Program PWSCF v.5.1.1 starts on 2Dec2015 at 0:17: 3 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaCoO3.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 52 30 8 1808 797 123 Max 53 31 10 1815 809 129 Sum 2539 1483 433 86997 38529 6057 bravais-lattice index = 14 lattice parameter (alat) = 10.6675 a.u. unit-cell volume = 884.9759 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 74.00 number of Kohn-Sham states= 88 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.667503 celldm(2)= 1.000000 celldm(3)= 0.841807 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 0.841807 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 1.187921 ) PseudoPot. # 1 for Ba read from file: /home/autes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Co read from file: /home/autes/Pseudo/Co.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6e843fd57bb34a371311d5dc8eddf880 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 1193 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 Ba 10.00 137.32700 Ba( 1.00) O 6.00 15.99940 O( 1.00) Co 9.00 58.93320 Co( 1.00) 12 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,1,0] cryst. s( 2) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [2,1,0] cryst. s( 6) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 7) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 7) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 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 ) isym = 9 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3h (-62m) there are 9 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3C2' s_h 2S3 -2S3 3s_v -3C2' -s_h' -3s_v G_7 2.00 -2.00 1.00 -1.00 0.00 0.00 1.73 -1.73 0.00 G_8 2.00 -2.00 1.00 -1.00 0.00 0.00 -1.73 1.73 0.00 G_9 2.00 -2.00 -2.00 2.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 3C2'-3C2' 2 -6 -5 -2 5 6 2C3 3 4 3s_v-3s_v 7 -7 3s_v-3s_v 8 -8 11 -12 -11 12 2S3 9 10 -E -1 -2C3 -3 -4 -2S3 -9 -10 Cartesian axes number of k points= 291 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0151515 0.0087477 -0.0000000), wk = 0.0034364 k( 3) = ( 0.0303030 0.0174955 -0.0000000), wk = 0.0034364 k( 4) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0034364 k( 5) = ( 0.0606061 0.0349909 -0.0000000), wk = 0.0034364 k( 6) = ( 0.0757576 0.0437387 -0.0000000), wk = 0.0034364 k( 7) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0034364 k( 8) = ( 0.1060606 0.0612341 -0.0000000), wk = 0.0034364 k( 9) = ( 0.1212121 0.0699819 -0.0000000), wk = 0.0034364 k( 10) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0034364 k( 11) = ( 0.1515151 0.0874773 -0.0000000), wk = 0.0034364 k( 12) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0034364 k( 13) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0034364 k( 14) = ( 0.1969697 0.1137205 -0.0000000), wk = 0.0034364 k( 15) = ( 0.2121212 0.1224682 -0.0000000), wk = 0.0034364 k( 16) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0034364 k( 17) = ( 0.2424242 0.1399637 -0.0000000), wk = 0.0034364 k( 18) = ( 0.2575758 0.1487114 -0.0000000), wk = 0.0034364 k( 19) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0034364 k( 20) = ( 0.2878788 0.1662069 -0.0000000), wk = 0.0034364 k( 21) = ( 0.3030303 0.1749546 -0.0000000), wk = 0.0034364 k( 22) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0034364 k( 23) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0034364 k( 24) = ( 0.3484849 0.2011978 -0.0000000), wk = 0.0034364 k( 25) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0034364 k( 26) = ( 0.3787879 0.2186933 -0.0000000), wk = 0.0034364 k( 27) = ( 0.3939394 0.2274410 -0.0000000), wk = 0.0034364 k( 28) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0034364 k( 29) = ( 0.4242424 0.2449365 -0.0000000), wk = 0.0034364 k( 30) = ( 0.4393939 0.2536842 -0.0000000), wk = 0.0034364 k( 31) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0034364 k( 32) = ( 0.4696970 0.2711797 -0.0000000), wk = 0.0034364 k( 33) = ( 0.4848485 0.2799274 -0.0000000), wk = 0.0034364 k( 34) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0034364 k( 35) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0034364 k( 36) = ( 0.4912281 0.3038686 -0.0000000), wk = 0.0034364 k( 37) = ( 0.4824561 0.3190620 -0.0000000), wk = 0.0034364 k( 38) = ( 0.4736842 0.3342554 -0.0000000), wk = 0.0034364 k( 39) = ( 0.4649123 0.3494488 -0.0000000), wk = 0.0034364 k( 40) = ( 0.4561404 0.3646423 -0.0000000), wk = 0.0034364 k( 41) = ( 0.4473684 0.3798357 -0.0000000), wk = 0.0034364 k( 42) = ( 0.4385965 0.3950291 -0.0000000), wk = 0.0034364 k( 43) = ( 0.4298246 0.4102226 -0.0000000), wk = 0.0034364 k( 44) = ( 0.4210526 0.4254160 -0.0000000), wk = 0.0034364 k( 45) = ( 0.4122807 0.4406094 -0.0000000), wk = 0.0034364 k( 46) = ( 0.4035088 0.4558028 -0.0000000), wk = 0.0034364 k( 47) = ( 0.3947368 0.4709963 -0.0000000), wk = 0.0034364 k( 48) = ( 0.3859649 0.4861897 -0.0000000), wk = 0.0034364 k( 49) = ( 0.3771930 0.5013831 -0.0000000), wk = 0.0034364 k( 50) = ( 0.3684211 0.5165765 -0.0000000), wk = 0.0034364 k( 51) = ( 0.3596491 0.5317700 -0.0000000), wk = 0.0034364 k( 52) = ( 0.3508772 0.5469634 -0.0000000), wk = 0.0034364 k( 53) = ( 0.3421053 0.5621568 -0.0000000), wk = 0.0034364 k( 54) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0034364 k( 55) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0034364 k( 56) = ( 0.3245614 0.5621568 -0.0000000), wk = 0.0034364 k( 57) = ( 0.3157895 0.5469634 -0.0000000), wk = 0.0034364 k( 58) = ( 0.3070175 0.5317700 -0.0000000), wk = 0.0034364 k( 59) = ( 0.2982456 0.5165765 -0.0000000), wk = 0.0034364 k( 60) = ( 0.2894737 0.5013831 -0.0000000), wk = 0.0034364 k( 61) = ( 0.2807018 0.4861897 -0.0000000), wk = 0.0034364 k( 62) = ( 0.2719298 0.4709963 -0.0000000), wk = 0.0034364 k( 63) = ( 0.2631579 0.4558028 -0.0000000), wk = 0.0034364 k( 64) = ( 0.2543860 0.4406094 -0.0000000), wk = 0.0034364 k( 65) = ( 0.2456140 0.4254160 -0.0000000), wk = 0.0034364 k( 66) = ( 0.2368421 0.4102226 -0.0000000), wk = 0.0034364 k( 67) = ( 0.2280702 0.3950291 -0.0000000), wk = 0.0034364 k( 68) = ( 0.2192983 0.3798357 -0.0000000), wk = 0.0034364 k( 69) = ( 0.2105263 0.3646423 -0.0000000), wk = 0.0034364 k( 70) = ( 0.2017544 0.3494489 -0.0000000), wk = 0.0034364 k( 71) = ( 0.1929825 0.3342554 -0.0000000), wk = 0.0034364 k( 72) = ( 0.1842105 0.3190620 -0.0000000), wk = 0.0034364 k( 73) = ( 0.1754386 0.3038686 -0.0000000), wk = 0.0034364 k( 74) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0034364 k( 75) = ( 0.1578947 0.2734817 -0.0000000), wk = 0.0034364 k( 76) = ( 0.1491228 0.2582883 -0.0000000), wk = 0.0034364 k( 77) = ( 0.1403509 0.2430949 -0.0000000), wk = 0.0034364 k( 78) = ( 0.1315790 0.2279014 -0.0000000), wk = 0.0034364 k( 79) = ( 0.1228070 0.2127080 -0.0000000), wk = 0.0034364 k( 80) = ( 0.1140351 0.1975146 -0.0000000), wk = 0.0034364 k( 81) = ( 0.1052632 0.1823211 -0.0000000), wk = 0.0034364 k( 82) = ( 0.0964912 0.1671277 -0.0000000), wk = 0.0034364 k( 83) = ( 0.0877193 0.1519343 -0.0000000), wk = 0.0034364 k( 84) = ( 0.0789474 0.1367409 -0.0000000), wk = 0.0034364 k( 85) = ( 0.0701754 0.1215474 -0.0000000), wk = 0.0034364 k( 86) = ( 0.0614035 0.1063540 -0.0000000), wk = 0.0034364 k( 87) = ( 0.0526316 0.0911606 -0.0000000), wk = 0.0034364 k( 88) = ( 0.0438597 0.0759671 -0.0000000), wk = 0.0034364 k( 89) = ( 0.0350877 0.0607737 -0.0000000), wk = 0.0034364 k( 90) = ( 0.0263158 0.0455803 -0.0000000), wk = 0.0034364 k( 91) = ( 0.0175439 0.0303869 -0.0000000), wk = 0.0034364 k( 92) = ( 0.0087719 0.0151934 -0.0000000), wk = 0.0034364 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 94) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 95) = ( 0.0000000 0.0000000 0.0174694), wk = 0.0034364 k( 96) = ( 0.0000000 0.0000000 0.0349388), wk = 0.0034364 k( 97) = ( 0.0000000 0.0000000 0.0524083), wk = 0.0034364 k( 98) = ( 0.0000000 0.0000000 0.0698777), wk = 0.0034364 k( 99) = ( 0.0000000 0.0000000 0.0873471), wk = 0.0034364 k( 100) = ( 0.0000000 0.0000000 0.1048165), wk = 0.0034364 k( 101) = ( 0.0000000 0.0000000 0.1222860), wk = 0.0034364 k( 102) = ( 0.0000000 0.0000000 0.1397554), wk = 0.0034364 k( 103) = ( 0.0000000 0.0000000 0.1572248), wk = 0.0034364 k( 104) = ( 0.0000000 0.0000000 0.1746942), wk = 0.0034364 k( 105) = ( 0.0000000 0.0000000 0.1921637), wk = 0.0034364 k( 106) = ( 0.0000000 0.0000000 0.2096331), wk = 0.0034364 k( 107) = ( 0.0000000 0.0000000 0.2271025), wk = 0.0034364 k( 108) = ( 0.0000000 0.0000000 0.2445719), wk = 0.0034364 k( 109) = ( 0.0000000 0.0000000 0.2620414), wk = 0.0034364 k( 110) = ( 0.0000000 