.7696 -44.7696 -44.7684 -44.7684 -19.0589 -19.0589 -19.0545 -19.0545 -11.5009 -11.5009 -11.4894 -11.4894 -11.1616 -11.1616 -11.1609 -11.1609 11.3524 11.3524 11.5215 11.5215 12.3282 12.3282 12.4787 12.4787 12.9069 12.9069 12.9584 12.9584 14.0045 14.0045 14.2444 14.2444 14.9694 14.9694 14.9876 14.9876 15.7883 15.7883 15.9111 15.9111 16.0535 16.0535 16.1864 16.1864 16.7762 16.7762 16.8342 16.8342 18.5606 18.5606 k = 0.0000 0.2899 0.3093 ( 2656 PWs) bands (ev): -44.7699 -44.7699 -44.7682 -44.7682 -19.0594 -19.0594 -19.0537 -19.0537 -11.5020 -11.5020 -11.4869 -11.4869 -11.1619 -11.1619 -11.1611 -11.1611 11.2955 11.2955 11.5099 11.5099 12.3196 12.3196 12.5054 12.5054 12.9018 12.9018 12.9644 12.9644 13.9702 13.9702 14.2859 14.2859 14.9644 14.9644 14.9892 14.9892 15.7674 15.7674 15.9260 15.9260 16.0416 16.0416 16.2222 16.2222 16.7774 16.7774 16.8550 16.8550 18.5472 18.5472 k = 0.0000 0.2803 0.3093 ( 2656 PWs) bands (ev): -44.7701 -44.7701 -44.7680 -44.7680 -19.0600 -19.0600 -19.0529 -19.0529 -11.5031 -11.5031 -11.4841 -11.4841 -11.1624 -11.1624 -11.1613 -11.1613 11.2339 11.2339 11.4866 11.4866 12.3165 12.3165 12.5267 12.5267 12.9009 12.9009 12.9694 12.9694 13.9383 13.9383 14.3261 14.3261 14.9585 14.9585 14.9905 14.9905 15.7468 15.7468 15.9379 15.9379 16.0323 16.0323 16.2638 16.2638 16.7815 16.7815 16.8788 16.8788 18.5380 18.5380 k = 0.0000 0.2706 0.3093 ( 2658 PWs) bands (ev): -44.7703 -44.7703 -44.7678 -44.7678 -19.0606 -19.0606 -19.0522 -19.0522 -11.5039 -11.5039 -11.4813 -11.4813 -11.1631 -11.1631 -11.1617 -11.1617 11.1688 11.1688 11.4532 11.4532 12.3176 12.3176 12.5406 12.5406 12.9050 12.9050 12.9742 12.9742 13.9090 13.9090 14.3644 14.3644 14.9517 14.9517 14.9915 14.9915 15.7267 15.7267 15.9467 15.9467 16.0257 16.0257 16.3116 16.3116 16.7885 16.7885 16.9057 16.9057 18.5329 18.5329 k = 0.0000 0.2609 0.3093 ( 2664 PWs) bands (ev): -44.7705 -44.7705 -44.7676 -44.7676 -19.0612 -19.0612 -19.0514 -19.0514 -11.5046 -11.5046 -11.4783 -11.4783 -11.1638 -11.1638 -11.1621 -11.1621 11.1010 11.1010 11.4113 11.4113 12.3215 12.3215 12.5462 12.5462 12.9134 12.9134 12.9802 12.9802 13.8823 13.8823 14.3997 14.3997 14.9439 14.9439 14.9922 14.9922 15.7072 15.7072 15.9520 15.9520 16.0222 16.0222 16.3655 16.3655 16.7983 16.7983 16.9355 16.9355 18.5316 18.5316 k = 0.0000 0.2513 0.3093 ( 2660 PWs) bands (ev): -44.7708 -44.7708 -44.7675 -44.7675 -19.0616 -19.0616 -19.0506 -19.0506 -11.5050 -11.5050 -11.4751 -11.4751 -11.1645 -11.1645 -11.1625 -11.1625 11.0314 11.0314 11.3629 11.3629 12.3267 12.3267 12.5435 12.5435 12.9230 12.9230 12.9906 12.9906 13.8582 13.8582 14.4314 14.4314 14.9351 14.9351 14.9928 14.9928 15.6883 15.6883 15.9527 15.9527 16.0237 16.0237 16.4251 16.4251 16.8110 16.8110 16.9682 16.9682 18.5336 18.5336 k = 0.0000 0.2416 0.3093 ( 2660 PWs) bands (ev): -44.7710 -44.7710 -44.7673 -44.7673 -19.0621 -19.0621 -19.0498 -19.0498 -11.5052 -11.5052 -11.4718 -11.4718 -11.1653 -11.1653 -11.1630 -11.1630 10.9606 10.9606 11.3094 11.3094 12.3319 12.3319 12.5336 12.5336 12.9295 12.9295 13.0085 13.0085 13.8368 13.8368 14.4586 14.4586 14.9252 14.9252 14.9932 14.9932 15.6702 15.6702 15.9479 15.9479 16.0317 16.0317 16.4896 16.4896 16.8268 16.8268 17.0037 17.0037 18.5386 18.5386 k = 0.0000 0.2320 0.3093 ( 2662 PWs) bands (ev): -44.7712 -44.7712 -44.7671 -44.7671 -19.0626 -19.0626 -19.0489 -19.0489 -11.5054 -11.5054 -11.4683 -11.4683 -11.1663 -11.1663 -11.1636 -11.1636 10.8894 10.8894 11.2523 11.2523 12.3364 12.3364 12.5182 12.5182 12.9312 12.9312 13.0344 13.0344 13.8179 13.8179 14.4806 14.4806 14.9145 14.9145 14.9935 14.9935 15.6527 15.6527 15.9384 15.9384 16.0463 16.0463 16.5582 16.5582 16.8460 16.8460 17.0419 17.0419 18.5462 18.5462 k = 0.0000 0.2223 0.3093 ( 2658 PWs) bands (ev): -44.7714 -44.7714 -44.7670 -44.7670 -19.0630 -19.0630 -19.0480 -19.0480 -11.5054 -11.5054 -11.4647 -11.4647 -11.1673 -11.1673 -11.1641 -11.1641 10.8181 10.8181 11.1928 11.1928 12.3393 12.3393 12.4987 12.4987 12.9292 12.9292 13.0660 13.0660 13.8015 13.8015 14.4970 14.4970 14.9031 14.9031 14.9936 14.9936 15.6355 15.6355 15.9258 15.9258 16.0664 16.0664 16.6296 16.6296 16.8692 16.8692 17.0828 17.0828 18.5559 18.5559 k = 0.0000 0.2126 0.3093 ( 2658 PWs) bands (ev): -44.7716 -44.7716 -44.7668 -44.7668 -19.0634 -19.0634 -19.0472 -19.0472 -11.5052 -11.5052 -11.4611 -11.4611 -11.1684 -11.1684 -11.1647 -11.1647 10.7472 10.7472 11.1318 11.1318 12.3404 12.3404 12.4764 12.4764 12.9249 12.9249 13.1009 13.1009 13.7876 13.7876 14.5074 14.5074 14.8913 14.8913 14.9932 14.9932 15.6183 15.6183 15.9115 15.9115 16.0911 16.0911 16.7019 16.7019 16.8974 16.8974 17.1264 17.1264 18.5673 18.5673 k = 0.0000 0.2030 0.3093 ( 2656 PWs) bands (ev): -44.7718 -44.7718 -44.7667 -44.7667 -19.0638 -19.0638 -19.0463 -19.0463 -11.5049 -11.5049 -11.4574 -11.4574 -11.1696 -11.1696 -11.1654 -11.1654 10.6773 10.6773 11.0701 11.0701 12.3393 12.3393 12.4521 12.4521 12.9193 12.9193 13.1377 13.1377 13.7760 13.7760 14.5120 14.5120 14.8795 14.8795 14.9922 14.9922 15.6006 15.6006 15.8967 15.8967 16.1198 16.1198 16.7728 16.7728 16.9324 16.9324 17.1728 17.1728 18.5798 18.5798 k = 0.0000 0.1933 0.3093 ( 2656 PWs) bands (ev): -44.7720 -44.7720 -44.7665 -44.7665 -19.0641 -19.0641 -19.0455 -19.0455 -11.5045 -11.5045 -11.4536 -11.4536 -11.1708 -11.1708 -11.1661 -11.1661 10.6086 10.6086 11.0083 11.0083 12.3362 12.3362 12.4267 12.4267 12.9127 12.9127 13.1753 13.1753 13.7667 13.7667 14.5110 14.5110 14.8679 14.8679 14.9902 14.9902 15.5820 15.5820 15.8822 15.8822 16.1519 16.1519 16.8389 16.8389 16.9768 16.9768 17.2220 17.2220 18.5931 18.5931 k = 0.0000 0.1836 0.3093 ( 2654 PWs) bands (ev): -44.7722 -44.7722 -44.7664 -44.7664 -19.0644 -19.0644 -19.0447 -19.0447 -11.5039 -11.5039 -11.4498 -11.4498 -11.1721 -11.1721 -11.1668 -11.1668 10.5416 10.5416 10.9471 10.9471 12.3311 12.3311 12.4007 12.4007 12.9057 12.9057 13.2129 13.2129 13.7596 13.7596 14.5049 14.5049 14.8568 14.8568 14.9870 14.9870 15.5622 15.5622 15.8686 15.8686 16.1865 16.1865 16.8977 16.8977 17.0322 17.0322 17.2744 17.2744 18.6066 18.6066 k = 0.0000 0.1740 0.3093 ( 2658 PWs) bands (ev): -44.7724 -44.7724 -44.7663 -44.7663 -19.0648 -19.0648 -19.0439 -19.0439 -11.5033 -11.5033 -11.4460 -11.4460 -11.1735 -11.1735 -11.1675 -11.1675 10.4764 10.4764 10.8869 10.8869 12.3240 12.3240 12.3746 12.3746 12.8985 12.8985 13.2500 13.2500 13.7547 13.7547 14.4945 14.4945 14.8462 14.8462 14.9822 14.9822 15.5410 15.5410 15.8562 15.8562 16.2228 16.2228 16.9502 16.9502 17.0964 17.0964 17.3301 17.3301 18.6200 18.6200 k = 0.0000 0.1643 0.3093 ( 2664 PWs) bands (ev): -44.7726 -44.7726 -44.7662 -44.7662 -19.0651 -19.0651 -19.0433 -19.0433 -11.5026 -11.5026 -11.4422 -11.4422 -11.1749 -11.1749 -11.1683 -11.1683 10.4135 10.4135 10.8282 10.8282 12.3150 12.3150 12.3491 12.3491 12.8912 12.8912 13.2861 13.2861 13.7520 13.7520 14.4807 14.4807 14.8361 14.8361 14.9757 14.9757 15.5186 15.5186 15.8452 15.8452 16.2601 16.2601 17.0002 17.0002 17.1648 17.1648 17.3897 17.3897 18.6327 18.6327 k = 0.0000 0.1546 0.3093 ( 2672 PWs) bands (ev): -44.7728 -44.7728 -44.7660 -44.7660 -19.0653 -19.0653 -19.0427 -19.0427 -11.5018 -11.5018 -11.4385 -11.4385 -11.1764 -11.1764 -11.1692 -11.1692 10.3530 10.3530 10.7713 10.7713 12.3036 12.3036 12.3251 12.3251 12.8840 12.8840 13.3207 13.3207 13.7517 13.7517 14.4642 14.4642 14.8267 14.8267 14.9672 14.9672 15.4950 15.4950 15.8356 15.8356 16.2974 16.2974 17.0505 17.0505 17.2333 17.2333 17.4533 17.4533 18.6445 18.6445 k = 0.0000 0.1450 0.3093 ( 2672 PWs) bands (ev): -44.7729 -44.7729 -44.7659 -44.7659 -19.0656 -19.0656 -19.0419 -19.0419 -11.5010 -11.5010 -11.4348 -11.4348 -11.1779 -11.1779 -11.1699 -11.1699 10.2952 10.2952 10.7164 10.7164 12.2880 12.2880 12.3050 12.3050 12.8770 12.8770 13.3534 13.3534 13.7539 13.7539 14.4461 14.4461 14.8178 14.8178 