0.0000000 0.2795108), wk = 0.0034364 k( 111) = ( 0.0000000 0.0000000 0.2969802), wk = 0.0034364 k( 112) = ( 0.0000000 0.0000000 0.3144496), wk = 0.0034364 k( 113) = ( 0.0000000 0.0000000 0.3319191), wk = 0.0034364 k( 114) = ( 0.0000000 0.0000000 0.3493885), wk = 0.0034364 k( 115) = ( 0.0000000 0.0000000 0.3668579), wk = 0.0034364 k( 116) = ( 0.0000000 0.0000000 0.3843273), wk = 0.0034364 k( 117) = ( 0.0000000 0.0000000 0.4017968), wk = 0.0034364 k( 118) = ( 0.0000000 0.0000000 0.4192662), wk = 0.0034364 k( 119) = ( 0.0000000 0.0000000 0.4367356), wk = 0.0034364 k( 120) = ( 0.0000000 0.0000000 0.4542050), wk = 0.0034364 k( 121) = ( 0.0000000 0.0000000 0.4716745), wk = 0.0034364 k( 122) = ( 0.0000000 0.0000000 0.4891439), wk = 0.0034364 k( 123) = ( 0.0000000 0.0000000 0.5066133), wk = 0.0034364 k( 124) = ( 0.0000000 0.0000000 0.5240827), wk = 0.0034364 k( 125) = ( 0.0000000 0.0000000 0.5415522), wk = 0.0034364 k( 126) = ( 0.0000000 0.0000000 0.5590216), wk = 0.0034364 k( 127) = ( 0.0000000 0.0000000 0.5764910), wk = 0.0034364 k( 128) = ( 0.0000000 0.0000000 0.5939604), wk = 0.0034364 k( 129) = ( 0.0000000 0.0000000 0.5939604), wk = 0.0034364 k( 130) = ( 0.0151515 0.0087477 0.5939604), wk = 0.0034364 k( 131) = ( 0.0303030 0.0174955 0.5939604), wk = 0.0034364 k( 132) = ( 0.0454546 0.0262432 0.5939604), wk = 0.0034364 k( 133) = ( 0.0606061 0.0349909 0.5939604), wk = 0.0034364 k( 134) = ( 0.0757576 0.0437387 0.5939604), wk = 0.0034364 k( 135) = ( 0.0909091 0.0524864 0.5939604), wk = 0.0034364 k( 136) = ( 0.1060606 0.0612341 0.5939604), wk = 0.0034364 k( 137) = ( 0.1212121 0.0699819 0.5939604), wk = 0.0034364 k( 138) = ( 0.1363636 0.0787296 0.5939604), wk = 0.0034364 k( 139) = ( 0.1515151 0.0874773 0.5939604), wk = 0.0034364 k( 140) = ( 0.1666667 0.0962250 0.5939604), wk = 0.0034364 k( 141) = ( 0.1818182 0.1049728 0.5939604), wk = 0.0034364 k( 142) = ( 0.1969697 0.1137205 0.5939604), wk = 0.0034364 k( 143) = ( 0.2121212 0.1224682 0.5939604), wk = 0.0034364 k( 144) = ( 0.2272727 0.1312160 0.5939604), wk = 0.0034364 k( 145) = ( 0.2424242 0.1399637 0.5939604), wk = 0.0034364 k( 146) = ( 0.2575758 0.1487114 0.5939604), wk = 0.0034364 k( 147) = ( 0.2727273 0.1574592 0.5939604), wk = 0.0034364 k( 148) = ( 0.2878788 0.1662069 0.5939604), wk = 0.0034364 k( 149) = ( 0.3030303 0.1749546 0.5939604), wk = 0.0034364 k( 150) = ( 0.3181818 0.1837024 0.5939604), wk = 0.0034364 k( 151) = ( 0.3333333 0.1924501 0.5939604), wk = 0.0034364 k( 152) = ( 0.3484849 0.2011978 0.5939604), wk = 0.0034364 k( 153) = ( 0.3636364 0.2099456 0.5939604), wk = 0.0034364 k( 154) = ( 0.3787879 0.2186933 0.5939604), wk = 0.0034364 k( 155) = ( 0.3939394 0.2274410 0.5939604), wk = 0.0034364 k( 156) = ( 0.4090909 0.2361887 0.5939604), wk = 0.0034364 k( 157) = ( 0.4242424 0.2449365 0.5939604), wk = 0.0034364 k( 158) = ( 0.4393939 0.2536842 0.5939604), wk = 0.0034364 k( 159) = ( 0.4545455 0.2624319 0.5939604), wk = 0.0034364 k( 160) = ( 0.4696970 0.2711797 0.5939604), wk = 0.0034364 k( 161) = ( 0.4848485 0.2799274 0.5939604), wk = 0.0034364 k( 162) = ( 0.5000000 0.2886751 0.5939604), wk = 0.0034364 k( 163) = ( 0.5000000 0.2886751 0.5939604), wk = 0.0034364 k( 164) = ( 0.4912281 0.3038686 0.5939604), wk = 0.0034364 k( 165) = ( 0.4824561 0.3190620 0.5939604), wk = 0.0034364 k( 166) = ( 0.4736842 0.3342554 0.5939604), wk = 0.0034364 k( 167) = ( 0.4649123 0.3494488 0.5939604), wk = 0.0034364 k( 168) = ( 0.4561404 0.3646423 0.5939604), wk = 0.0034364 k( 169) = ( 0.4473684 0.3798357 0.5939604), wk = 0.0034364 k( 170) = ( 0.4385965 0.3950291 0.5939604), wk = 0.0034364 k( 171) = ( 0.4298246 0.4102226 0.5939604), wk = 0.0034364 k( 172) = ( 0.4210526 0.4254160 0.5939604), wk = 0.0034364 k( 173) = ( 0.4122807 0.4406094 0.5939604), wk = 0.0034364 k( 174) = ( 0.4035088 0.4558028 0.5939604), wk = 0.0034364 k( 175) = ( 0.3947368 0.4709963 0.5939604), wk = 0.0034364 k( 176) = ( 0.3859649 0.4861897 0.5939604), wk = 0.0034364 k( 177) = ( 0.3771930 0.5013831 0.5939604), wk = 0.0034364 k( 178) = ( 0.3684211 0.5165765 0.5939604), wk = 0.0034364 k( 179) = ( 0.3596491 0.5317700 0.5939604), wk = 0.0034364 k( 180) = ( 0.3508772 0.5469634 0.5939604), wk = 0.0034364 k( 181) = ( 0.3421053 0.5621568 0.5939604), wk = 0.0034364 k( 182) = ( 0.3333333 0.5773503 0.5939604), wk = 0.0034364 k( 183) = ( 0.3333333 0.5773503 0.5939604), wk = 0.0034364 k( 184) = ( 0.3245614 0.5621568 0.5939604), wk = 0.0034364 k( 185) = ( 0.3157895 0.5469634 0.5939604), wk = 0.0034364 k( 186) = ( 0.3070175 0.5317700 0.5939604), wk = 0.0034364 k( 187) = ( 0.2982456 0.5165765 0.5939604), wk = 0.0034364 k( 188) = ( 0.2894737 0.5013831 0.5939604), wk = 0.0034364 k( 189) = ( 0.2807018 0.4861897 0.5939604), wk = 0.0034364 k( 190) = ( 0.2719298 0.4709963 0.5939604), wk = 0.0034364 k( 191) = ( 0.2631579 0.4558028 0.5939604), wk = 0.0034364 k( 192) = ( 0.2543860 0.4406094 0.5939604), wk = 0.0034364 k( 193) = ( 0.2456140 0.4254160 0.5939604), wk = 0.0034364 k( 194) = ( 0.2368421 0.4102226 0.5939604), wk = 0.0034364 k( 195) = ( 0.2280702 0.3950291 0.5939604), wk = 0.0034364 k( 196) = ( 0.2192983 0.3798357 0.5939604), wk = 0.0034364 k( 197) = ( 0.2105263 0.3646423 0.5939604), wk = 0.0034364 k( 198) = ( 0.2017544 0.3494489 0.5939604), wk = 0.0034364 k( 199) = ( 0.1929825 0.3342554 0.5939604), wk = 0.0034364 k( 200) = ( 0.1842105 0.3190620 0.5939604), wk = 0.0034364 k( 201) = ( 0.1754386 0.3038686 0.5939604), wk = 0.0034364 k( 202) = ( 0.1666667 0.2886751 0.5939604), wk = 0.0034364 k( 203) = ( 0.1578947 0.2734817 0.5939604), wk = 0.0034364 k( 204) = ( 0.1491228 0.2582883 0.5939604), wk = 0.0034364 k( 205) = ( 0.1403509 0.2430949 0.5939604), wk = 0.0034364 k( 206) = ( 0.1315790 0.2279014 0.5939604), wk = 0.0034364 k( 207) = ( 0.1228070 0.2127080 0.5939604), wk = 0.0034364 k( 208) = ( 0.1140351 0.1975146 0.5939604), wk = 0.0034364 k( 209) = ( 0.1052632 0.1823211 0.5939604), wk = 0.0034364 k( 210) = ( 0.0964912 0.1671277 0.5939604), wk = 0.0034364 k( 211) = ( 0.0877193 0.1519343 0.5939604), wk = 0.0034364 k( 212) = ( 0.0789474 0.1367409 0.5939604), wk = 0.0034364 k( 213) = ( 0.0701754 0.1215474 0.5939604), wk = 0.0034364 k( 214) = ( 0.0614035 0.1063540 0.5939604), wk = 0.0034364 k( 215) = ( 0.0526316 0.0911606 0.5939604), wk = 0.0034364 k( 216) = ( 0.0438597 0.0759671 0.5939604), wk = 0.0034364 k( 217) = ( 0.0350877 0.0607737 0.5939604), wk = 0.0034364 k( 218) = ( 0.0263158 0.0455803 0.5939604), wk = 0.0034364 k( 219) = ( 0.0175439 0.0303869 0.5939604), wk = 0.0034364 k( 220) = ( 0.0087719 0.0151934 0.5939604), wk = 0.0034364 k( 221) = ( 0.0000000 0.0000000 0.5939604), wk = 0.0034364 k( 222) = ( 0.5000000 0.2886751 0.5939604), wk = 0.0034364 k( 223) = ( 0.5000000 0.2886751 0.5764910), wk = 0.0034364 k( 224) = ( 0.5000000 0.2886751 0.5590216), wk = 0.0034364 k( 225) = ( 0.5000000 0.2886751 0.5415522), wk = 0.0034364 k( 226) = ( 0.5000000 0.2886751 0.5240827), wk = 0.0034364 k( 227) = ( 0.5000000 0.2886751 0.5066133), wk = 0.0034364 k( 228) = ( 0.5000000 0.2886751 0.4891439), wk = 0.0034364 k( 229) = ( 0.5000000 0.2886751 0.4716745), wk = 0.0034364 k( 230) = ( 0.5000000 0.2886751 0.4542050), wk = 0.0034364 k( 231) = ( 0.5000000 0.2886751 0.4367356), wk = 0.0034364 k( 232) = ( 0.5000000 0.2886751 0.4192662), wk = 0.0034364 k( 233) = ( 0.5000000 0.2886751 0.4017968), wk = 0.0034364 k( 234) = ( 0.5000000 0.2886751 0.3843273), wk = 0.0034364 k( 235) = ( 0.5000000 0.2886751 0.3668579), wk = 0.0034364 k( 236) = ( 0.5000000 0.2886751 0.3493885), wk = 0.0034364 k( 237) = ( 0.5000000 0.2886751 0.3319191), wk = 0.0034364 k( 238) = ( 0.5000000 0.2886751 0.3144496), wk = 0.0034364 k( 239) = ( 0.5000000 0.2886751 0.2969802), wk = 0.0034364 k( 240) = ( 0.5000000 0.2886751 0.2795108), wk = 0.0034364 k( 241) = ( 0.5000000 0.2886751 0.2620414), wk = 0.0034364 k( 242) = ( 0.5000000 0.2886751 0.2445719), wk = 0.0034364 k( 243) = ( 0.5000000 0.2886751 0.2271025), wk = 0.0034364 k( 244) = ( 0.5000000 0.2886751 0.2096331), wk = 0.0034364 k( 245) = ( 0.5000000 0.2886751 0.1921637), wk = 0.0034364 k( 246) = ( 0.5000000 0.2886751 0.1746942), wk = 0.0034364 k( 247) = ( 0.5000000 0.2886751 0.1572248), wk = 0.0034364 k( 248) = ( 0.5000000 0.2886751 0.1397554), wk = 0.0034364 k( 249) = ( 0.5000000 0.2886751 0.1222860), wk = 0.0034364 k( 250) = ( 0.5000000 0.2886751 0.1048165), wk = 0.0034364 k( 251) = ( 0.5000000 0.2886751 0.0873471), wk = 0.0034364 k( 252) = ( 0.5000000 0.2886751 0.0698777), wk = 0.0034364 k( 253) = ( 0.5000000 0.2886751 0.0524083), wk = 0.0034364 k( 254) = ( 0.5000000 0.2886751 