14.9567 14.9567 15.4707 15.4707 15.8274 15.8274 16.3342 16.3342 17.1031 17.1031 17.2992 17.2992 17.5207 17.5207 18.6549 18.6549 k = 0.0000 0.1353 0.3093 ( 2676 PWs) bands (ev): -44.7731 -44.7731 -44.7658 -44.7658 -19.0658 -19.0658 -19.0413 -19.0413 -11.5001 -11.5001 -11.4311 -11.4311 -11.1794 -11.1794 -11.1707 -11.1707 10.2402 10.2402 10.6640 10.6640 12.2675 12.2675 12.2899 12.2899 12.8702 12.8702 13.3837 13.3837 13.7586 13.7586 14.4270 14.4270 14.8094 14.8094 14.9441 14.9441 15.4461 15.4461 15.8204 15.8204 16.3696 16.3696 17.1586 17.1586 17.3615 17.3615 17.5913 17.5913 18.6637 18.6637 k = 0.0000 0.1256 0.3093 ( 2674 PWs) bands (ev): -44.7733 -44.7733 -44.7658 -44.7658 -19.0660 -19.0660 -19.0406 -19.0406 -11.4992 -11.4992 -11.4275 -11.4275 -11.1809 -11.1809 -11.1714 -11.1714 10.1884 10.1884 10.6143 10.6143 12.2456 12.2456 12.2769 12.2769 12.8639 12.8639 13.4111 13.4111 13.7661 13.7661 14.4078 14.4078 14.8015 14.8015 14.9297 14.9297 15.4215 15.4215 15.8145 15.8145 16.4032 16.4032 17.2172 17.2172 17.4197 17.4197 17.6638 17.6638 18.6706 18.6706 k = 0.0000 0.1160 0.3093 ( 2674 PWs) bands (ev): -44.7734 -44.7734 -44.7657 -44.7657 -19.0662 -19.0662 -19.0399 -19.0399 -11.4983 -11.4983 -11.4240 -11.4240 -11.1824 -11.1824 -11.1720 -11.1720 10.1398 10.1398 10.5674 10.5674 12.2242 12.2242 12.2645 12.2645 12.8578 12.8578 13.4354 13.4354 13.7762 13.7762 14.3889 14.3889 14.7939 14.7939 14.9134 14.9134 15.3973 15.3973 15.8095 15.8095 16.4346 16.4346 17.2789 17.2789 17.4741 17.4741 17.7368 17.7368 18.6754 18.6754 k = 0.0000 0.1063 0.3093 ( 2682 PWs) bands (ev): -44.7735 -44.7735 -44.7656 -44.7656 -19.0664 -19.0664 -19.0394 -19.0394 -11.4975 -11.4975 -11.4208 -11.4208 -11.1839 -11.1839 -11.1727 -11.1727 10.0945 10.0945 10.5237 10.5237 12.2038 12.2038 12.2525 12.2525 12.8522 12.8522 13.4562 13.4562 13.7889 13.7889 14.3709 14.3709 14.7867 14.7867 14.8955 14.8955 15.3740 15.3740 15.8052 15.8052 16.4636 16.4636 17.3431 17.3431 17.5249 17.5249 17.8089 17.8089 18.6780 18.6780 k = 0.0000 0.0966 0.3093 ( 2682 PWs) bands (ev): -44.7737 -44.7737 -44.7655 -44.7655 -19.0666 -19.0666 -19.0389 -19.0389 -11.4966 -11.4966 -11.4177 -11.4177 -11.1853 -11.1853 -11.1734 -11.1734 10.0528 10.0528 10.4831 10.4831 12.1847 12.1847 12.2409 12.2409 12.8471 12.8471 13.4738 13.4738 13.8038 13.8038 14.3543 14.3543 14.7799 14.7799 14.8764 14.8764 15.3518 15.3518 15.8017 15.8017 16.4901 16.4901 17.4093 17.4093 17.5723 17.5723 17.8788 17.8788 18.6785 18.6785 k = 0.0000 0.0870 0.3093 ( 2682 PWs) bands (ev): -44.7738 -44.7738 -44.7655 -44.7655 -19.0667 -19.0667 -19.0384 -19.0384 -11.4957 -11.4957 -11.4147 -11.4147 -11.1866 -11.1866 -11.1740 -11.1740 10.0147 10.0147 10.4460 10.4460 12.1672 12.1672 12.2299 12.2299 12.8424 12.8424 13.4881 13.4881 13.8204 13.8204 14.3396 14.3396 14.7733 14.7733 14.8565 14.8565 15.3310 15.3310 15.7988 15.7988 16.5139 16.5139 17.4766 17.4766 17.6163 17.6163 17.9452 17.9452 18.6769 18.6769 k = 0.0000 0.0773 0.3093 ( 2678 PWs) bands (ev): -44.7739 -44.7739 -44.7654 -44.7654 -19.0667 -19.0667 -19.0379 -19.0379 -11.4949 -11.4949 -11.4120 -11.4120 -11.1878 -11.1878 -11.1745 -11.1745 9.9803 9.9803 10.4125 10.4125 12.1512 12.1512 12.2196 12.2196 12.8382 12.8382 13.4996 13.4996 13.8379 13.8379 14.3270 14.3270 14.7669 14.7669 14.8363 14.8363 15.3119 15.3119 15.7963 15.7963 16.5352 16.5352 17.5442 17.5442 17.6567 17.6567 18.0072 18.0072 18.6736 18.6736 k = 0.0000 0.0677 0.3093 ( 2672 PWs) bands (ev): -44.7740 -44.7740 -44.7653 -44.7653 -19.0666 -19.0666 -19.0376 -19.0376 -11.4940 -11.4940 -11.4096 -11.4096 -11.1889 -11.1889 -11.1750 -11.1750 9.9498 9.9498 10.3826 10.3826 12.1370 12.1370 12.2102 12.2102 12.8344 12.8344 13.5087 13.5087 13.8554 13.8554 14.3169 14.3169 14.7606 14.7606 14.8165 14.8165 15.2946 15.2946 15.7943 15.7943 16.5538 16.5538 17.6110 17.6110 17.6935 17.6935 18.0635 18.0635 18.6691 18.6691 k = 0.0000 0.0580 0.3093 ( 2672 PWs) bands (ev): -44.7741 -44.7741 -44.7653 -44.7653 -19.0667 -19.0667 -19.0373 -19.0373 -11.4933 -11.4933 -11.4075 -11.4075 -11.1900 -11.1900 -11.1755 -11.1755 9.9232 9.9232 10.3566 10.3566 12.1245 12.1245 12.2018 12.2018 12.8312 12.8312 13.5157 13.5157 13.8721 13.8721 14.3091 14.3091 14.7538 14.7538 14.7981 14.7981 15.2793 15.2793 15.7927 15.7927 16.5699 16.5699 17.6756 17.6756 17.7265 17.7265 18.1131 18.1131 18.6640 18.6640 k = 0.0000 0.0483 0.3093 ( 2672 PWs) bands (ev): -44.7741 -44.7741 -44.7653 -44.7653 -19.0667 -19.0667 -19.0370 -19.0370 -11.4927 -11.4927 -11.4056 -11.4056 -11.1909 -11.1909 -11.1759 -11.1759 9.9006 9.9006 10.3343 10.3343 12.1138 12.1138 12.1945 12.1945 12.8284 12.8284 13.5210 13.5210 13.8873 13.8873 14.3038 14.3038 14.7458 14.7458 14.7827 14.7827 15.2662 15.2662 15.7914 15.7914 16.5835 16.5835 17.7358 17.7358 17.7559 17.7559 18.1549 18.1549 18.6593 18.6593 k = 0.0000 0.0387 0.3093 ( 2668 PWs) bands (ev): -44.7742 -44.7742 -44.7652 -44.7652 -19.0667 -19.0667 -19.0367 -19.0367 -11.4922 -11.4922 -11.4040 -11.4040 -11.1916 -11.1916 -11.1762 -11.1762 9.8820 9.8820 10.3161 10.3161 12.1051 12.1051 12.1884 12.1884 12.8262 12.8262 13.5249 13.5249 13.9004 13.9004 14.3007 14.3007 14.7362 14.7362 14.7715 14.7715 15.2553 15.2553 15.7904 15.7904 16.5945 16.5945 17.7762 17.7762 17.7952 17.7952 18.1879 18.1879 18.6558 18.6558 k = 0.0000 0.0290 0.3093 ( 2672 PWs) bands (ev): -44.7742 -44.7742 -44.7652 -44.7652 -19.0668 -19.0668 -19.0365 -19.0365 -11.4919 -11.4919 -11.4027 -11.4027 -11.1923 -11.1923 -11.1764 -11.1764 9.8675 9.8675 10.3018 10.3018 12.0982 12.0982 12.1835 12.1835 12.8244 12.8244 13.5278 13.5278 13.9108 13.9108 14.2992 14.2992 14.7258 14.7258 14.7644 14.7644 15.2468 15.2468 15.7896 15.7896 16.6031 16.6031 17.7962 17.7962 17.8424 17.8424 18.2115 18.2115 18.6542 18.6542 k = 0.0000 0.0193 0.3093 ( 2676 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0364 -19.0364 -11.4916 -11.4916 -11.4019 -11.4019 -11.1927 -11.1927 -11.1767 -11.1767 9.8571 9.8571 10.2916 10.2916 12.0933 12.0933 12.1800 12.1800 12.8231 12.8231 13.5297 13.5297 13.9184 13.9184 14.2988 14.2988 14.7167 14.7167 14.7602 14.7602 15.2407 15.2407 15.7891 15.7891 16.6092 16.6092 17.8102 17.8102 17.8801 17.8801 18.2264 18.2264 18.6543 18.6543 k = 0.0000 0.0097 0.3093 ( 2672 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0363 -19.0363 -11.4914 -11.4914 -11.4013 -11.4013 -11.1930 -11.1930 -11.1768 -11.1768 9.8508 9.8508 10.2854 10.2854 12.0903 12.0903 12.1779 12.1779 12.8224 12.8224 13.5308 13.5308 13.9230 13.9230 14.2990 14.2990 14.7105 14.7105 14.7580 14.7580 15.2370 15.2370 15.7888 15.7888 16.6128 16.6128 17.8186 17.8186 17.9045 17.9045 18.2340 18.2340 18.6551 18.6551 k = 0.0000 0.0000 0.3093 ( 2672 PWs) bands (ev): -44.7743 -44.7743 -44.7652 -44.7652 -19.0669 -19.0669 -19.0362 -19.0362 -11.4914 -11.4914 -11.4010 -11.4010 -11.1931 -11.1931 -11.1768 -11.1768 9.8487 9.8487 10.2834 10.2834 12.0893 12.0893 12.1772 12.1772 12.8221 12.8221 13.5311 13.5311 13.9245 13.9245 14.2990 14.2990 14.7084 14.7084 14.7573 14.7573 15.2358 15.2358 15.7887 15.7887 16.6141 16.6141 17.8214 17.8214 17.9131 17.9131 18.2363 18.2363 18.6556 18.6556 k = 0.0000 0.3286-0.0000 ( 2664 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0536 -19.0536 -19.0536 -19.0536 -11.4567 -11.4567 -11.4567 -11.4567 -11.1868 -11.1868 -11.1868 -11.1868 10.3125 10.3125 10.3125 10.3125 12.2303 12.2303 12.2303 12.2303 13.0132 13.0132 13.0132 13.0132 14.3965 14.3965 14.3965 14.3965 14.7795 14.7795 14.7795 14.7795 15.5767 15.5767 15.5767 15.5767 16.8710 16.8710 16.8710 16.8710 17.8725 17.8725 17.8725 17.8725 19.2878 19.2878 k = 0.0000 0.3286 0.0097 ( 2668 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0536 -19.0536 -19.0536 -19.0536 -11.4569 -11.4569 -11.4569 -11.4569 -11.1867 -11.1867 -11.1867 -11.1867 10.3145 10.3145 10.3145 10.3145 12.2309 