0.0349388), wk = 0.0034364 k( 255) = ( 0.5000000 0.2886751 0.0174694), wk = 0.0034364 k( 256) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0034364 k( 257) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0034364 k( 258) = ( 0.3333333 0.5773503 0.0174694), wk = 0.0034364 k( 259) = ( 0.3333333 0.5773503 0.0349388), wk = 0.0034364 k( 260) = ( 0.3333333 0.5773503 0.0524083), wk = 0.0034364 k( 261) = ( 0.3333333 0.5773503 0.0698777), wk = 0.0034364 k( 262) = ( 0.3333333 0.5773503 0.0873471), wk = 0.0034364 k( 263) = ( 0.3333333 0.5773503 0.1048165), wk = 0.0034364 k( 264) = ( 0.3333333 0.5773503 0.1222860), wk = 0.0034364 k( 265) = ( 0.3333333 0.5773503 0.1397554), wk = 0.0034364 k( 266) = ( 0.3333333 0.5773503 0.1572248), wk = 0.0034364 k( 267) = ( 0.3333333 0.5773503 0.1746942), wk = 0.0034364 k( 268) = ( 0.3333333 0.5773503 0.1921637), wk = 0.0034364 k( 269) = ( 0.3333333 0.5773503 0.2096331), wk = 0.0034364 k( 270) = ( 0.3333333 0.5773503 0.2271025), wk = 0.0034364 k( 271) = ( 0.3333333 0.5773503 0.2445719), wk = 0.0034364 k( 272) = ( 0.3333333 0.5773503 0.2620414), wk = 0.0034364 k( 273) = ( 0.3333333 0.5773503 0.2795108), wk = 0.0034364 k( 274) = ( 0.3333333 0.5773503 0.2969802), wk = 0.0034364 k( 275) = ( 0.3333333 0.5773503 0.3144496), wk = 0.0034364 k( 276) = ( 0.3333333 0.5773503 0.3319191), wk = 0.0034364 k( 277) = ( 0.3333333 0.5773503 0.3493885), wk = 0.0034364 k( 278) = ( 0.3333333 0.5773503 0.3668579), wk = 0.0034364 k( 279) = ( 0.3333333 0.5773503 0.3843273), wk = 0.0034364 k( 280) = ( 0.3333333 0.5773503 0.4017968), wk = 0.0034364 k( 281) = ( 0.3333333 0.5773503 0.4192662), wk = 0.0034364 k( 282) = ( 0.3333333 0.5773503 0.4367356), wk = 0.0034364 k( 283) = ( 0.3333333 0.5773503 0.4542050), wk = 0.0034364 k( 284) = ( 0.3333333 0.5773503 0.4716745), wk = 0.0034364 k( 285) = ( 0.3333333 0.5773503 0.4891439), wk = 0.0034364 k( 286) = ( 0.3333333 0.5773503 0.5066133), wk = 0.0034364 k( 287) = ( 0.3333333 0.5773503 0.5240827), wk = 0.0034364 k( 288) = ( 0.3333333 0.5773503 0.5415522), wk = 0.0034364 k( 289) = ( 0.3333333 0.5773503 0.5590216), wk = 0.0034364 k( 290) = ( 0.3333333 0.5773503 0.5764910), wk = 0.0034364 k( 291) = ( 0.3333333 0.5773503 0.5939604), wk = 0.0034364 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0151515 0.0000000 0.0000000), wk = 0.0034364 k( 3) = ( 0.0303030 0.0000000 0.0000000), wk = 0.0034364 k( 4) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0034364 k( 5) = ( 0.0606061 0.0000000 0.0000000), wk = 0.0034364 k( 6) = ( 0.0757576 0.0000000 0.0000000), wk = 0.0034364 k( 7) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0034364 k( 8) = ( 0.1060606 0.0000000 0.0000000), wk = 0.0034364 k( 9) = ( 0.1212121 0.0000000 0.0000000), wk = 0.0034364 k( 10) = ( 0.1363636 0.0000000 0.0000000), wk = 0.0034364 k( 11) = ( 0.1515151 0.0000000 0.0000000), wk = 0.0034364 k( 12) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0034364 k( 13) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0034364 k( 14) = ( 0.1969697 0.0000000 0.0000000), wk = 0.0034364 k( 15) = ( 0.2121212 0.0000000 0.0000000), wk = 0.0034364 k( 16) = ( 0.2272727 0.0000000 0.0000000), wk = 0.0034364 k( 17) = ( 0.2424242 0.0000000 0.0000000), wk = 0.0034364 k( 18) = ( 0.2575758 0.0000000 0.0000000), wk = 0.0034364 k( 19) = ( 0.2727273 0.0000000 0.0000000), wk = 0.0034364 k( 20) = ( 0.2878788 -0.0000000 0.0000000), wk = 0.0034364 k( 21) = ( 0.3030303 0.0000000 0.0000000), wk = 0.0034364 k( 22) = ( 0.3181818 0.0000000 0.0000000), wk = 0.0034364 k( 23) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0034364 k( 24) = ( 0.3484849 0.0000000 0.0000000), wk = 0.0034364 k( 25) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0034364 k( 26) = ( 0.3787879 0.0000000 0.0000000), wk = 0.0034364 k( 27) = ( 0.3939394 0.0000000 0.0000000), wk = 0.0034364 k( 28) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0034364 k( 29) = ( 0.4242424 0.0000000 0.0000000), wk = 0.0034364 k( 30) = ( 0.4393939 0.0000000 0.0000000), wk = 0.0034364 k( 31) = ( 0.4545455 0.0000000 0.0000000), wk = 0.0034364 k( 32) = ( 0.4696970 0.0000000 0.0000000), wk = 0.0034364 k( 33) = ( 0.4848485 0.0000000 0.0000000), wk = 0.0034364 k( 34) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0034364 k( 35) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0034364 k( 36) = ( 0.4912281 0.0175439 0.0000000), wk = 0.0034364 k( 37) = ( 0.4824561 0.0350877 0.0000000), wk = 0.0034364 k( 38) = ( 0.4736842 0.0526316 0.0000000), wk = 0.0034364 k( 39) = ( 0.4649123 0.0701754 0.0000000), wk = 0.0034364 k( 40) = ( 0.4561404 0.0877193 0.0000000), wk = 0.0034364 k( 41) = ( 0.4473684 0.1052632 0.0000000), wk = 0.0034364 k( 42) = ( 0.4385965 0.1228070 0.0000000), wk = 0.0034364 k( 43) = ( 0.4298246 0.1403509 0.0000000), wk = 0.0034364 k( 44) = ( 0.4210526 0.1578947 0.0000000), wk = 0.0034364 k( 45) = ( 0.4122807 0.1754386 0.0000000), wk = 0.0034364 k( 46) = ( 0.4035088 0.1929825 0.0000000), wk = 0.0034364 k( 47) = ( 0.3947368 0.2105263 0.0000000), wk = 0.0034364 k( 48) = ( 0.3859649 0.2280702 0.0000000), wk = 0.0034364 k( 49) = ( 0.3771930 0.2456140 0.0000000), wk = 0.0034364 k( 50) = ( 0.3684211 0.2631579 -0.0000000), wk = 0.0034364 k( 51) = ( 0.3596491 0.2807017 0.0000000), wk = 0.0034364 k( 52) = ( 0.3508772 0.2982456 0.0000000), wk = 0.0034364 k( 53) = ( 0.3421053 0.3157895 0.0000000), wk = 0.0034364 k( 54) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0034364 k( 55) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0034364 k( 56) = ( 0.3245614 0.3245614 0.0000000), wk = 0.0034364 k( 57) = ( 0.3157895 0.3157895 0.0000000), wk = 0.0034364 k( 58) = ( 0.3070175 0.3070175 0.0000000), wk = 0.0034364 k( 59) = ( 0.2982456 0.2982456 0.0000000), wk = 0.0034364 k( 60) = ( 0.2894737 0.2894737 0.0000000), wk = 0.0034364 k( 61) = ( 0.2807018 0.2807018 0.0000000), wk = 0.0034364 k( 62) = ( 0.2719298 0.2719298 0.0000000), wk = 0.0034364 k( 63) = ( 0.2631579 0.2631579 0.0000000), wk = 0.0034364 k( 64) = ( 0.2543860 0.2543860 0.0000000), wk = 0.0034364 k( 65) = ( 0.2456140 0.2456140 -0.0000000), wk = 0.0034364 k( 66) = ( 0.2368421 0.2368421 0.0000000), wk = 0.0034364 k( 67) = ( 0.2280702 0.2280702 0.0000000), wk = 0.0034364 k( 68) = ( 0.2192983 0.2192983 0.0000000), wk = 0.0034364 k( 69) = ( 0.2105263 0.2105263 0.0000000), wk = 0.0034364 k( 70) = ( 0.2017544 0.2017544 0.0000000), wk = 0.0034364 k( 71) = ( 0.1929825 0.1929825 0.0000000), wk = 0.0034364 k( 72) = ( 0.1842105 0.1842105 0.0000000), wk = 0.0034364 k( 73) = ( 0.1754386 0.1754386 0.0000000), wk = 0.0034364 k( 74) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0034364 k( 75) = ( 0.1578947 0.1578947 0.0000000), wk = 0.0034364 k( 76) = ( 0.1491228 0.1491228 0.0000000), wk = 0.0034364 k( 77) = ( 0.1403509 0.1403509 -0.0000000), wk = 0.0034364 k( 78) = ( 0.1315790 0.1315790 0.0000000), wk = 0.0034364 k( 79) = ( 0.1228070 0.1228070 -0.0000000), wk = 0.0034364 k( 80) = ( 0.1140351 0.1140351 0.0000000), wk = 0.0034364 k( 81) = ( 0.1052632 0.1052632 0.0000000), wk = 0.0034364 k( 82) = ( 0.0964912 0.0964912 0.0000000), wk = 0.0034364 k( 83) = ( 0.0877193 0.0877193 0.0000000), wk = 0.0034364 k( 84) = ( 0.0789474 0.0789474 0.0000000), wk = 0.0034364 k( 85) = ( 0.0701754 0.0701754 -0.0000000), wk = 0.0034364 k( 86) = ( 0.0614035 0.0614035 -0.0000000), wk = 0.0034364 k( 87) = ( 0.0526316 0.0526316 0.0000000), wk = 0.0034364 k( 88) = ( 0.0438597 0.0438597 0.0000000), wk = 0.0034364 k( 89) = ( 0.0350877 0.0350877 -0.0000000), wk = 0.0034364 k( 90) = ( 0.0263158 0.0263158 0.0000000), wk = 0.0034364 k( 91) = ( 0.0175439 0.0175439 -0.0000000), wk = 0.0034364 k( 92) = ( 0.0087719 0.0087719 -0.0000000), wk = 0.0034364 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 94) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 95) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0034364 k( 96) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0034364 k( 97) = ( 0.0000000 0.0000000 0.0441176), wk = 0.0034364 k( 98) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0034364 k( 99) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0034364 k( 100) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0034364 k( 101) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0034364 k( 102) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0034364 k( 103) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0034364 k( 104) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0034364 k( 105) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0034364 k( 106) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0034364 k( 107) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0034364 k( 108) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0034364 k( 109) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0034364 k( 110) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0034364 k( 111) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0034364 k( 112) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0034364 k( 113) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0034364 k( 114) = ( 0.0000000 0.0000000 0.2941176), wk = 0.0034364 k( 115) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0034364 k( 116) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0034364 k( 117) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0034364 k( 118) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0034364 k( 119) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0034364 k( 120) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0034364 k( 121) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0034364 k( 122) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0034364 k( 123) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0034364 k( 124) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0034364 k( 125) = ( 0.0000000 0.0000000 0.4558823), wk = 0.0034364 k( 126) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0034364 k( 127) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0034364 k( 128) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 129) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 130) = ( 0.0151515 0.0000000 0.5000000), wk = 0.0034364 k( 131) = ( 0.0303030 0.0000000 0.5000000), wk = 0.0034364 k( 132) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0034364 k( 133) = ( 0.0606061 0.0000000 0.5000000), wk = 0.0034364 k( 134) = ( 0.0757576 0.0000000 0.5000000), wk = 0.0034364 k( 135) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0034364 k( 136) = ( 0.1060606 0.0000000 0.5000000), wk = 0.0034364 k( 137) = ( 0.1212121 0.0000000 0.5000000), wk = 0.0034364 k( 138) = ( 0.1363636 0.0000000 0.5000000), wk = 0.0034364 k( 139) = ( 0.1515151 0.0000000 0.5000000), wk = 0.0034364 k( 140) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0034364 k( 141) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0034364 k( 142) = ( 0.1969697 0.0000000 0.5000000), wk = 0.0034364 k( 143) = ( 0.2121212 0.0000000 0.5000000), wk = 0.0034364 k( 144) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0034364 k( 145) = ( 0.2424242 0.0000000 0.5000000), wk = 0.0034364 k( 146) = ( 0.2575758 0.0000000 0.5000000), wk = 0.0034364 k( 147) = ( 0.2727273 0.0000000 0.5000000), wk = 0.0034364 k( 148) = ( 0.2878788 -0.0000000 0.5000000), wk = 0.0034364 k( 149) = ( 0.3030303 0.0000000 0.5000000), wk = 0.0034364 k( 150) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0034364 k( 151) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0034364 k( 152) = ( 0.3484849 0.0000000 0.5000000), wk = 0.0034364 k( 153) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0034364 k( 154) = ( 0.3787879 0.0000000 0.5000000), wk = 0.0034364 k( 155) = ( 0.3939394 0.0000000 0.5000000), wk = 0.0034364 k( 156) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0034364 k( 157) = ( 0.4242424 0.0000000 0.5000000), wk = 0.0034364 k( 158) = ( 0.4393939 0.0000000 0.5000000), wk = 0.0034364 k( 159) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0034364 k( 160) = ( 0.4696970 0.0000000 0.5000000), wk = 0.0034364 k( 161) = ( 0.4848485 0.0000000 0.5000000), wk = 0.0034364 k( 162) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034364 k( 163) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034364 k( 164) = ( 0.4912281 0.0175439 0.5000000), wk = 0.0034364 k( 165) = ( 0.4824561 0.0350877 0.5000000), wk = 0.0034364 k( 166) = ( 0.4736842 0.0526316 0.5000000), wk = 0.0034364 k( 167) = ( 0.4649123 0.0701754 0.5000000), wk = 0.0034364 k( 168) = ( 0.4561404 0.0877193 0.5000000), wk = 0.0034364 k( 169) = ( 0.4473684 0.1052632 0.5000000), wk = 0.0034364 k( 170) = ( 0.4385965 0.1228070 0.5000000), wk = 0.0034364 k( 171) = ( 0.4298246 0.1403509 0.5000000), wk = 0.0034364 k( 172) = ( 0.4210526 0.1578947 0.5000000), wk = 0.0034364 k( 173) = ( 0.4122807 0.1754386 0.5000000), wk = 0.0034364 k( 174) = ( 0.4035088 0.1929825 0.5000000), wk = 0.0034364 k( 175) = ( 0.3947368 0.2105263 0.5000000), wk = 0.0034364 k( 176) = ( 0.3859649 0.2280702 0.5000000), wk = 0.0034364 k( 177) = ( 0.3771930 0.2456140 0.5000000), wk = 0.0034364 k( 178) = ( 0.3684211 0.2631579 0.5000000), wk = 0.0034364 k( 179) = ( 0.3596491 0.2807017 0.5000000), wk = 0.0034364 k( 180) = ( 0.3508772 0.2982456 0.5000000), wk = 0.0034364 k( 181) = ( 0.3421053 0.3157895 0.5000000), wk = 0.0034364 k( 182) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0034364 k( 183) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0034364 k( 184) = ( 0.3245614 0.3245614 0.5000000), wk = 0.0034364 k( 185) = ( 0.3157895 0.3157895 0.5000000), wk = 0.0034364 k( 186) = ( 0.3070175 0.3070175 0.5000000), wk = 0.0034364 k( 187) = ( 0.2982456 0.2982456 0.5000000), wk = 0.0034364 k( 188) = ( 0.2894737 0.2894737 0.5000000), wk = 0.0034364 k( 189) = ( 0.2807018 0.2807018 0.5000000), wk = 0.0034364 k( 190) = ( 0.2719298 0.2719298 0.5000000), wk = 0.0034364 k( 191) = ( 0.2631579 0.2631579 0.5000000), wk = 0.0034364 k( 192) = ( 0.2543860 0.2543860 0.5000000), wk = 0.0034364 k( 193) = ( 0.2456140 0.2456140 0.5000000), wk = 0.0034364 k( 194) = ( 0.2368421 0.2368421 0.5000000), wk = 0.0034364 k( 195) = ( 0.2280702 0.2280702 0.5000000), wk = 0.0034364 k( 196) = ( 0.2192983 0.2192983 0.5000000), wk = 0.0034364 k( 197) = ( 0.2105263 0.2105263 0.5000000), wk = 0.0034364 k( 198) = ( 0.2017544 0.2017544 0.5000000), wk = 0.0034364 k( 199) = ( 0.1929825 0.1929825 0.5000000), wk = 0.0034364 k( 200) = ( 0.1842105 0.1842105 0.5000000), wk = 0.0034364 k( 201) = ( 0.1754386 0.1754386 0.5000000), wk = 0.0034364 k( 202) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0034364 k( 203) = ( 0.1578947 0.1578947 0.5000000), wk = 0.0034364 k( 204) = ( 0.1491228 0.1491228 0.5000000), wk = 0.0034364 k( 205) = ( 0.1403509 0.1403509 0.5000000), wk = 0.0034364 k( 206) = ( 0.1315790 0.1315790 0.5000000), wk = 0.0034364 k( 207) = ( 0.1228070 0.1228070 0.5000000), wk = 0.0034364 k( 208) = ( 0.1140351 0.1140351 0.5000000), wk = 0.0034364 k( 209) = ( 0.1052632 0.1052632 0.5000000), wk = 0.0034364 k( 210) = ( 0.0964912 0.0964912 0.5000000), wk = 0.0034364 k( 211) = ( 0.0877193 0.0877193 0.5000000), wk = 0.0034364 k( 212) = ( 0.0789474 0.0789474 0.5000000), wk = 0.0034364 k( 213) = ( 0.0701754 0.0701754 0.5000000), wk = 0.0034364 k( 214) = ( 0.0614035 0.0614035 0.5000000), wk = 0.0034364 k( 215) = ( 0.0526316 0.0526316 0.5000000), wk = 0.0034364 k( 216) = ( 0.0438597 0.0438597 0.5000000), wk = 0.0034364 k( 217) = ( 0.0350877 0.0350877 0.5000000), wk = 0.0034364 k( 218) = ( 0.0263158 0.0263158 0.5000000), wk = 0.0034364 k( 219) = ( 0.0175439 0.0175439 0.5000000), wk = 0.0034364 k( 220) = ( 0.0087719 0.0087719 0.5000000), wk = 0.0034364 k( 221) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 222) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0034364 k( 223) = ( 0.5000000 0.0000000 0.4852941), wk = 0.0034364 k( 224) = ( 0.5000000 0.0000000 0.4705882), wk = 0.0034364 k( 225) = ( 0.5000000 0.0000000 0.4558823), wk = 0.0034364 k( 226) = ( 0.5000000 0.0000000 0.4411765), wk = 0.0034364 k( 227) = ( 0.5000000 0.0000000 0.4264706), wk = 0.0034364 k( 228) = ( 0.5000000 0.0000000 0.4117647), wk = 0.0034364 k( 229) = ( 0.5000000 0.0000000 0.3970588), wk = 0.0034364 k( 230) = ( 0.5000000 0.0000000 0.3823529), wk = 0.0034364 k( 231) = ( 0.5000000 0.0000000 0.3676471), wk = 0.0034364 k( 232) = ( 0.5000000 0.0000000 0.3529412), wk = 0.0034364 k( 233) = ( 0.5000000 0.0000000 0.3382353), wk = 0.0034364 k( 234) = ( 0.5000000 0.0000000 0.3235294), wk = 0.0034364 k( 235) = ( 0.5000000 0.0000000 0.3088235), wk = 0.0034364 k( 236) = ( 0.5000000 0.0000000 0.2941176), wk = 0.0034364 k( 237) = ( 0.5000000 0.0000000 0.2794118), wk = 0.0034364 k( 238) = ( 0.5000000 0.0000000 0.2647059), wk = 0.0034364 k( 239) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0034364 k( 240) = ( 0.5000000 0.0000000 0.2352941), wk = 0.0034364 k( 241) = ( 0.5000000 0.0000000 0.2205882), wk = 0.0034364 k( 242) = ( 0.5000000 0.0000000 0.2058823), wk = 0.0034364 k( 243) = ( 0.5000000 0.0000000 0.1911765), wk = 0.0034364 k( 244) = ( 0.5000000 0.0000000 0.1764706), wk = 