12.2309 12.2309 12.2309 13.0129 13.0129 13.0129 13.0129 14.3967 14.3967 14.3967 14.3967 14.7801 14.7801 14.7801 14.7801 15.5771 15.5771 15.5771 15.5771 16.8685 16.8685 16.8685 16.8685 17.8698 17.8698 17.8698 17.8698 19.2879 19.2879 k = 0.0000 0.3286 0.0193 ( 2676 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0537 -19.0537 -19.0537 -19.0537 -11.4572 -11.4572 -11.4572 -11.4572 -11.1866 -11.1866 -11.1866 -11.1866 10.3204 10.3204 10.3204 10.3204 12.2327 12.2327 12.2327 12.2327 13.0122 13.0122 13.0122 13.0122 14.3972 14.3972 14.3972 14.3972 14.7820 14.7820 14.7820 14.7820 15.5781 15.5781 15.5781 15.5781 16.8610 16.8610 16.8610 16.8610 17.8617 17.8617 17.8617 17.8617 19.2880 19.2880 k = 0.0000 0.3286 0.0290 ( 2670 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0537 -19.0537 -19.0537 -19.0537 -11.4577 -11.4577 -11.4577 -11.4577 -11.1862 -11.1862 -11.1862 -11.1862 10.3304 10.3304 10.3304 10.3304 12.2356 12.2356 12.2356 12.2356 13.0109 13.0109 13.0109 13.0109 14.3980 14.3980 14.3980 14.3980 14.7852 14.7852 14.7852 14.7852 15.5799 15.5799 15.5799 15.5799 16.8487 16.8487 16.8487 16.8487 17.8484 17.8484 17.8484 17.8484 19.2879 19.2879 k = 0.0000 0.3286 0.0387 ( 2678 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0538 -19.0538 -19.0538 -19.0538 -11.4585 -11.4585 -11.4585 -11.4585 -11.1857 -11.1857 -11.1857 -11.1857 10.3442 10.3442 10.3442 10.3442 12.2397 12.2397 12.2397 12.2397 13.0092 13.0092 13.0092 13.0092 14.3991 14.3991 14.3991 14.3991 14.7895 14.7895 14.7895 14.7895 15.5824 15.5824 15.5824 15.5824 16.8317 16.8317 16.8317 16.8317 17.8302 17.8302 17.8302 17.8302 19.2872 19.2872 k = 0.0000 0.3286 0.0483 ( 2666 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0538 -19.0538 -19.0538 -19.0538 -11.4593 -11.4593 -11.4593 -11.4593 -11.1850 -11.1850 -11.1850 -11.1850 10.3620 10.3620 10.3620 10.3620 12.2449 12.2449 12.2449 12.2449 13.0070 13.0070 13.0070 13.0070 14.4003 14.4003 14.4003 14.4003 14.7951 14.7951 14.7951 14.7951 15.5857 15.5857 15.5857 15.5857 16.8103 16.8103 16.8103 16.8103 17.8072 17.8072 17.8072 17.8072 19.2853 19.2853 k = 0.0000 0.3286 0.0580 ( 2670 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0539 -19.0539 -19.0539 -19.0539 -11.4604 -11.4604 -11.4604 -11.4604 -11.1843 -11.1843 -11.1843 -11.1843 10.3835 10.3835 10.3835 10.3835 12.2511 12.2511 12.2511 12.2511 13.0043 13.0043 13.0043 13.0043 14.4016 14.4016 14.4016 14.4016 14.8016 14.8016 14.8016 14.8016 15.5897 15.5897 15.5897 15.5897 16.7848 16.7848 16.7848 16.7848 17.7799 17.7799 17.7799 17.7799 19.2817 19.2817 k = 0.0000 0.3286 0.0677 ( 2670 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0540 -19.0540 -19.0540 -19.0540 -11.4617 -11.4617 -11.4617 -11.4617 -11.1835 -11.1835 -11.1835 -11.1835 10.4088 10.4088 10.4088 10.4088 12.2583 12.2583 12.2583 12.2583 13.0013 13.0013 13.0013 13.0013 14.4028 14.4028 14.4028 14.4028 14.8092 14.8092 14.8092 14.8092 15.5945 15.5945 15.5945 15.5945 16.7555 16.7555 16.7555 16.7555 17.7485 17.7485 17.7485 17.7485 19.2757 19.2757 k = 0.0000 0.3286 0.0773 ( 2668 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0541 -19.0541 -19.0541 -19.0541 -11.4630 -11.4630 -11.4630 -11.4630 -11.1825 -11.1825 -11.1825 -11.1825 10.4377 10.4377 10.4377 10.4377 12.2664 12.2664 12.2664 12.2664 12.9978 12.9978 12.9978 12.9978 14.4038 14.4038 14.4038 14.4038 14.8175 14.8175 14.8175 14.8175 15.6000 15.6000 15.6000 15.6000 16.7229 16.7229 16.7229 16.7229 17.7135 17.7135 17.7135 17.7135 19.2667 19.2667 k = 0.0000 0.3286 0.0870 ( 2668 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0542 -19.0542 -19.0542 -19.0542 -11.4645 -11.4645 -11.4645 -11.4645 -11.1815 -11.1815 -11.1815 -11.1815 10.4702 10.4702 10.4702 10.4702 12.2753 12.2753 12.2753 12.2753 12.9940 12.9940 12.9940 12.9940 14.4044 14.4044 14.4044 14.4044 14.8266 14.8266 14.8266 14.8266 15.6064 15.6064 15.6064 15.6064 16.6874 16.6874 16.6874 16.6874 17.6751 17.6751 17.6751 17.6751 19.2543 19.2543 k = 0.0000 0.3286 0.0966 ( 2668 PWs) bands (ev): -44.7693 -44.7693 -44.7693 -44.7693 -19.0543 -19.0543 -19.0543 -19.0543 -11.4662 -11.4662 -11.4662 -11.4662 -11.1804 -11.1804 -11.1804 -11.1804 10.5061 10.5061 10.5061 10.5061 12.2850 12.2850 12.2850 12.2850 12.9900 12.9900 12.9900 12.9900 14.4043 14.4043 14.4043 14.4043 14.8363 14.8363 14.8363 14.8363 15.6137 15.6137 15.6137 15.6137 16.6496 16.6496 16.6496 16.6496 17.6338 17.6338 17.6338 17.6338 19.2380 19.2380 k = 0.0000 0.3286 0.1063 ( 2676 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0546 -19.0546 -19.0546 -19.0546 -11.4679 -11.4679 -11.4679 -11.4679 -11.1793 -11.1793 -11.1793 -11.1793 10.5452 10.5452 10.5452 10.5452 12.2952 12.2952 12.2952 12.2952 12.9856 12.9856 12.9856 12.9856 14.4035 14.4035 14.4035 14.4035 14.8463 14.8463 14.8463 14.8463 15.6218 15.6218 15.6218 15.6218 16.6099 16.6099 16.6099 16.6099 17.5899 17.5899 17.5899 17.5899 19.2176 19.2176 k = 0.0000 0.3286 0.1160 ( 2670 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0546 -19.0546 -19.0546 -19.0546 -11.4697 -11.4697 -11.4697 -11.4697 -11.1780 -11.1780 -11.1780 -11.1780 10.5874 10.5874 10.5874 10.5874 12.3059 12.3059 12.3059 12.3059 12.9811 12.9811 12.9811 12.9811 14.4016 14.4016 14.4016 14.4016 14.8567 14.8567 14.8567 14.8567 15.6308 15.6308 15.6308 15.6308 16.5689 16.5689 16.5689 16.5689 17.5438 17.5438 17.5438 17.5438 19.1931 19.1931 k = 0.0000 0.3286 0.1256 ( 2674 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0548 -19.0548 -19.0548 -19.0548 -11.4716 -11.4716 -11.4716 -11.4716 -11.1768 -11.1768 -11.1768 -11.1768 10.6326 10.6326 10.6326 10.6326 12.3170 12.3170 12.3170 12.3170 12.9764 12.9764 12.9764 12.9764 14.3984 14.3984 14.3984 14.3984 14.8672 14.8672 14.8672 14.8672 15.6407 15.6407 15.6407 15.6407 16.5272 16.5272 16.5272 16.5272 17.4958 17.4958 17.4958 17.4958 19.1647 19.1647 k = 0.0000 0.3286 0.1353 ( 2670 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0549 -19.0549 -19.0549 -19.0549 -11.4735 -11.4735 -11.4735 -11.4735 -11.1755 -11.1755 -11.1755 -11.1755 10.6804 10.6804 10.6804 10.6804 12.3282 12.3282 12.3282 12.3282 12.9716 12.9716 12.9716 12.9716 14.3937 14.3937 14.3937 14.3937 14.8776 14.8776 14.8776 14.8776 15.6515 15.6515 15.6515 15.6515 16.4854 16.4854 16.4854 16.4854 17.4463 17.4463 17.4463 17.4463 19.1327 19.1327 k = 0.0000 0.3286 0.1450 ( 2666 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0551 -19.0551 -19.0551 -19.0551 -11.4754 -11.4754 -11.4754 -11.4754 -11.1742 -11.1742 -11.1742 -11.1742 10.7306 10.7306 10.7306 10.7306 12.3393 12.3393 12.3393 12.3393 12.9669 12.9669 12.9669 12.9669 14.3872 14.3872 14.3872 14.3872 14.8878 14.8878 14.8878 14.8878 15.6632 15.6632 15.6632 15.6632 16.4441 16.4441 16.4441 16.4441 17.3957 17.3957 17.3957 17.3957 19.0976 19.0976 k = 0.0000 0.3286 0.1546 ( 2666 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0552 -19.0552 -19.0552 -19.0552 -11.4773 -11.4773 -11.4773 -11.4773 -11.1730 -11.1730 -11.1730 -11.1730 10.7830 10.7830 10.7830 10.7830 12.3503 12.3503 12.3503 12.3503 12.9621 12.9621 12.9621 12.9621 14.3787 14.3787 14.3787 14.3787 14.8978 14.8978 14.8978 14.8978 15.6757 15.6757 15.6757 15.6757 16.4037 16.4037 16.4037 16.4037 17.3443 17.3443 17.3443 17.3443 19.0602 19.0602 k = 0.0000 0.3286 0.1643 ( 2670 PWs) bands (ev): -44.7692 -44.7692 -44.7692 -44.7692 -19.0554 -19.0554 -19.0554 -19.0554 -11.4792 -11.4792 -11.4792 -11.4792 -11.1717 -11.1717 -11.1717 -11.1717 10.8373 10.8373 10.8373 10.8373 12.3608 12.3608 12.3608 12.3608 12.9575 12.9575 12.9575 12.9575 14.3681 14.3681 14.3681 14.3681 14.9073 14.9073 14.9073 14.9073 15.6891 15.6891 15.6891 15.6891 16.3648 16.3648 16.3648 16.3648 17.2926 17.2926 17.2926 17.2926 19.0210 19.0210 k = 0.0000 0.3286 0.1740 ( 2674 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0556 -19.0556 -19.0556 -19.0556 -11.4811 -11.4811 -11.4811 -11.4811 -11.1705 -11.1705 -11.1705 -11.1705 10.8930 10.8930 10.8930 10.8930 12.3707 12.3707 12.3707 12.3707 12.9531 12.9531 12.9531 12.9531 14.3552 14.3552 14.3552 14.3552 14.9164 14.9164 14.9164 14.9164 15.7031 15.7031 15.7031 15.7031 16.3280 16.3280 16.3280 16.3280 17.2411 17.2411 17.2411 17.2411 18.9809 18.9809 k = 0.0000 0.3286 0.1836 ( 2668 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0557 -19.0557 -19.0557 -19.0557 -11.4829 -11.4829 -11.4829 -11.4829 -11.1693 -11.1693 -11.1693 -11.1693 10.9498 10.9498 10.9498 10.9498 12.3796 12.3796 12.3796 12.3796 12.9490 12.9490 12.9490 12.9490 14.3400 14.3400 14.3400 14.3400 14.9249 14.9249 14.9249 14.9249 15.7177 15.7177 15.7177 15.7177 16.2935 16.2935 16.2935 16.2935 17.1901 17.1901 17.1901 17.1901 18.9405 18.9405 k = 0.0000 0.3286 0.1933 ( 2668 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0559 -19.0559 -19.0559 -19.0559 -11.4847 -11.4847 -11.4847 -11.4847 -11.1682 -11.1682 -11.1682 -11.1682 11.0072 11.0072 11.0072 11.0072 12.3875 12.3875 12.3875 12.3875 12.9452 12.9452 12.9452 12.9452 14.3227 14.3227 14.3227 14.3227 14.9329 14.9329 14.9329 14.9329 15.7327 15.7327 15.7327 15.7327 16.2617 16.2617 16.2617 16.2617 17.1402 17.1402 17.1402 17.1402 18.9006 18.9006 k = 0.0000 0.3286 0.2030 ( 2668 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0560 -19.0560 -19.0560 -19.0560 -11.4863 -11.4863 -11.4863 -11.4863 -11.1671 -11.1671 -11.1671 -11.1671 11.0648 11.0648 11.0648 11.0648 12.3941 12.3941 12.3941 12.3941 12.9419 12.9419 12.9419 12.9419 14.3033 14.3033 14.3033 14.3033 14.9402 14.9402 14.9402 14.9402 15.7479 15.7479 15.7479 15.7479 16.2329 16.2329 16.2329 16.2329 17.0918 17.0918 17.0918 17.0918 18.8619 18.8619 k = 0.0000 0.3286 0.2126 ( 2672 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0562 -19.0562 -19.0562 -19.0562 -11.4879 -11.4879 -11.4879 -11.4879 -11.1661 -11.1661 -11.1661 -11.1661 11.1218 11.1218 11.1218 11.1218 12.3992 12.3992 12.3992 12.3992 12.9391 12.9391 12.9391 12.9391 14.2823 14.2823 14.2823 14.2823 14.9470 14.9470 14.9470 14.9470 15.7630 15.7630 15.7630 15.7630 16.2073 16.2073 16.2073 16.2073 17.0455 17.0455 17.0455 17.0455 18.8248 18.8248 k = 0.0000 0.3286 0.2223 ( 2672 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0563 -19.0563 -19.0563 -19.0563 -11.4894 -11.4894 -11.4894 -11.4894 -11.1652 -11.1652 -11.1652 -11.1652 11.1777 11.1777 11.1777 11.1777 12.4027 12.4027 12.4027 12.4027 12.9368 12.9368 12.9368 12.9368 14.2601 14.2601 14.2601 14.2601 14.9532 14.9532 14.9532 14.9532 15.7778 15.7778 15.7778 15.7778 16.1849 16.1849 16.1849 16.1849 17.0016 17.0016 17.0016 17.0016 18.7900 18.7900 k = 0.0000 0.3286 0.2319 ( 2670 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0564 -19.0564 -19.0564 -19.0564 -11.4907 -11.4907 -11.4907 -11.4907 -11.1643 -11.1643 -11.1643 -11.1643 11.2318 11.2318 11.2318 11.2318 12.4045 12.4045 12.4045 12.4045 12.9350 12.9350 12.9350 12.9350 14.2373 14.2373 14.2373 14.2373 14.9588 14.9588 14.9588 14.9588 15.7919 15.7919 15.7919 15.7919 16.1657 16.1657 16.1657 16.1657 16.9607 16.9607 16.9607 16.9607 18.7578 18.7578 k = 0.0000 0.3286 0.2416 ( 2670 PWs) bands (ev): -44.7691 -44.7691 -44.7691 -44.7691 -19.0565 -19.0565 -19.0565 -19.0565 -11.4920 -11.4920 -11.4920 -11.4920 -11.1636 -11.1636 -11.1636 -11.1636 11.2831 11.2831 11.2831 11.2831 12.4047 12.4047 12.4047 12.4047 12.9339 12.9339 12.9339 12.9339 14.2145 14.2145 14.2145 14.2145 14.9638 14.9638 14.9638 14.9638 15.8051 15.8051 15.8051 15.8051 16.1496 16.1496 16.1496 16.1496 16.9232 16.9232 16.9232 16.9232 18.7286 18.7286 k = 0.0000 0.3286 0.2513 ( 2672 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0566 -19.0566 -19.0566 -19.0566 -11.4930 -11.4930 -11.4930 -11.4930 -11.1629 -11.1629 -11.1629 -11.1629 11.3307 11.3307 11.3307 11.3307 12.4035 12.4035 12.4035 12.4035 12.9332 12.9332 12.9332 12.9332 14.1925 14.1925 14.1925 14.1925 14.9681 14.9681 14.9681 14.9681 15.8171 15.8171 15.8171 15.8171 16.1365 16.1365 16.1365 16.1365 16.8897 16.8897 16.8897 16.8897 18.7028 18.7028 k = 0.0000 0.3286 0.2609 ( 2664 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0566 -19.0566 -19.0566 -19.0566 -11.4939 -11.4939 -11.4939 -11.4939 -11.1622 -11.1622 -11.1622 -11.1622 11.3737 11.3737 11.3737 11.3737 12.4011 12.4011 12.4011 12.4011 12.9329 12.9329 12.9329 12.9329 14.1722 14.1722 14.1722 14.1722 14.9719 14.9719 14.9719 14.9719 15.8277 15.8277 15.8277 15.8277 16.1262 16.1262 16.1262 16.1262 16.8605 16.8605 16.8605 16.8605 18.6805 18.6805 k = 0.0000 0.3286 0.2706 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0567 -19.0567 -19.0567 -19.0567 -11.4947 -11.4947 -11.4947 -11.4947 -11.1617 -11.1617 -11.1617 -11.1617 11.4109 11.4109 11.4109 11.4109 12.3981 12.3981 12.3981 12.3981 12.9329 12.9329 12.9329 12.9329 14.1543 14.1543 14.1543 14.1543 14.9750 14.9750 14.9750 14.9750 15.8365 15.8365 15.8365 15.8365 16.1183 16.1183 16.1183 16.1183 16.8360 16.8360 16.8360 16.8360 18.6620 18.6620 k = 0.0000 0.3286 0.2803 ( 2668 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0568 -19.0568 -19.0568 -19.0568 -11.4953 -11.4953 -11.4953 -11.4953 -11.1614 -11.1614 -11.1614 -11.1614 11.4414 11.4414 11.4414 11.4414 12.3948 12.3948 12.3948 12.3948 12.9331 12.9331 12.9331 12.9331 14.1395 14.1395 14.1395 14.1395 14.9774 14.9774 14.9774 14.9774 15.8435 15.8435 15.8435 15.8435 16.1126 16.1126 16.1126 16.1126 16.8165 16.8165 16.8165 16.8165 18.6475 18.6475 k = 0.0000 0.3286 0.2899 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0567 -19.0567 -19.0567 -19.0567 -11.4956 -11.4956 -11.4956 -11.4956 -11.1611 -11.1611 -11.1611 -11.1611 11.4640 11.4640 11.4640 11.4640 12.3920 12.3920 12.3920 12.3920 12.9333 12.9333 12.9333 12.9333 14.1284 14.1284 14.1284 14.1284 14.9792 14.9792 14.9792 14.9792 15.8485 15.8485 15.8485 15.8485 16.1088 16.1088 16.1088 16.1088 16.8024 16.8024 16.8024 16.8024 18.6371 18.6371 k = 0.0000 0.3286 0.2996 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0568 -19.0568 -19.0568 -19.0568 -11.4959 -11.4959 -11.4959 -11.4959 -11.1610 -11.1610 -11.1610 -11.1610 11.4780 11.4780 11.4780 11.4780 12.3900 12.3900 12.3900 12.3900 12.9335 12.9335 12.9335 12.9335 14.1216 14.1216 14.1216 14.1216 14.9803 14.9803 14.9803 14.9803 15.8516 15.8516 15.8516 15.8516 16.1066 16.1066 16.1066 16.1066 16.7939 16.7939 16.7939 16.7939 18.6308 18.6308 k = 0.0000 0.3286 0.3093 ( 2660 PWs) bands (ev): -44.7690 -44.7690 -44.7690 -44.7690 -19.0568 -19.0568 -19.0568 -19.0568 -11.4960 -11.4960 -11.4960 -11.4960 -11.1609 -11.1609 -11.1609 -11.1609 11.4827 11.4827 11.4827 11.4827 12.3893 12.3893 12.3893 12.3893 12.9336 12.9336 12.9336 12.9336 14.1193 14.1193 14.1193 14.1193 14.9807 14.9807 14.9807 14.9807 15.8526 15.8526 15.8526 15.8526 16.1059 16.1059 16.1059 16.1059 16.7910 16.7910 16.7910 16.7910 18.6287 18.6287 k = 0.5000-0.0000 0.3093 ( 2640 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1637 -19.1637 -19.1384 -19.1384 -11.6596 -11.6596 -11.6493 -11.6493 -11.4052 -11.4052 -11.3208 -11.3208 12.0836 12.0836 12.0991 12.0991 12.4051 12.4051 12.4361 12.4361 12.8651 12.8651 13.6099 13.6099 13.6425 13.6425 14.1721 14.1721 14.2967 14.2967 14.8096 14.8096 15.2367 15.2367 16.1363 16.1363 16.8949 16.8949 17.8802 17.8802 17.9527 17.9527 18.5788 18.5788 18.9891 18.9891 k = 0.5000-0.0000 0.2996 ( 2644 PWs) bands (ev): -44.7413 -44.7413 -44.7319 -44.7319 -19.1638 -19.1638 -19.1384 -19.1384 -11.6597 -11.6597 -11.6493 -11.6493 -11.4057 -11.4057 -11.3204 -11.3204 12.0805 12.0805 12.1040 12.1040 12.4028 12.4028 12.4413 12.4413 12.8654 12.8654 13.5959 13.5959 13.6577 13.6577 14.1726 14.1726 14.2972 14.2972 14.8107 14.8107 15.2343 15.2343 16.1357 16.1357 16.8931 16.8931 17.8767 17.8767 17.9553 17.9553 18.5728 18.5728 18.9887 18.9887 k = 