0.0034364 k( 245) = ( 0.5000000 0.0000000 0.1617647), wk = 0.0034364 k( 246) = ( 0.5000000 0.0000000 0.1470588), wk = 0.0034364 k( 247) = ( 0.5000000 0.0000000 0.1323529), wk = 0.0034364 k( 248) = ( 0.5000000 0.0000000 0.1176471), wk = 0.0034364 k( 249) = ( 0.5000000 0.0000000 0.1029412), wk = 0.0034364 k( 250) = ( 0.5000000 0.0000000 0.0882353), wk = 0.0034364 k( 251) = ( 0.5000000 0.0000000 0.0735294), wk = 0.0034364 k( 252) = ( 0.5000000 0.0000000 0.0588235), wk = 0.0034364 k( 253) = ( 0.5000000 0.0000000 0.0441176), wk = 0.0034364 k( 254) = ( 0.5000000 0.0000000 0.0294118), wk = 0.0034364 k( 255) = ( 0.5000000 0.0000000 0.0147059), wk = 0.0034364 k( 256) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0034364 k( 257) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0034364 k( 258) = ( 0.3333333 0.3333333 0.0147059), wk = 0.0034364 k( 259) = ( 0.3333333 0.3333333 0.0294118), wk = 0.0034364 k( 260) = ( 0.3333333 0.3333333 0.0441176), wk = 0.0034364 k( 261) = ( 0.3333333 0.3333333 0.0588235), wk = 0.0034364 k( 262) = ( 0.3333333 0.3333333 0.0735294), wk = 0.0034364 k( 263) = ( 0.3333333 0.3333333 0.0882353), wk = 0.0034364 k( 264) = ( 0.3333333 0.3333333 0.1029412), wk = 0.0034364 k( 265) = ( 0.3333333 0.3333333 0.1176471), wk = 0.0034364 k( 266) = ( 0.3333333 0.3333333 0.1323529), wk = 0.0034364 k( 267) = ( 0.3333333 0.3333333 0.1470588), wk = 0.0034364 k( 268) = ( 0.3333333 0.3333333 0.1617647), wk = 0.0034364 k( 269) = ( 0.3333333 0.3333333 0.1764706), wk = 0.0034364 k( 270) = ( 0.3333333 0.3333333 0.1911765), wk = 0.0034364 k( 271) = ( 0.3333333 0.3333333 0.2058823), wk = 0.0034364 k( 272) = ( 0.3333333 0.3333333 0.2205882), wk = 0.0034364 k( 273) = ( 0.3333333 0.3333333 0.2352941), wk = 0.0034364 k( 274) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0034364 k( 275) = ( 0.3333333 0.3333333 0.2647059), wk = 0.0034364 k( 276) = ( 0.3333333 0.3333333 0.2794118), wk = 0.0034364 k( 277) = ( 0.3333333 0.3333333 0.2941176), wk = 0.0034364 k( 278) = ( 0.3333333 0.3333333 0.3088235), wk = 0.0034364 k( 279) = ( 0.3333333 0.3333333 0.3235294), wk = 0.0034364 k( 280) = ( 0.3333333 0.3333333 0.3382353), wk = 0.0034364 k( 281) = ( 0.3333333 0.3333333 0.3529412), wk = 0.0034364 k( 282) = ( 0.3333333 0.3333333 0.3676471), wk = 0.0034364 k( 283) = ( 0.3333333 0.3333333 0.3823529), wk = 0.0034364 k( 284) = ( 0.3333333 0.3333333 0.3970588), wk = 0.0034364 k( 285) = ( 0.3333333 0.3333333 0.4117647), wk = 0.0034364 k( 286) = ( 0.3333333 0.3333333 0.4264706), wk = 0.0034364 k( 287) = ( 0.3333333 0.3333333 0.4411765), wk = 0.0034364 k( 288) = ( 0.3333333 0.3333333 0.4558823), wk = 0.0034364 k( 289) = ( 0.3333333 0.3333333 0.4705882), wk = 0.0034364 k( 290) = ( 0.3333333 0.3333333 0.4852941), wk = 0.0034364 k( 291) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0034364 Dense grid: 86997 G-vectors FFT dimensions: ( 64, 64, 54) Smooth grid: 38529 G-vectors FFT dimensions: ( 48, 48, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.30 Mb ( 220, 88) NL pseudopotentials 0.37 Mb ( 110, 222) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1810) G-vector shells 0.01 Mb ( 828) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.18 Mb ( 220, 352) Each subspace H/S matrix 1.89 Mb ( 352, 352) Each matrix 0.60 Mb ( 222, 2, 88) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./BaCoO3.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 51.6 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 62.8 secs Computing kpt #: 3 total cpu time spent up to now is 73.2 secs Computing kpt #: 4 total cpu time spent up to now is 81.7 secs Computing kpt #: 5 total cpu time spent up to now is 90.2 secs Computing kpt #: 6 total cpu time spent up to now is 99.0 secs Computing kpt #: 7 total cpu time spent up to now is 106.8 secs Computing kpt #: 8 total cpu time spent up to now is 114.4 secs Computing kpt #: 9 total cpu time spent up to now is 122.3 secs Computing kpt #: 10 total cpu time spent up to now is 129.9 secs Computing kpt #: 11 total cpu time spent up to now is 137.5 secs Computing kpt #: 12 total cpu time spent up to now is 145.1 secs Computing kpt #: 13 total cpu time spent up to now is 152.4 secs Computing kpt #: 14 total cpu time spent up to now is 160.6 secs Computing kpt #: 15 total cpu time spent up to now is 169.1 secs Computing kpt #: 16 total cpu time spent up to now is 176.6 secs Computing kpt #: 17 total cpu time spent up to now is 185.2 secs Computing kpt #: 18 total cpu time spent up to now is 194.0 secs Computing kpt #: 19 total cpu time spent up to now is 204.0 secs Computing kpt #: 20 total cpu time spent up to now is 214.1 secs Computing kpt #: 21 total cpu time spent up to now is 224.1 secs Computing kpt #: 22 total cpu time spent up to now is 233.3 secs Computing kpt #: 23 total cpu time spent up to now is 243.3 secs Computing kpt #: 24 total cpu time spent up to now is 252.9 secs Computing kpt #: 25 total cpu time spent up to now is 263.4 secs Computing kpt #: 26 total cpu time spent up to now is 274.4 secs Computing kpt #: 27 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.6 secs Computing kpt #: 28 total cpu time spent up to now is 296.5 secs Computing kpt #: 29 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 307.7 secs Computing kpt #: 30 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 318.8 secs Computing kpt #: 31 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 329.9 secs Computing kpt #: 32 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 340.9 secs Computing kpt #: 33 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 352.7 secs Computing kpt #: 34 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 363.6 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 374.5 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 386.0 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 397.2 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 408.6 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 420.0 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 431.4 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 442.9 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 454.5 secs Computing kpt #: 43 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 466.1 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 477.7 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 489.6 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 501.0 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 512.4 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 523.8 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 535.1 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 546.4 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 557.8 secs Computing kpt #: 52 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 569.3 secs Computing kpt #: 53 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 580.8 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 592.2 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 603.8 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 615.1 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 626.8 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 638.3 secs Computing kpt #: 59 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 651.2 secs Computing kpt #: 60 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 662.6 secs Computing kpt #: 61 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 674.1 secs Computing kpt #: 62 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 685.5 secs Computing kpt #: 63 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 696.8 secs Computing kpt #: 64 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 708.1 secs Computing kpt #: 65 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 719.4 secs Computing kpt #: 66 total cpu time spent up to now is 730.3 secs Computing kpt #: 67 total cpu time spent up to now is 741.4 secs Computing kpt #: 68 total cpu time spent up to now is 752.3 secs Computing kpt #: 69 total cpu time spent up to now is 762.1 secs Computing kpt #: 70 total cpu time spent up to now is 771.2 secs Computing kpt #: 71 total cpu time spent up to now is 780.5 secs Computing kpt #: 72 total cpu time spent up to now is 789.7 secs Computing kpt #: 73 total cpu time spent up to now is 797.8 secs Computing kpt #: 74 total cpu time spent up to now is 806.6 secs Computing kpt #: 75 total cpu time spent up to now is 814.7 secs Computing kpt #: 76 total cpu time spent up to now is 822.7 secs Computing kpt #: 77 