0.5000-0.0000 0.2899 ( 2650 PWs) bands (ev): -44.7414 -44.7414 -44.7318 -44.7318 -19.1642 -19.1642 -19.1382 -19.1382 -11.6600 -11.6600 -11.6491 -11.6491 -11.4072 -11.4072 -11.3191 -11.3191 12.0756 12.0756 12.1143 12.1143 12.3988 12.3988 12.4540 12.4540 12.8664 12.8664 13.5735 13.5735 13.6835 13.6835 14.1741 14.1741 14.2989 14.2989 14.8140 14.8140 15.2273 15.2273 16.1339 16.1339 16.8875 16.8875 17.8672 17.8672 17.9617 17.9617 18.5551 18.5551 18.9875 18.9875 k = 0.5000-0.0000 0.2803 ( 2650 PWs) bands (ev): -44.7414 -44.7414 -44.7317 -44.7317 -19.1647 -19.1647 -19.1378 -19.1378 -11.6604 -11.6604 -11.6489 -11.6489 -11.4094 -11.4094 -11.3170 -11.3170 12.0718 12.0718 12.1272 12.1272 12.3962 12.3962 12.4710 12.4710 12.8680 12.8680 13.5509 13.5509 13.7117 13.7117 14.1767 14.1767 14.3017 14.3017 14.8194 14.8194 15.2157 15.2157 16.1309 16.1309 16.8782 16.8782 17.8537 17.8537 17.9700 17.9700 18.5267 18.5267 18.9854 18.9854 k = 0.5000-0.0000 0.2706 ( 2646 PWs) bands (ev): -44.7415 -44.7415 -44.7316 -44.7316 -19.1652 -19.1652 -19.1373 -19.1373 -11.6609 -11.6609 -11.6485 -11.6485 -11.4123 -11.4123 -11.3142 -11.3142 12.0695 12.0695 12.1420 12.1420 12.3962 12.3962 12.4912 12.4912 12.8703 12.8703 13.5291 13.5291 13.7413 13.7413 14.1802 14.1802 14.3055 14.3055 14.8271 14.8271 15.1997 15.1997 16.1264 16.1264 16.8652 16.8652 17.8376 17.8376 17.9785 17.9785 18.4890 18.4890 18.9825 18.9825 k = 0.5000-0.0000 0.2609 ( 2646 PWs) bands (ev): -44.7417 -44.7417 -44.7315 -44.7315 -19.1660 -19.1660 -19.1366 -19.1366 -11.6616 -11.6616 -11.6482 -11.6482 -11.4158 -11.4158 -11.3109 -11.3109 12.0687 12.0687 12.1585 12.1585 12.3993 12.3993 12.5142 12.5142 12.8732 12.8732 13.5083 13.5083 13.7719 13.7719 14.1849 14.1849 14.3103 14.3103 14.8369 14.8369 15.1797 15.1797 16.1205 16.1205 16.8487 16.8487 17.8195 17.8195 17.9863 17.9863 18.4437 18.4437 18.9789 18.9789 k = 0.5000-0.0000 0.2513 ( 2650 PWs) bands (ev): -44.7418 -44.7418 -44.7314 -44.7314 -19.1669 -19.1669 -19.1359 -19.1359 -11.6624 -11.6624 -11.6478 -11.6478 -11.4197 -11.4197 -11.3072 -11.3072 12.0694 12.0694 12.1766 12.1766 12.4055 12.4055 12.5396 12.5396 12.8768 12.8768 13.4886 13.4886 13.8034 13.8034 14.1907 14.1907 14.3161 14.3161 14.8488 14.8488 15.1562 15.1562 16.1129 16.1129 16.8288 16.8288 17.7997 17.7997 17.9924 17.9924 18.3929 18.3929 18.9744 18.9744 k = 0.5000-0.0000 0.2416 ( 2648 PWs) bands (ev): -44.7419 -44.7419 -44.7312 -44.7312 -19.1679 -19.1679 -19.1350 -19.1350 -11.6632 -11.6632 -11.6473 -11.6473 -11.4240 -11.4240 -11.3031 -11.3031 12.0714 12.0714 12.1961 12.1961 12.4151 12.4151 12.5673 12.5673 12.8811 12.8811 13.4700 13.4700 13.8355 13.8355 14.1977 14.1977 14.3228 14.3228 14.8627 14.8627 15.1296 15.1296 16.1035 16.1035 16.8055 16.8055 17.7782 17.7782 17.9958 17.9958 18.3390 18.3390 18.9692 18.9692 k = 0.5000-0.0000 0.2319 ( 2648 PWs) bands (ev): -44.7421 -44.7421 -44.7310 -44.7310 -19.1690 -19.1690 -19.1341 -19.1341 -11.6641 -11.6641 -11.6469 -11.6469 -11.4284 -11.4284 -11.2989 -11.2989 12.0746 12.0746 12.2170 12.2170 12.4281 12.4281 12.5971 12.5971 12.8861 12.8861 13.4525 13.4525 13.8680 13.8680 14.2060 14.2060 14.3303 14.3303 14.8782 14.8782 15.1008 15.1008 16.0923 16.0923 16.7790 16.7790 17.7552 17.7552 17.9945 17.9945 18.2851 18.2851 18.9633 18.9633 k = 0.5000-0.0000 0.2223 ( 2648 PWs) bands (ev): -44.7423 -44.7423 -44.7308 -44.7308 -19.1701 -19.1701 -19.1332 -19.1332 -11.6650 -11.6650 -11.6465 -11.6465 -11.4331 -11.4331 -11.2945 -11.2945 12.0789 12.0789 12.2392 12.2392 12.4445 12.4445 12.6287 12.6287 12.8919 12.8919 13.4362 13.4362 13.9005 13.9005 14.2157 14.2157 14.3385 14.3385 14.8944 14.8944 15.0713 15.0713 16.0791 16.0791 16.7495 16.7495 17.7304 17.7304 17.9855 17.9855 18.2355 18.2355 18.9567 18.9567 k = 0.5000-0.0000 0.2126 ( 2652 PWs) bands (ev): -44.7425 -44.7425 -44.7307 -44.7307 -19.1713 -19.1713 -19.1323 -19.1323 -11.6659 -11.6659 -11.6461 -11.6461 -11.4378 -11.4378 -11.2902 -11.2902 12.0839 12.0839 12.2628 12.2628 12.4642 12.4642 12.6618 12.6618 12.8985 12.8985 13.4209 13.4209 13.9328 13.9328 14.2271 14.2271 14.3474 14.3474 14.9086 14.9086 15.0441 15.0441 16.0638 16.0638 16.7171 16.7171 17.7039 17.7039 17.9645 17.9645 18.1954 18.1954 18.9495 18.9495 k = 0.5000-0.0000 0.2030 ( 2656 PWs) bands (ev): -44.7427 -44.7427 -44.7305 -44.7305 -19.1725 -19.1725 -19.1314 -19.1314 -11.6669 -11.6669 -11.6457 -11.6457 -11.4425 -11.4425 -11.2858 -11.2858 12.0897 12.0897 12.2877 12.2877 12.4869 12.4869 12.6961 12.6961 12.9062 12.9062 13.4067 13.4067 13.9641 13.9641 14.2404 14.2404 14.3569 14.3569 14.9141 14.9141 15.0267 15.0267 16.0466 16.0466 16.6819 16.6819 17.6754 17.6754 17.9286 17.9286 18.1688 18.1688 18.9416 18.9416 k = 0.5000-0.0000 0.1933 ( 2664 PWs) bands (ev): -44.7429 -44.7429 -44.7303 -44.7303 -19.1738 -19.1738 -19.1305 -19.1305 -11.6680 -11.6680 -11.6454 -11.6454 -11.4473 -11.4473 -11.2814 -11.2814 12.0959 12.0959 12.3141 12.3141 12.5125 12.5125 12.7310 12.7310 12.9152 12.9152 13.3935 13.3935 13.9940 13.9940 14.2556 14.2556 14.3671 14.3671 14.9019 14.9019 15.0286 15.0286 16.0275 16.0275 16.6442 16.6442 17.6447 17.6447 17.8797 17.8797 18.1545 18.1545 18.9333 18.9333 k = 0.5000-0.0000 0.1836 ( 2660 PWs) bands (ev): -44.7431 -44.7431 -44.7300 -44.7300 -19.1749 -19.1749 -19.1296 -19.1296 -11.6689 -11.6689 -11.6450 -11.6450 -11.4519 -11.4519 -11.2771 -11.2771 12.1025 12.1025 12.3421 12.3421 12.5406 12.5406 12.7657 12.7657 12.9261 12.9261 13.3814 13.3814 14.0215 14.0215 14.2730 14.2730 14.3780 14.3780 14.8743 14.8743 15.0481 15.0481 16.0066 16.0066 16.6040 16.6040 17.6116 17.6116 17.8226 17.8226 18.1488 18.1488 18.9244 18.9244 k = 0.5000-0.0000 0.1740 ( 2662 PWs) bands (ev): -44.7433 -44.7433 -44.7298 -44.7298 -19.1760 -19.1760 -19.1287 -19.1287 -11.6699 -11.6699 -11.6447 -11.6447 -11.4565 -11.4565 -11.2729 -11.2729 12.1093 12.1093 12.3717 12.3717 12.5709 12.5709 12.7992 12.7992 12.9396 12.9396 13.3703 13.3703 14.0460 14.0460 14.2922 14.2922 14.3903 14.3903 14.8398 14.8398 15.0776 15.0776 15.9841 15.9841 16.5617 16.5617 17.5756 17.5756 17.7618 17.7618 18.1479 18.1479 18.9152 18.9152 k = 0.5000-0.0000 0.1643 ( 2658 PWs) bands (ev): -44.7435 -44.7435 -44.7296 -44.7296 -19.1771 -19.1771 -19.1278 -19.1278 -11.6708 -11.6708 -11.6444 -11.6444 -11.4609 -11.4609 -11.2688 -11.2688 12.1162 12.1162 12.4029 12.4029 12.6030 12.6030 12.8299 12.8299 12.9570 12.9570 13.3602 13.3602 14.0667 14.0667 14.3123 14.3123 14.4047 14.4047 14.8031 14.8031 15.1131 15.1131 15.9601 15.9601 16.5174 16.5174 17.5365 17.5365 17.7002 17.7002 18.1497 18.1497 18.9056 18.9056 k = 0.5000-0.0000 0.1546 ( 2656 PWs) bands (ev): -44.7437 -44.7437 -44.7294 -44.7294 -19.1782 -19.1782 -19.1269 -19.1269 -11.6717 -11.6717 -11.6442 -11.6442 -11.4652 -11.4652 -11.2648 -11.2648 12.1230 12.1230 12.4358 12.4358 12.6365 12.6365 12.8563 12.8563 12.9793 12.9793 13.3512 13.3512 14.0828 14.0828 14.3313 14.3313 14.4230 14.4230 14.7665 14.7665 15.1531 15.1531 15.9352 15.9352 16.4712 16.4712 17.4938 17.4938 17.6399 17.6399 18.1529 18.1529 18.8956 18.8956 k = 0.5000-0.0000 0.1450 ( 2648 PWs) bands (ev): -44.7438 -44.7438 -44.7292 -44.7292 -19.1792 -19.1792 -19.1260 -19.1260 -11.6726 -11.6726 -11.6439 -11.6439 -11.4693 -11.4693 -11.2609 -11.2609 12.1298 12.1298 12.4702 12.4702 12.6711 12.6711 12.8776 12.8776 13.0069 13.0069 13.3434 13.3434 14.0940 14.0940 14.3469 14.3469 14.4469 14.4469 14.7318 14.7318 15.1968 15.1968 15.9095 15.9095 16.4234 16.4234 17.4473 17.4473 17.5822 17.5822 18.1568 18.1568 18.8854 18.8854 k = 0.5000-0.0000 0.1353 ( 2640 PWs) bands (ev): -44.7440 -44.7440 -44.7290 -44.7290 -19.1801 -19.1801 -19.1252 -19.1252 -11.6734 -11.6734 -11.6436 -11.6436 -11.4731 -11.4731 -11.2573 -11.2573 12.1363 12.1363 12.5062 12.5062 12.7062 12.7062 12.8945 12.8945 13.0386 13.0386 13.3368 13.3368 14.0997 