total cpu time spent up to now is 830.8 secs Computing kpt #: 78 total cpu time spent up to now is 838.8 secs Computing kpt #: 79 total cpu time spent up to now is 845.7 secs Computing kpt #: 80 total cpu time spent up to now is 852.8 secs Computing kpt #: 81 total cpu time spent up to now is 860.0 secs Computing kpt #: 82 total cpu time spent up to now is 868.0 secs Computing kpt #: 83 total cpu time spent up to now is 875.4 secs Computing kpt #: 84 total cpu time spent up to now is 883.2 secs Computing kpt #: 85 total cpu time spent up to now is 891.1 secs Computing kpt #: 86 total cpu time spent up to now is 899.7 secs Computing kpt #: 87 total cpu time spent up to now is 907.5 secs Computing kpt #: 88 total cpu time spent up to now is 915.8 secs Computing kpt #: 89 total cpu time spent up to now is 925.1 secs Computing kpt #: 90 total cpu time spent up to now is 933.2 secs Computing kpt #: 91 total cpu time spent up to now is 942.9 secs Computing kpt #: 92 total cpu time spent up to now is 952.9 secs Computing kpt #: 93 total cpu time spent up to now is 962.3 secs Computing kpt #: 94 total cpu time spent up to now is 971.1 secs Computing kpt #: 95 total cpu time spent up to now is 980.8 secs Computing kpt #: 96 total cpu time spent up to now is 989.4 secs Computing kpt #: 97 total cpu time spent up to now is 997.9 secs Computing kpt #: 98 total cpu time spent up to now is 1006.0 secs Computing kpt #: 99 total cpu time spent up to now is 1013.6 secs Computing kpt #: 100 total cpu time spent up to now is 1021.3 secs Computing kpt #: 101 total cpu time spent up to now is 1028.8 secs Computing kpt #: 102 total cpu time spent up to now is 1035.4 secs Computing kpt #: 103 total cpu time spent up to now is 1042.1 secs Computing kpt #: 104 total cpu time spent up to now is 1048.2 secs Computing kpt #: 105 total cpu time spent up to now is 1054.8 secs Computing kpt #: 106 total cpu time spent up to now is 1061.6 secs Computing kpt #: 107 total cpu time spent up to now is 1068.1 secs Computing kpt #: 108 total cpu time spent up to now is 1074.1 secs Computing kpt #: 109 total cpu time spent up to now is 1080.2 secs Computing kpt #: 110 total cpu time spent up to now is 1086.8 secs Computing kpt #: 111 total cpu time spent up to now is 1093.2 secs Computing kpt #: 112 total cpu time spent up to now is 1099.5 secs Computing kpt #: 113 total cpu time spent up to now is 1106.3 secs Computing kpt #: 114 total cpu time spent up to now is 1112.5 secs Computing kpt #: 115 total cpu time spent up to now is 1119.3 secs Computing kpt #: 116 total cpu time spent up to now is 1126.2 secs Computing kpt #: 117 total cpu time spent up to now is 1133.8 secs Computing kpt #: 118 total cpu time spent up to now is 1140.8 secs Computing kpt #: 119 total cpu time spent up to now is 1147.9 secs Computing kpt #: 120 total cpu time spent up to now is 1155.5 secs Computing kpt #: 121 total cpu time spent up to now is 1162.6 secs Computing kpt #: 122 total cpu time spent up to now is 1170.3 secs Computing kpt #: 123 total cpu time spent up to now is 1178.3 secs Computing kpt #: 124 total cpu time spent up to now is 1186.0 secs Computing kpt #: 125 total cpu time spent up to now is 1194.5 secs Computing kpt #: 126 total cpu time spent up to now is 1205.4 secs Computing kpt #: 127 total cpu time spent up to now is 1216.9 secs Computing kpt #: 128 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1228.8 secs Computing kpt #: 129 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1240.7 secs Computing kpt #: 130 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1254.2 secs Computing kpt #: 131 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1266.1 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1278.2 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1290.3 secs Computing kpt #: 134 total cpu time spent up to now is 1301.5 secs Computing kpt #: 135 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1313.4 secs Computing kpt #: 136 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1325.5 secs Computing kpt #: 137 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1337.3 secs Computing kpt #: 138 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1349.4 secs Computing kpt #: 139 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1361.1 secs Computing kpt #: 140 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1372.9 secs Computing kpt #: 141 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1384.6 secs Computing kpt #: 142 total cpu time spent up to now is 1395.5 secs Computing kpt #: 143 total cpu time spent up to now is 1403.9 secs Computing kpt #: 144 total cpu time spent up to now is 1412.6 secs Computing kpt #: 145 total cpu time spent up to now is 1421.3 secs Computing kpt #: 146 total cpu time spent up to now is 1429.4 secs Computing kpt #: 147 total cpu time spent up to now is 1438.1 secs Computing kpt #: 148 total cpu time spent up to now is 1446.4 secs Computing kpt #: 149 total cpu time spent up to now is 1454.9 secs Computing kpt #: 150 total cpu time spent up to now is 1466.6 secs Computing kpt #: 151 total cpu time spent up to now is 1475.5 secs Computing kpt #: 152 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1487.4 secs Computing kpt #: 153 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1499.4 secs Computing kpt #: 154 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1511.5 secs Computing kpt #: 155 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1523.5 secs Computing kpt #: 156 total cpu time spent up to now is 1534.8 secs Computing kpt #: 157 total cpu time spent up to now is 1546.8 secs Computing kpt #: 158 total cpu time spent up to now is 1556.5 secs Computing kpt #: 159 total cpu time spent up to now is 1565.3 secs Computing kpt #: 160 total cpu time spent up to now is 1574.7 secs Computing kpt #: 161 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1586.5 secs Computing kpt #: 162 total cpu time spent up to now is 1594.9 secs Computing kpt #: 163 total cpu time spent up to now is 1604.5 secs Computing kpt #: 164 total cpu time spent up to now is 1615.1 secs Computing kpt #: 165 total cpu time spent up to now is 1623.3 secs Computing kpt #: 166 total cpu time spent up to now is 1631.9 secs Computing kpt #: 167 total cpu time spent up to now is 1639.9 secs Computing kpt #: 168 total cpu time spent up to now is 1648.4 secs Computing kpt #: 169 total cpu time spent up to now is 1657.1 secs Computing kpt #: 170 total cpu time spent up to now is 1665.1 secs Computing kpt #: 171 total cpu time spent up to now is 1673.1 secs Computing kpt #: 172 total cpu time spent up to now is 1681.2 secs Computing kpt #: 173 total cpu time spent up to now is 1689.4 secs Computing kpt #: 174 total cpu time spent up to now is 1697.0 secs Computing kpt #: 175 total cpu time spent up to now is 1704.3 secs Computing kpt #: 176 total cpu time spent up to now is 1711.7 secs Computing kpt #: 177 total cpu time spent up to now is 1718.8 secs Computing kpt #: 178 total cpu time spent up to now is 1727.1 secs Computing kpt #: 179 total cpu time spent up to now is 1734.6 secs Computing kpt #: 180 total cpu time spent up to now is 1741.5 secs Computing kpt #: 181 total cpu time spent up to now is 1749.0 secs Computing kpt #: 182 total cpu time spent up to now is 1756.6 secs Computing kpt #: 183 total cpu time spent up to now is 1764.7 secs Computing kpt #: 184 total cpu time spent up to now is 1772.1 secs Computing kpt #: 185 total cpu time spent up to now is 1779.7 secs Computing kpt #: 186 total cpu time spent up to now is 1787.6 secs Computing kpt #: 187 total cpu time spent up to now is 1795.3 secs Computing kpt #: 188 total cpu time spent up to now is 1802.8 secs Computing kpt #: 189 total cpu time spent up to now is 1811.1 secs Computing kpt #: 190 total cpu time spent up to now is 1818.7 secs Computing kpt #: 191 total cpu time spent up to now is 1826.1 secs Computing kpt #: 192 total cpu time spent up to now is 1833.7 secs Computing kpt #: 193 total cpu time spent up to now is 1841.3 secs Computing kpt #: 194 total cpu time spent up to now is 1851.3 secs Computing kpt #: 195 total cpu time spent up to now is 1859.3 secs Computing kpt #: 196 total cpu time spent up to now is 1867.4 secs Computing kpt #: 197 total cpu time spent up to now is 1875.8 secs Computing kpt #: 198 total cpu time spent up to now is 1883.9 secs Computing kpt #: 199 total cpu time spent up to now is 1892.1 secs Computing kpt #: 200 total cpu time spent up