14.0997 14.3577 14.3577 14.4770 14.4770 14.7005 14.7005 15.2438 15.2438 15.8835 15.8835 16.3743 16.3743 17.3973 17.3973 17.5277 17.5277 18.1610 18.1610 18.8749 18.8749 k = 0.5000-0.0000 0.1256 ( 2644 PWs) bands (ev): -44.7442 -44.7442 -44.7288 -44.7288 -19.1811 -19.1811 -19.1246 -19.1246 -11.6743 -11.6743 -11.6435 -11.6435 -11.4769 -11.4769 -11.2540 -11.2540 12.1426 12.1426 12.5435 12.5435 12.7415 12.7415 12.9081 12.9081 13.0727 13.0727 13.3317 13.3317 14.0997 14.0997 14.3638 14.3638 14.5123 14.5123 14.6739 14.6739 15.2937 15.2937 15.8577 15.8577 16.3239 16.3239 17.3446 17.3446 17.4761 17.4761 18.1652 18.1652 18.8638 18.8638 k = 0.5000-0.0000 0.1160 ( 2646 PWs) bands (ev): -44.7444 -44.7444 -44.7286 -44.7286 -19.1820 -19.1820 -19.1239 -19.1239 -11.6751 -11.6751 -11.6433 -11.6433 -11.4804 -11.4804 -11.2508 -11.2508 12.1486 12.1486 12.5821 12.5821 12.7765 12.7765 12.9195 12.9195 13.1071 13.1071 13.3285 13.3285 14.0935 14.0935 14.3662 14.3662 14.5507 14.5507 14.6535 14.6535 15.3459 15.3459 15.8327 15.8327 16.2728 16.2728 17.2905 17.2905 17.4269 17.4269 18.1692 18.1692 18.8520 18.8520 k = 0.5000-0.0000 0.1063 ( 2650 PWs) bands (ev): -44.7445 -44.7445 -44.7285 -44.7285 -19.1829 -19.1829 -19.1234 -19.1234 -11.6759 -11.6759 -11.6432 -11.6432 -11.4837 -11.4837 -11.2479 -11.2479 12.1542 12.1542 12.6215 12.6215 12.8106 12.8106 12.9295 12.9295 13.1399 13.1399 13.3278 13.3278 14.0811 14.0811 14.3660 14.3660 14.5876 14.5876 14.6430 14.6430 15.3997 15.3997 15.8093 15.8093 16.2210 16.2210 17.2362 17.2362 17.3794 17.3794 18.1727 18.1727 18.8383 18.8383 k = 0.5000-0.0000 0.0966 ( 2646 PWs) bands (ev): -44.7447 -44.7447 -44.7283 -44.7283 -19.1837 -19.1837 -19.1227 -19.1227 -11.6766 -11.6766 -11.6430 -11.6430 -11.4868 -11.4868 -11.2451 -11.2451 12.1594 12.1594 12.6616 12.6616 12.8434 12.8434 12.9388 12.9388 13.1692 13.1692 13.3308 13.3308 14.0627 14.0627 14.3642 14.3642 14.6063 14.6063 14.6576 14.6576 15.4542 15.4542 15.7884 15.7884 16.1692 16.1692 17.1826 17.1826 17.3335 17.3335 18.1757 18.1757 18.8200 18.8200 k = 0.5000-0.0000 0.0870 ( 2646 PWs) bands (ev): -44.7448 -44.7448 -44.7282 -44.7282 -19.1844 -19.1844 -19.1222 -19.1222 -11.6772 -11.6772 -11.6429 -11.6429 -11.4896 -11.4896 -11.2426 -11.2426 12.1642 12.1642 12.7020 12.7020 12.8740 12.8740 12.9479 12.9479 13.1928 13.1928 13.3387 13.3387 14.0390 14.0390 14.3616 14.3616 14.6063 14.6063 14.6962 14.6962 15.5076 15.5076 15.7714 15.7714 16.1177 16.1177 17.1303 17.1303 17.2891 17.2891 18.1779 18.1779 18.7880 18.7880 k = 0.5000-0.0000 0.0773 ( 2642 PWs) bands (ev): -44.7449 -44.7449 -44.7280 -44.7280 -19.1851 -19.1851 -19.1217 -19.1217 -11.6778 -11.6778 -11.6428 -11.6428 -11.4921 -11.4921 -11.2403 -11.2403 12.1685 12.1685 12.7421 12.7421 12.9013 12.9013 12.9576 12.9576 13.2093 13.2093 13.3523 13.3523 14.0114 14.0114 14.3587 14.3587 14.6045 14.6045 14.7401 14.7401 15.5571 15.5571 15.7606 15.7606 16.0674 16.0674 17.0797 17.0797 17.2466 17.2466 18.1791 18.1791 18.7276 18.7276 k = 0.5000-0.0000 0.0677 ( 2642 PWs) bands (ev): -44.7450 -44.7450 -44.7279 -44.7279 -19.1856 -19.1856 -19.1213 -19.1213 -11.6783 -11.6783 -11.6427 -11.6427 -11.4943 -11.4943 -11.2382 -11.2382 12.1724 12.1724 12.7815 12.7815 12.9236 12.9236 12.9693 12.9693 13.2189 13.2189 13.3705 13.3705 13.9812 13.9812 14.3557 14.3557 14.6040 14.6040 14.7845 14.7845 15.5977 15.5977 15.7599 15.7599 16.0195 16.0195 17.0313 17.0313 17.2066 17.2066 18.1791 18.1791 18.6471 18.6471 k = 0.5000-0.0000 0.0580 ( 2646 PWs) bands (ev): -44.7451 -44.7451 -44.7278 -44.7278 -19.1862 -19.1862 -19.1209 -19.1209 -11.6789 -11.6789 -11.6427 -11.6427 -11.4963 -11.4963 -11.2365 -11.2365 12.1758 12.1758 12.8193 12.8193 12.9393 12.9393 12.9841 12.9841 13.2233 13.2233 13.3912 13.3912 13.9502 13.9502 14.3529 14.3529 14.6048 14.6048 14.8275 14.8275 15.6241 15.6241 15.7719 15.7719 15.9765 15.9765 16.9852 16.9852 17.1697 17.1697 18.1774 18.1774 18.5667 18.5667 k = 0.5000-0.0000 0.0483 ( 2642 PWs) bands (ev): -44.7452 -44.7452 -44.7277 -44.7277 -19.1866 -19.1866 -19.1206 -19.1206 -11.6792 -11.6792 -11.6426 -11.6426 -11.4979 -11.4979 -11.2350 -11.2350 12.1787 12.1787 12.8547 12.8547 12.9494 12.9494 13.0008 13.0008 13.2242 13.2242 13.4120 13.4120 13.9200 13.9200 14.3501 14.3501 14.6062 14.6062 14.8679 14.8679 15.6371 15.6371 15.7896 15.7896 15.9443 15.9443 16.9421 16.9421 17.1369 17.1369 18.1736 18.1736 18.4953 18.4953 k = 0.5000-0.0000 0.0387 ( 2646 PWs) bands (ev): -44.7453 -44.7453 -44.7277 -44.7277 -19.1870 -19.1870 -19.1204 -19.1204 -11.6796 -11.6796 -11.6426 -11.6426 -11.4993 -11.4993 -11.2338 -11.2338 12.1810 12.1810 12.8866 12.8866 12.9560 12.9560 13.0169 13.0169 13.2231 13.2231 13.4310 13.4310 13.8923 13.8923 14.3476 14.3476 14.6080 14.6080 14.9042 14.9042 15.6437 15.6437 15.7943 15.7943 15.9341 15.9341 16.9029 16.9029 17.1089 17.1089 18.1675 18.1675 18.4370 18.4370 k = 0.5000-0.0000 0.0290 ( 2642 PWs) bands (ev): -44.7453 -44.7453 -44.7276 -44.7276 -19.1873 -19.1873 -19.1201 -19.1201 -11.6798 -11.6798 -11.6425 -11.6425 -11.5004 -11.5004 -11.2327 -11.2327 12.1829 12.1829 12.9136 12.9136 12.9606 12.9606 13.0305 13.0305 13.2208 13.2208 13.4470 13.4470 13.8686 13.8686 14.3454 14.3454 14.6098 14.6098 14.9349 14.9349 15.6498 15.6498 15.7776 15.7776 15.9477 15.9477 16.8690 16.8690 17.0865 17.0865 18.1594 18.1594 18.3932 18.3932 k = 0.5000-0.0000 0.0193 ( 2650 PWs) bands (ev): -44.7453 -44.7453 -44.7276 -44.7276 -19.1876 -19.1876 -19.1200 -19.1200 -11.6801 -11.6801 -11.6425 -11.6425 -11.5013 -11.5013 -11.2321 -11.2321 12.1842 12.1842 12.9342 12.9342 12.9638 12.9638 13.0408 13.0408 13.2184 13.2184 13.4590 13.4590 13.8504 13.8504 14.3437 14.3437 14.6112 14.6112 14.9584 14.9584 15.6583 15.6583 15.7514 15.7514 15.9690 15.9690 16.8422 16.8422 17.0701 17.0701 18.1508 18.1508 18.3638 18.3638 k = 0.5000-0.0000 0.0097 ( 2642 PWs) bands (ev): -44.7454 -44.7454 -44.7275 -44.7275 -19.1876 -19.1876 -19.1198 -19.1198 -11.6801 -11.6801 -11.6424 -11.6424 -11.5017 -11.5017 -11.2317 -11.2317 12.1850 12.1850 12.9469 12.9469 12.9661 12.9661 13.0471 13.0471 13.2165 13.2165 13.4665 13.4665 13.8390 13.8390 14.3426 14.3426 14.6122 14.6122 14.9733 14.9733 15.6697 15.6697 15.7264 15.7264 15.9855 15.9855 16.8250 16.8250 17.0601 17.0601 18.1441 18.1441 18.3474 18.3474 k = 0.5000-0.0000-0.0000 ( 2640 PWs) bands (ev): -44.7454 -44.7454 -44.7275 -44.7275 -19.1877 -19.1877 -19.1198 -19.1198 -11.6801 -11.6801 -11.6424 -11.6424 -11.5019 -11.5019 -11.2315 -11.2315 12.1853 12.1853 12.9511 12.9511 12.9671 12.9671 13.0493 13.0493 13.2157 13.2157 13.4690 13.4690 13.8351 13.8351 14.3422 14.3422 14.6125 14.6125 14.9784 14.9784 15.6777 15.6777 15.7135 15.7135 15.9916 15.9916 16.8190 16.8190 17.0568 17.0568 18.1416 18.1416 18.3422 18.3422 k = 0.5000 0.3286-0.0000 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1492 -19.1492 -19.1492 -19.1492 -11.6526 -11.6526 -11.6526 -11.6526 -11.3558 -11.3558 -11.3558 -11.3558 12.0565 12.0565 12.0565 12.0565 12.3535 12.3535 12.3535 12.3535 13.3577 13.3577 13.3577 13.3577 13.7761 13.7761 13.7761 13.7761 14.2918 14.2918 14.2918 14.2918 15.7754 15.7754 15.7754 15.7754 17.7433 17.7433 17.7433 17.7433 17.9462 17.9462 17.9462 17.9462 19.3157 19.3157 k = 0.5000 0.3286 0.0097 ( 2692 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1492 -19.1492 -19.1492 -19.1492 -11.6527 -11.6527 -11.6527 -11.6527 -11.3558 -11.3558 -11.3558 -11.3558 12.0545 12.0545 12.0545 12.0545 12.3495 12.3495 12.3495 12.3495 13.3569 13.3569 13.3569 13.3569 13.7727 13.7727 13.7727 13.7727 14.2993 14.2993 14.2993 14.2993 15.7802 15.7802 15.7802 15.7802 17.7438 17.7438 17.7438 17.7438 17.9470 17.9470 17.9470 17.9470 19.3173 19.3173 k = 0.5000 0.3286 0.0193 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1492 -19.1492 -19.1492 -19.1492 -11.6528 -11.6528 -11.6528 -11.6528 -11.3555 -11.3555 -11.3555 -11.3555 12.0483 12.0483 12.0483 12.0483 12.3379 12.3379 12.3379 12.3379 13.3548 13.3548 13.3548 13.3548 13.7632 13.7632 13.7632 13.7632 14.3213 14.3213 14.3213 14.3213 15.7946 15.7946 15.7946 15.7946 17.7452 17.7452 17.7452 17.7452 17.9492 17.9492 17.9492 17.9492 19.3219 19.3219 k = 0.5000 0.3286 0.0290 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1491 -19.1491 -19.1491 -19.1491 -11.6530 -11.6530 -11.6530 -11.6530 -11.3551 -11.3551 -11.3551 -11.3551 12.0382 12.0382 12.0382 12.0382 12.3189 12.3189 12.3189 12.3189 13.3511 13.3511 13.3511 13.3511 13.7489 13.7489 13.7489 13.7489 14.3560 14.3560 14.3560 14.3560 15.8183 15.8183 15.8183 15.8183 17.7473 17.7473 17.7473 17.7473 17.9529 17.9529 17.9529 17.9529 19.3295 19.3295 k = 0.5000 0.3286 0.0387 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1491 -19.1491 -19.1491 -19.1491 -11.6533 -11.6533 -11.6533 -11.6533 -11.3546 -11.3546 -11.3546 -11.3546 12.0242 12.0242 12.0242 12.0242 12.2933 12.2933 12.2933 12.2933 13.3460 13.3460 13.3460 13.3460 13.7313 13.7313 13.7313 13.7313 14.4017 14.4017 14.4017 14.4017 15.8510 15.8510 15.8510 15.8510 17.7502 17.7502 17.7502 17.7502 17.9581 17.9581 17.9581 17.9581 19.3402 19.3402 k = 0.5000 0.3286 0.0483 ( 2688 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1490 -19.1490 -19.1490 -19.1490 -11.6536 -11.6536 -11.6536 -11.6536 -11.3539 -11.3539 -11.3539 -11.3539 12.0066 12.0066 12.0066 12.0066 12.2619 12.2619 12.2619 12.2619 13.3393 13.3393 13.3393 13.3393 13.7118 13.7118 13.7118 13.7118 14.4564 14.4564 14.4564 14.4564 15.8921 15.8921 15.8921 15.8921 17.7536 17.7536 17.7536 17.7536 17.9648 17.9648 17.9648 17.9648 19.3537 19.3537 k = 0.5000 0.3286 0.0580 ( 2684 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1489 -19.1489 -19.1489 -19.1489 -11.6540 -11.6540 -11.6540 -11.6540 -11.3530 -11.3530 -11.3530 -11.3530 11.9856 11.9856 11.9856 11.9856 12.2257 12.2257 12.2257 12.2257 13.3311 13.3311 13.3311 13.3311 13.6913 13.6913 13.6913 13.6913 14.5186 14.5186 14.5186 14.5186 15.9410 15.9410 15.9410 15.9410 17.7573 17.7573 17.7573 17.7573 17.9728 17.9728 17.9728 17.9728 19.3700 19.3700 k = 0.5000 0.3286 0.0677 ( 2684 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1489 -19.1489 -19.1489 -19.1489 -11.6545 -11.6545 -11.6545 -11.6545 -11.3520 -11.3520 -11.3520 -11.3520 11.9614 11.9614 11.9614 11.9614 12.1855 12.1855 12.1855 12.1855 13.3215 13.3215 13.3215 13.3215 13.6706 13.6706 13.6706 13.6706 14.5870 14.5870 14.5870 14.5870 15.9972 15.9972 15.9972 15.9972 17.7612 17.7612 17.7612 17.7612 17.9823 17.9823 17.9823 17.9823 19.3890 19.3890 k = 0.5000 0.3286 0.0773 ( 2680 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1488 -19.1488 -19.1488 -19.1488 -11.6550 -11.6550 -11.6550 -11.6550 -11.3510 -11.3510 -11.3510 -11.3510 11.9345 11.9345 11.9345 11.9345 12.1423 12.1423 12.1423 12.1423 13.3106 13.3106 13.3106 13.3106 13.6499 13.6499 13.6499 13.6499 14.6605 14.6605 14.6605 14.6605 16.0599 16.0599 16.0599 16.0599 17.7650 17.7650 17.7650 17.7650 17.9929 17.9929 17.9929 17.9929 19.4104 19.4104 k = 0.5000 0.3286 0.0870 ( 2680 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1487 -19.1487 -19.1487 -19.1487 -11.6556 -11.6556 -11.6556 -11.6556 -11.3498 -11.3498 -11.3498 -11.3498 11.9052 11.9052 11.9052 11.9052 12.0969 12.0969 12.0969 12.0969 13.2986 13.2986 13.2986 13.2986 13.6296 13.6296 13.6296 13.6296 14.7382 14.7382 14.7382 14.7382 16.1284 16.1284 16.1284 16.1284 17.7687 17.7687 17.7687 17.7687 18.0045 18.0045 18.0045 18.0045 19.4342 19.4342 k = 0.5000 0.3286 0.0966 ( 2676 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1486 -19.1486 -19.1486 -19.1486 -11.6562 -11.6562 -11.6562 -11.6562 -11.3485 -11.3485 -11.3485 -11.3485 11.8737 11.8737 11.8737 11.8737 12.0500 12.0500 12.0500 12.0500 13.2856 13.2856 13.2856 13.2856 13.6097 13.6097 13.6097 13.6097 14.8193 14.8193 14.8193 14.8193 16.2020 16.2020 16.2020 16.2020 17.7720 17.7720 17.7720 17.7720 18.0169 18.0169 18.0169 18.0169 19.4601 19.4601 k = 0.5000 0.3286 0.1063 ( 2672 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1484 -19.1484 -19.1484 -19.1484 -11.6569 -11.6569 -11.6569 -11.6569 -11.3471 -11.3471 -11.3471 -11.3471 11.8405 11.8405 11.8405 11.8405 12.0025 12.0025 12.0025 12.0025 13.2719 13.2719 13.2719 13.2719 13.5904 13.5904 13.5904 13.5904 14.9032 14.9032 14.9032 14.9032 16.2799 16.2799 16.2799 16.2799 17.7750 17.7750 17.7750 17.7750 18.0297 18.0297 18.0297 18.0297 19.4879 19.4879 k = 0.5000 0.3286 0.1160 ( 2664 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1482 -19.1482 -19.1482 -19.1482 -11.6575 -11.6575 -11.6575 -11.6575 -11.3456 -11.3456 -11.3456 -11.3456 11.8058 11.8058 11.8058 11.8058 11.9550 11.9550 11.9550 11.9550 13.2577 13.2577 13.2577 13.2577 13.5716 13.5716 13.5716 13.5716 14.9892 14.9892 14.9892 14.9892 16.3614 16.3614 16.3614 16.3614 17.7776 17.7776 17.7776 17.7776 18.0425 18.0425 18.0425 18.0425 19.5174 19.5174 k = 0.5000 0.3286 0.1256 ( 2664 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1481 -19.1481 -19.1481 -19.1481 -11.6583 -11.6583 -11.6583 -11.6583 -11.3441 -11.3441 -11.3441 -11.3441 11.7701 11.7701 11.7701 11.7701 11.9078 11.9078 11.9078 11.9078 13.2432 13.2432 13.2432 13.2432 13.5534 13.5534 13.5534 13.5534 15.0769 15.0769 15.0769 15.0769 16.4459 16.4459 16.4459 16.4459 17.7797 17.7797 17.7797 17.7797 18.0552 18.0552 18.0552 18.0552 19.5483 19.5483 k = 0.5000 0.3286 0.1353 ( 2672 PWs) bands (ev): -44.7368 -44.7368 -44.7368 -44.7368 -19.1481 -19.1481 -19.1481 -19.1481 -11.6591 -11.6591 -11.6591 -11.6591 -11.3427 -11.3427 -11.3427 -11.3427 11.7337 11.7337 11.7337 11.7337 11.8617 11.8617 11.8617 11.8617 13.2285 13.2285 13.2285 13.2285 13.5358 13.5358 13.5358 13.5358 15.1656 15.1656 15.1656 15.1656 16.5325 16.5325 16.5325 16.5325 17.7814 17.7814 17.7814 17.7814 18.0671 18.0671 18.0671 18.0671 19.5804 19.5804 k = 0.5000 0.3286 0.1450 ( 2672 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1480 -19.1480 -19.1480 -19.1480 -11.6598 -11.6598 -11.6598 -11.6598 -11.3411 -11.3411 -11.3411 -11.3411 11.6970 11.6970 11.6970 11.6970 11.8168 11.8168 11.8168 11.8168 13.2139 13.2139 13.2139 13.2139 13.5189 13.5189 13.5189 13.5189 15.2549 15.2549 15.2549 15.2549 16.6206 16.6206 16.6206 16.6206 17.7825 17.7825 17.7825 17.7825 18.0782 18.0782 18.0782 18.0782 19.6133 19.6133 k = 0.5000 0.3286 0.1546 ( 2668 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1479 -19.1479 -19.1479 -19.1479 -11.6605 -11.6605 -11.6605 -11.6605 -11.3396 -11.3396 -11.3396 -11.3396 11.6602 11.6602 11.6602 11.6602 11.7737 11.7737 11.7737 11.7737 13.1995 13.1995 13.1995 13.1995 13.5025 13.5025 13.5025 13.5025 15.3443 15.3443 15.3443 15.3443 16.7096 16.7096 16.7096 16.7096 17.7831 17.7831 17.7831 17.7831 18.0879 18.0879 18.0879 18.0879 19.6469 19.6469 k = 0.5000 0.3286 0.1643 ( 2664 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1477 -19.1477 -19.1477 -19.1477 -11.6613 -11.6613 -11.6613 -11.6613 -11.3380 -11.3380 -11.3380 -11.3380 11.6238 11.6238 11.6238 11.6238 11.7325 11.7325 11.7325 11.7325 13.1854 13.1854 13.1854 13.1854 13.4869 13.4869 13.4869 13.4869 15.4333 15.4333 15.4333 15.4333 16.7986 16.7986 16.7986 16.7986 17.7831 17.7831 17.7831 17.7831 18.0961 18.0961 18.0961 18.0961 19.6808 19.6808 k = 0.5000 0.3286 0.1740 ( 2656 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1475 -19.1475 -19.1475 -19.1475 -11.6619 -11.6619 -11.6619 -11.6619 -11.3364 -11.3364 -11.3364 -11.3364 11.5880 11.5880 11.5880 11.5880 11.6934 11.6934 11.6934 11.6934 13.1717 13.1717 13.1717 13.1717 13.4719 13.4719 13.4719 13.4719 15.5215 15.5215 15.5215 15.5215 16.8870 16.8870 16.8870 16.8870 17.7825 17.7825 17.7825 17.7825 18.1025 18.1025 18.1025 18.1025 19.7147 19.7147 k = 0.5000 0.3286 0.1836 ( 2656 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1474 -19.1474 -19.1474 -19.1474 -11.6627 -11.6627 -11.6627 -11.6627 -11.3350 -11.3350 -11.3350 -11.3350 11.5532 11.5532 11.5532 11.5532 11.6566 11.6566 11.6566 11.6566 13.1585 13.1585 13.1585 13.1585 13.4578 13.4578 13.4578 13.4578 15.6082 15.6082 15.6082 15.6082 16.9740 16.9740 16.9740 16.9740 17.7814 17.7814 17.7814 17.7814 18.1070 18.1070 18.1070 18.1070 19.7484 19.7484 k = 0.5000 0.3286 0.1933 ( 2652 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1473 -19.1473 -19.1473 -19.1473 -11.6633 -11.6633 -11.6633 -11.6633 -11.3335 -11.3335 -11.3335 -11.3335 11.5198 11.5198 11.5198 11.5198 11.6222 11.6222 11.6222 11.6222 13.1460 13.1460 13.1460 13.1460 13.4444 13.4444 13.4444 13.4444 15.6931 15.6931 15.6931 15.6931 17.0590 17.0590 17.0590 17.0590 17.7796 17.7796 17.7796 17.7796 18.1096 18.1096 18.1096 18.1096 19.7814 19.7814 k = 0.5000 0.3286 0.2030 ( 2644 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1471 -19.1471 -19.1471 -19.1471 -11.6639 -11.6639 -11.6639 -11.6639 -11.3321 -11.3321 -11.3321 -11.3321 11.4880 11.4880 11.4880 11.4880 11.5902 11.5902 11.5902 11.5902 13.1342 13.1342 13.1342 13.1342 13.4319 13.4319 13.4319 13.4319 15.7754 15.7754 15.7754 15.7754 17.1410 17.1410 17.1410 17.1410 17.7772 17.7772 17.7772 17.7772 18.1103 18.1103 18.1103 18.1103 19.8136 19.8136 k = 0.5000 0.3286 0.2126 ( 2640 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1470 -19.1470 -19.1470 -19.1470 -11.6645 -11.6645 -11.6645 -11.6645 -11.3308 -11.3308 -11.3308 -11.3308 11.4581 11.4581 11.4581 11.4581 11.5608 11.5608 11.5608 11.5608 13.1232 13.1232 13.1232 13.1232 13.4203 13.4203 13.4203 13.4203 15.8547 15.8547 15.8547 15.8547 17.2194 17.2194 17.2194 17.2194 17.7742 17.7742 17.7742 17.7742 18.1091 18.1091 18.1091 18.1091 19.8445 19.8445 k = 0.5000 0.3286 0.2223 ( 2640 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1469 -19.1469 -19.1469 -19.1469 -11.6651 -11.6651 -11.6651 -11.6651 -11.3296 -11.3296 -11.3296 -11.3296 11.4305 11.4305 11.4305 11.4305 11.5340 11.5340 11.5340 11.5340 13.1130 13.1130 13.1130 13.1130 13.4097 13.4097 13.4097 13.4097 15.9302 15.9302 15.9302 15.9302 17.2933 17.2933 17.2933 17.2933 17.7707 17.7707 17.7707 17.7707 18.1064 18.1064 18.1064 18.1064 19.8738 19.8738 k = 0.5000 0.3286 0.2319 ( 2640 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1468 -19.1468 -19.1468 -19.1468 -11.6656 -11.6656 -11.6656 -11.6656 -11.3285 -11.3285 -11.3285 -11.3285 11.4052 11.4052 11.4052 11.4052 11.5099 11.5099 11.5099 11.5099 13.1038 13.1038 13.1038 13.1038 13.4000 13.4000 13.4000 13.4000 16.0013 16.0013 16.0013 16.0013 17.3619 17.3619 17.3619 17.3619 17.7668 17.7668 17.7668 17.7668 18.1023 18.1023 18.1023 18.1023 19.9012 19.9012 k = 0.5000 0.3286 0.2416 ( 2644 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1468 -19.1468 -19.1468 -19.1468 -11.6661 -11.6661 -11.6661 -11.6661 -11.3275 -11.3275 -11.3275 -11.3275 11.3825 11.3825 11.3825 11.3825 11.4884 11.4884 11.4884 11.4884 13.0955 13.0955 13.0955 13.0955 13.3914 13.3914 13.3914 13.3914 16.0671 16.0671 16.0671 16.0671 17.4243 17.4243 17.4243 17.4243 17.7626 17.7626 17.7626 17.7626 18.0973 18.0973 18.0973 18.0973 19.9265 19.9265 k = 0.5000 0.3286 0.2513 ( 2648 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1467 -19.1467 -19.1467 -19.1467 -11.6665 -11.6665 -11.6665 -11.6665 -11.3266 -11.3266 -11.3266 -11.3266 11.3626 11.3626 11.3626 11.3626 11.4697 11.4697 11.4697 11.4697 13.0882 13.0882 13.0882 13.0882 13.3839 13.3839 13.3839 13.3839 16.1268 16.1268 16.1268 16.1268 17.4797 17.4797 17.4797 17.4797 17.7586 17.7586 17.7586 17.7586 18.0918 18.0918 18.0918 18.0918 19.9492 19.9492 k = 0.5000 0.3286 0.2609 ( 2652 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1467 -19.1467 -19.1467 -19.1467 -11.6669 -11.6669 -11.6669 -11.6669 -11.3259 -11.3259 -11.3259 -11.3259 11.3456 11.3456 11.3456 11.3456 11.4538 11.4538 11.4538 11.4538 13.0820 13.0820 13.0820 13.0820 13.3774 13.3774 13.3774 13.3774 16.1794 16.1794 16.1794 16.1794 17.5270 17.5270 17.5270 17.5270 17.7553 17.7553 17.7553 17.7553 18.0861 18.0861 18.0861 18.0861 19.9690 19.9690 k = 0.5000 0.3286 0.2706 ( 2656 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1467 -19.1467 -19.1467 -19.1467 -11.6672 -11.6672 -11.6672 -11.6672 -11.3253 -11.3253 -11.3253 -11.3253 11.3315 11.3315 11.3315 11.3315 11.4407 11.4407 11.4407 11.4407 13.0769 13.0769 13.0769 13.0769 13.3721 13.3721 13.3721 13.3721 16.2242 16.2242 16.2242 16.2242 17.5655 17.5655 17.5655 17.5655 17.7530 17.7530 17.7530 17.7530 18.0807 18.0807 18.0807 18.0807 19.9857 19.9857 k = 0.5000 0.3286 0.2803 ( 2648 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1466 -19.1466 -19.1466 -19.1466 -11.6674 -11.6674 -11.6674 -11.6674 -11.3247 -11.3247 -11.3247 -11.3247 11.3204 11.3204 11.3204 11.3204 11.4305 11.4305 11.4305 11.4305 13.0728 13.0728 13.0728 13.0728 13.3680 13.3680 13.3680 13.3680 16.2602 16.2602 16.2602 16.2602 17.5946 17.5946 17.5946 17.5946 17.7522 17.7522 17.7522 17.7522 18.0761 18.0761 18.0761 18.0761 19.9990 19.9990 k = 0.5000 0.3286 0.2899 ( 2636 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1465 -19.1465 -19.1465 -19.1465 -11.6675 -11.6675 -11.6675 -11.6675 -11.3243 -11.3243 -11.3243 -11.3243 11.3125 11.3125 11.3125 11.3125 11.4232 11.4232 11.4232 11.4232 13.0700 13.0700 13.0700 13.0700 13.3650 13.3650 13.3650 13.3650 16.2866 16.2866 16.2866 16.2866 17.6142 17.6142 17.6142 17.6142 17.7528 17.7528 17.7528 17.7528 18.0725 18.0725 18.0725 18.0725 20.0087 20.0087 k = 0.5000 0.3286 0.2996 ( 2628 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1464 -19.1464 -19.1464 -19.1464 -11.6675 -11.6675 -11.6675 -11.6675 -11.3240 -11.3240 -11.3240 -11.3240 11.3077 11.3077 11.3077 11.3077 11.4188 11.4188 11.4188 11.4188 13.0682 13.0682 13.0682 13.0682 13.3632 13.3632 13.3632 13.3632 16.3027 16.3027 16.3027 16.3027 17.6253 17.6253 17.6253 17.6253 17.7539 17.7539 17.7539 17.7539 18.0702 18.0702 18.0702 18.0702 20.0146 20.0146 k = 0.5000 0.3286 0.3093 ( 2624 PWs) bands (ev): -44.7369 -44.7369 -44.7369 -44.7369 -19.1463 -19.1463 -19.1463 -19.1463 -11.6675 -11.6675 -11.6675 -11.6675 -11.3239 -11.3239 -11.3239 -11.3239 11.3061 11.3061 11.3061 11.3061 11.4173 11.4173 11.4173 11.4173 13.0677 13.0677 13.0677 13.0677 13.3626 13.3626 13.3626 13.3626 16.3081 16.3081 16.3081 16.3081 17.6288 17.6288 17.6288 17.6288 17.7545 17.7545 17.7545 17.7545 18.0694 18.0694 18.0694 18.0694 20.0166 20.0166 Writing output data file HfIr.save init_run : 0.39s CPU 0.67s WALL ( 1 calls) electrons : 455.07s CPU 457.93s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 455.06s CPU 457.92s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.04s WALL ( 484 calls) cegterg : 430.38s CPU 432.95s WALL ( 1229 calls) Called by sum_band: Called by *egterg: h_psi : 244.91s CPU 255.24s WALL ( 21488 calls) s_psi : 25.58s CPU 26.00s WALL ( 21488 calls) g_psi : 0.48s CPU 0.60s WALL ( 19775 calls) cdiaghg : 136.56s CPU 134.57s WALL ( 20259 calls) cegterg:over : 16.33s CPU 13.93s WALL ( 19775 calls) cegterg:upda : 3.53s CPU 5.48s WALL ( 19775 calls) cegterg:last : 2.46s CPU 3.56s WALL ( 3413 calls) Called by h_psi: h_psi:vloc : 220.03s CPU 227.70s WALL ( 21488 calls) h_psi:vnl : 24.80s CPU 27.26s WALL ( 21488 calls) add_vuspsi : 12.10s CPU 16.14s WALL ( 21488 calls) General routines calbec : 12.67s CPU 11.07s WALL ( 21488 calls) fft : 0.01s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 215.48s CPU 219.44s WALL ( 2075448 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.02s CPU 0.12s WALL ( 968 calls) Parallel routines fft_scatter : 173.71s CPU 144.86s WALL ( 2075471 calls) PWSCF : 8m 0.52s CPU 8m13.26s WALL This run was terminated on: 15:49:46 16Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=