to now is 1900.2 secs Computing kpt #: 201 total cpu time spent up to now is 1908.5 secs Computing kpt #: 202 total cpu time spent up to now is 1917.1 secs Computing kpt #: 203 total cpu time spent up to now is 1925.8 secs Computing kpt #: 204 total cpu time spent up to now is 1934.4 secs Computing kpt #: 205 total cpu time spent up to now is 1943.4 secs Computing kpt #: 206 total cpu time spent up to now is 1952.2 secs Computing kpt #: 207 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1964.4 secs Computing kpt #: 208 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1976.1 secs Computing kpt #: 209 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1988.5 secs Computing kpt #: 210 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2000.7 secs Computing kpt #: 211 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2013.0 secs Computing kpt #: 212 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2025.3 secs Computing kpt #: 213 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2037.7 secs Computing kpt #: 214 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2049.9 secs Computing kpt #: 215 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2062.4 secs Computing kpt #: 216 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2074.6 secs Computing kpt #: 217 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2087.0 secs Computing kpt #: 218 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2099.2 secs Computing kpt #: 219 total cpu time spent up to now is 2111.1 secs Computing kpt #: 220 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2123.4 secs Computing kpt #: 221 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2135.4 secs Computing kpt #: 222 total cpu time spent up to now is 2144.1 secs Computing kpt #: 223 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2156.4 secs Computing kpt #: 224 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2168.2 secs Computing kpt #: 225 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2179.9 secs Computing kpt #: 226 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2191.3 secs Computing kpt #: 227 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2203.0 secs Computing kpt #: 228 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2214.4 secs Computing kpt #: 229 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2225.8 secs Computing kpt #: 230 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2237.3 secs Computing kpt #: 231 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2248.8 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2260.3 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2271.8 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2283.7 secs Computing kpt #: 235 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2295.3 secs Computing kpt #: 236 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2306.8 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2318.1 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2329.4 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2341.0 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2352.7 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2364.0 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2375.4 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2386.6 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2398.2 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2409.6 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2421.3 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2432.6 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2444.2 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2456.1 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2467.5 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2479.1 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2490.5 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2502.1 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2513.5 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2525.0 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2535.9 secs Computing kpt #: 257 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2547.2 secs Computing kpt #: 258 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2558.9 secs Computing kpt #: 259 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2570.2 secs Computing kpt #: 260 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2581.7 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2593.6 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2605.1 secs Computing kpt #: 263 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2616.7 secs Computing kpt #: 264 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2627.9 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2639.4 secs Computing kpt #: 266 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2651.0 secs Computing kpt #: 267 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2662.5 secs Computing kpt #: 268 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2673.8 secs Computing kpt #: 269 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2685.2 secs Computing kpt #: 270 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2696.8 secs Computing kpt #: 271 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2708.3 secs Computing kpt #: 272 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2719.7 secs Computing kpt #: 273 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2731.5 secs Computing kpt #: 274 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2742.9 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2756.2 secs Computing kpt #: 276 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2767.7 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2779.1 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2790.7 secs Computing kpt #: 279 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2802.2 secs Computing kpt #: 280 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2813.7 secs Computing kpt #: 281 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2825.2 secs Computing kpt #: 282 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2836.9 secs Computing kpt #: 283 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2848.7 secs Computing kpt #: 284 total cpu time spent up to now is 2860.2 secs Computing kpt #: 285 total cpu time spent up to now is 2868.8 secs Computing kpt #: 286 total cpu time spent up to now is 2877.4 secs Computing kpt #: 287 total cpu time spent up to now is 2885.9 secs Computing kpt #: 288 total cpu time spent up to now is 2893.7 secs Computing kpt #: 289 total cpu time spent up to now is 2901.8 secs Computing kpt #: 290 total cpu time spent up to now is 2909.3 secs Computing kpt #: 291 total cpu time spent up to now is 2916.9 secs ethr = 1.35E-11, avg # of iterations = 93.7 total cpu time spent up to now is 2917.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4861 PWs) bands (ev): -16.4611 -16.4611 -16.2561 -16.2561 -9.2703 -9.2703 -8.0339 -8.0339 -7.9666 -7.9666 -7.9532 -7.9532 -7.6532 -7.6532 -7.6448 -7.6448 -3.3349 -3.3349 -2.8214 -2.8214 -1.5803 -1.5803 -1.4943 -1.4943 -0.8452 -0.8452 -0.7568 -0.7568 3.0201 3.0201 4.1887 4.1887 4.5654 4.5654 4.6963 4.6963 4.8608 4.8608 4.8976 4.8976 4.9199 4.9199 5.8104 5.8104 5.8371 5.8371 6.1613 6.1613 6.1719 6.1719 6.6156 6.6156 6.6799 6.6799 7.5251 7.5251 7.7874 7.7874 8.0514 8.0514 8.0736 8.0736 8.2010 8.2010 8.3586 8.3586 8.4346 8.4346 8.7336 8.7336 9.5457 9.5457 9.6796 9.6796 9.6852 9.6852 11.1054 11.1054 11.1424 11.1424 12.0413 12.0413 12.0738 12.0738 15.1218 15.1218 15.1719 15.1719 k = 0.0152 0.0087-0.0000 ( 4859 PWs) bands (ev): -16.4609 -16.4609 -16.2562 -16.2562 -9.2706 -9.2706 -8.0340 -8.0340 -7.9667 -7.9667 -7.9533 -7.9533 -7.6533 -7.6533 -7.6449 -7.6449 -3.3342 -3.3342 -2.8213 -2.8213 -1.5791 -1.5791 -1.4936 -1.4936 -0.8449 -0.8449 -0.7569 -0.7569 3.0211 3.0211 4.1874 4.1874 4.5636 4.5636 4.6936 4.6936 4.8641 4.8641 4.8979 4.8979 4.9201 4.9201 5.8107 5.8107 5.8374 5.8374 6.1605 6.1605 6.1713 6.1713 6.6148 6.6148 6.6790 6.6790 7.5253 7.5253 7.7863 7.7863 8.0515 8.0515 8.0736 8.0736 8.2009 8.2009 8.3576 8.3576 8.4332 8.4332 8.7332 8.7332 9.5456 9.5456 9.6791 9.6791 9.6846 9.6846 11.1062 11.1062 11.1431 11.1431 12.0403 12.0403 12.0728 12.0728 15.1222 15.1222 15.1723 15.1723 k = 0.0303 0.0175-0.0000 ( 4849 PWs) bands (ev): -16.4606 -16.4606 -16.2564 -16.2564 -9.2718 -9.2718 -8.0343 -8.0343 -7.9668 -7.9668 -7.9535 -7.9535 -7.6534 -7.6534 -7.6451 -7.6451 -3.3319 -3.3319 -2.8211 -2.8211 -1.5755 -1.5755 -1.4916 -1.4916 -0.8442 -0.8442 -0.7574 -0.7574 3.0243 3.0243 4.1837 4.1837 4.5582 4.5582 4.6863 4.6863 4.8731 4.8731 4.8989 4.8989 4.9209 4.9209 5.8114 5.8114 5.8385 5.8385 6.1580 6.1580 6.1696 6.1696 6.6122 6.6122 6.6762 6.6762 7.5259 7.5259 7.7830 7.7830 8.0515 8.0515 8.0736 8.0736 8.2006 8.2006 8.3548 8.3548 8.4290 8.4290 8.7320 8.7320 9.5453 9.5453 9.6772 9.6772 9.6836 9.6836 11.1084 11.1084 11.1453 11.1453 12.0368 12.0368 12.0701 12.0701 15.1233 15.1233 15.1737 15.1737 k = 0.0455 0.0262-0.0000 ( 4843 PWs) bands (ev): -16.4599 -16.4599 -16.2568 -16.2568 -9.2737 -9.2737 -8.0349 -8.0349 -7.9670 -7.9670 -7.9540 -7.9540 -7.6537 -7.6537 -7.6456 -7.6456 -3.3281 -3.3281 -2.8208 -2.8208 -1.5695 -1.5695 -1.4882 -1.4882 -0.8429 -0.8429 -0.7582 -0.7582 3.0296 3.0296 4.1775 4.1775 4.5491 4.5491 4.6759 4.6759 4.8858 4.8858 4.9012 4.9012 4.9221 4.9221 5.8120 5.8120 5.8406 5.8406 6.1537 6.1537 6.1669 6.1669 6.6073 6.6073 6.6722 6.6722 7.5267 7.5267 7.7774 7.7774 8.0517 8.0517 8.0737 8.0737 8.2001 8.2001 8.3500 8.3500 8.4224 8.4224 8.7300 8.7300 9.5447 9.5447 9.6727 9.6727 9.6830 9.6830 11.1120 11.1120 11.1490 11.1490 12.0302 12.0302 12.0665 12.0665 15.1251 15.1251 15.1762 15.1762 k = 0.0606 0.0350-0.0000 ( 4833 PWs) bands (ev): -16.4590 -16.4590 -16.2573 -16.2573 -9.2764 -9.2764 -8.0357 -8.0357 -7.9673 -7.9673 -7.9546 -7.9546 -7.6542 -7.6542 -7.6461 -7.6461 -3.3229 -3.3229 -2.8203 -2.8203 -1.5612 -1.5612 -1.4833 -1.4833 -0.8411 -0.8411 -0.7594 -0.7594 3.0369 3.0369 4.1690 4.1690 4.5364 4.5364 4.6639 4.6639 4.8966 4.8966 4.9087 4.9087 4.9239 4.9239 5.8120 5.8120 5.8443 5.8443 6.1474 6.1474 6.1634 6.1634 6.5997 6.5997 6.6678 6.6678 7.5276 7.5276 7.7699 7.7699 8.0518 8.0518 8.0736 8.0736 8.1994 8.1994 8.3430 8.3430 8.4136 8.4136 8.7271 8.7271 9.5440 9.5440 9.6657 9.6657 9.6829 9.6829 11.1168 11.1168 11.1541 11.1541 12.0197 12.0197 12.0630 12.0630 15.1272 15.1272 15.1801 15.1801 k = 0.0758 0.0437-0.0000 ( 4831 PWs) bands (ev): -16.4579 -16.4579 -16.2580 -16.2580 -9.2798 -9.2798 -8.0367 -8.0367 -7.9677 -7.9677 -7.9552 -7.9552 -7.6548 -7.6548 -7.6468 -7.6468 -3.3163 -3.3163 -2.8198 -2.8198 -1.5508 -1.5508 -1.4770 -1.4770 -0.8389 -0.8389 -0.7608 -0.7608 3.0462 3.0462 4.1583 4.1583 4.5204 4.5204 4.6513 4.6513 4.9009 4.9009 4.9246 4.9246 4.9266 4.9266 5.8111 5.8111 5.8500 5.8500 6.1390 6.1390 6.1593 6.1593 6.5887 6.5887 6.6635 6.6635 7.5285 7.5285 7.7604 7.7604 8.0519 8.0519 8.0736 8.0736 8.1984 8.1984 8.3339 8.3339 8.4033 8.4033 8.7233 8.7233 9.5430 9.5430 9.6567 9.6567 9.6831 9.6831 11.1229 11.1229 11.1606 11.1606 12.0050 12.0050 12.0600 12.0600 15.1294 15.1294 15.1857 15.1857 k = 0.0909 0.0525-0.0000 ( 4830 PWs) bands (ev): -16.4565 -16.4565 -16.2588 -16.2588 -9.2838 -9.2838 -8.0380 -8.0380 -7.9684 -7.9684 -7.9557 -7.9557 -7.6557 -7.6557 -7.6476 -7.6476 -3.3084 -3.3084 -2.8191 -2.8191 -1.5384 -1.5384 -1.4692 -1.4692 -0.8363 -0.8363 -0.7626 -0.7626 3.0574 3.0574 4.1455 4.1455 4.5012 4.5012 4.6385 4.6385 4.9036 4.9036 4.9291 4.9291 4.9441 4.9441 5.8092 5.8092 5.8574 5.8574 6.1286 6.1286 6.1545 6.1545 6.5744 6.5744 6.6598 6.6598 7.5291 7.5291 7.7492 7.7492 8.0521 8.0521 8.0734 8.0734 8.1972 8.1972 8.3224 8.3224 8.3919 8.3919 8.7186 8.7186 9.5418 9.5418 9.6459 9.6459 9.6834 9.6834 11.1300 11.1300 11.1686 11.1686 11.9864 11.9864 12.0575 12.0575 15.1312 15.1312 15.1933 15.1933 k = 0.1061 0.0612-0.0000 ( 4822 PWs) bands (ev): -16.4549 -16.4549 -16.2598 -16.2598 -9.2885 -9.2885 -8.0395 -8.0395 -7.9693 -7.9693 -7.9562 -7.9562 -7.6569 -7.6569 -7.6483 -7.6483 -3.2991 -3.2991 -2.8184 -2.8184 -1.5243 -1.5243 -1.4596 -1.4596 -0.8332 -0.8332 -0.7646 -0.7646 3.0706 3.0706 4.1307 4.1307 4.4795 4.4795 4.6258 4.6258 4.9063 4.9063 4.9326 4.9326 4.9640 4.9640 5.8064 5.8064 5.8664 5.8664 6.1161 6.1161 6.1492 6.1492 6.5570 6.5570 6.6568 6.6568 7.5293 7.5293 7.7366 7.7366 8.0523 8.0523 8.0732 8.0732 8.1957 8.1957 8.3083 8.3083 8.3801 8.3801 8.7129 8.7129 9.5404 9.5404 9.6336 9.6336 9.6837 9.6837 11.1381 11.1381 11.1780 11.1780 11.9645 11.9645 12.0554 12.0554 15.1326 15.1326 15.2032 15.2032 k = 0.1212 0.0700-0.0000 ( 4820 PWs) bands (ev): -16.4530 -16.4530 -16.2609 -16.2609 -9.2938 -9.2938 -8.0412 -8.0412 -7.9706 -7.9706 -7.9564 -7.9564 -7.6584 -7.6584 -7.6491 -7.6491 -3.2887 -3.2887 -2.8177 -2.8177 -1.5088 -1.5088 -1.4481 -1.4481 -0.8299 -0.8299 -0.7670 -0.7670 3.0854 3.0854 4.1142 4.1142 4.4555 4.4555 4.6130 4.6130 4.9090 4.9090 4.9367 4.9367 4.9843 4.9843 5.8028 5.8028 5.8767 5.8767 6.1017 6.1017 6.1434 6.1434 6.5371 6.5371 6.6540 6.6540 7.5288 7.5288 7.7227 7.7227 8.0525 8.0525 8.0730 8.0730 8.1937 8.1937 8.2920 8.2920 8.3684 8.3684 8.7062 8.7062 9.5386 9.5386 9.6201 9.6201 9.6840 9.6840 11.1470 11.1470 11.1888 11.1888 11.9396 11.9396 12.0533 12.0533 15.1334 15.1334 15.2153 15.2153 k = 0.1364 0.0787-0.0000 ( 4818 PWs) bands (ev): -16.4510 -16.4510 -16.2622 -16.2622 -9.2997 -9.2997 -8.0430 -8.0430 -7.9721 -7.9721 -7.9563 -7.9563 -7.6603 -7.6603 -7.6498 -7.6498 -3.2771 -3.2771 -2.8169 -2.8169 -1.4924 -1.4924 -1.4343 -1.4343 -0.8263 -0.8263 -0.7695 -0.7695 3.1020 3.1020 4.0961 4.0961 4.4298 4.4298 4.5999 4.5999 4.9117 4.9117 4.9414 4.9414 5.0045 5.0045 5.7987 5.7987 5.8881 5.8881 6.0853 6.0853 6.1372 6.1372 6.5153 6.5153 6.6514 6.6514 7.5274 7.5274 7.7079 7.7079 8.0528 8.0528 8.0725 8.0725 8.1912 8.1912 8.2739 8.2739 8.3571 8.3571 8.6985 8.6985 9.5363 9.5363 9.6056 9.6056 9.6843 9.6843 11.1567 11.1567 11.2008 11.2008 11.9122 11.9122 12.0514 12.0514 15.1337 15.1337 15.2299 15.2299 k = 0.1515 0.0875-0.0000 ( 4814 PWs) bands (ev): -16.4487 -16.4487 -16.2636 -16.2636 -9.3061 -9.3061 -8.0450 -8.0450 -7.9740 -7.9740 -7.9560 -7.9560 -7.6625 -7.6625 -7.6504 -7.6504 -3.2645 -3.2645 -2.8161 -2.8161 -1.4757 -1.4757 -1.4179 -1.4179 -0.8226 -0.8226 -0.7722 -0.7722 3.1201 3.1201 4.0767 4.0767 4.4027 4.4027 4.5867 4.5867 4.9146 4.9146 4.9466 4.9466 5.0246 5.0246 5.7939 5.7939 5.9003 5.9003 6.0670 6.0670 6.1307 6.1307 6.4922 6.4922 6.6485 6.6485 7.5249 7.5249 7.6924 7.6924 8.0531 8.0531 8.0718 8.0718 8.1876 8.1876 8.2549 8.2549 8.3463 8.3463 8.6898 8.6898 9.5335 9.5335 9.5905 9.5905 9.6845 9.6845 11.1669 11.1669 11.2139 11.2139 11.8827 11.8827 12.0496 12.0496 15.1335 15.1335 15.2467 15.2467 k = 0.1667 0.0962-0.0000 ( 4812 PWs) bands (ev): -16.4462 -16.4462 -16.2651 -16.2651 -9.3129 -9.3129 -8.0471 -8.0471 -7.9762 -7.9762 -7.9555 -7.9555 -7.6650 -7.6650 -7.6510 -7.6510 -3.2511 -3.2511 -2.8153 -2.8153 -1.4589 -1.4589 -1.3987 -1.3987 -0.8190 -0.8190 -0.7749 -0.7749 3.1396 3.1396 4.0562 4.0562 4.3744 4.3744 4.5731 4.5731 4.9175 4.9175 4.9523 4.9523 5.0443 5.0443 5.7888 5.7888 5.9129 5.9129 6.0470 6.0470 6.1239 6.1239 6.4685 6.4685 6.6453 6.6453 7.5212 7.5212 7.6765 7.6765 8.0535 8.0535 8.0707 8.0707 8.1821 8.1821 8.2365 8.2365 8.3361 8.3361 8.6801 8.6801 9.5296 9.5296 9.5757 9.5757 9.6847 9.6847 11.1777 11.1777 11.2279 11.2279 11.8514 11.8514 12.0478 12.0478 15.1328 15.1328 15.2659 15.2659 k = 0.1818 0.1050-0.0000 ( 4810 PWs) bands (ev): -16.4435 -16.4435 -16.2668 -16.2668 -9.3201 -9.3201 -8.0492 -8.0492 -7.9785 -7.9785 -7.9547 -7.9547 -7.6678 -7.6678 -7.6516 -7.6516 -3.2367 -3.2367 -2.8147 -2.8147 -1.4424 -1.4424 -1.3766 -1.3766 -0.8157 -0.8157 -0.7775 -0.7775 3.1603 3.1603 4.0347 4.0347 4.3452 4.3452 4.5591 4.5591 4.9205 4.9205 4.9585 4.9585 5.0635 5.0635 5.7832 5.7832 5.9257 5.9257 6.0254 6.0254 6.1169 6.1169 6.4446 6.4446 6.6415 6.6415 7.5160 7.5160 7.6606 7.6606 8.0539 8.0539 8.0690 8.0690 8.1734 8.1734 8.2208 8.2208 8.3263 8.3263 8.6695 8.6695 9.5238 9.5238 9.5620 9.5620 9.6848 9.6848 11.1889 11.1889 11.2427 11.2427 11.8187 11.8187 12.0461 12.0461 15.1318 15.1318 15.2873 15.2873 k = 0.1970 0.1137-0.0000 ( 4806 PWs) bands (ev): -16.4407 -16.4407 -16.2686 -16.2686 -9.3277 -9.3277 -8.0514 -8.0514 -7.9811 -7.9811 -7.9539 -7.9539 -7.6709 -7.6709 -7.6522 -7.6522 -3.2217 -3.2217 -2.8141 -2.8141 -1.4262 -1.4262 -1.3519 -1.3519 -0.8130 -0.8130 -0.7797 -0.7797 3.1821 3.1821 4.0125 4.0125 4.3154 4.3154 4.5448 4.5448 4.9235 4.9235 4.9650 4.9650 5.0822 5.0822 5.7774 5.7774 5.9378 5.9378 6.0030 6.0030 6.1098 6.1098 6.4211 6.4211 6.6370 6.6370 7.5093 7.5093 7.6448 7.6448 8.0543 8.0543 8.0663 8.0663 8.1607 8.1607 8.2097 8.2097 8.3172 8.3172 8.6579 8.6579 9.5148 9.5148 9.5511 9.5511 9.6848 9.6848 11.2005 11.2005 11.2580 11.2580 11.7851 11.7851 12.0445 12.0445 15.1306 15.1306 15.3110 15.3110 k = 0.2121 0.1225-0.0000 ( 4802 PWs) bands (ev): -16.4377 -16.4377 -16.2706 -16.2706 -9.3355 -9.3355 -8.0534 -8.0534 -7.9838 -7.9838 -7.9529 -7.9529 -7.6741 -7.6741 -7.6527 -7.6527 -3.2061 -3.2061 -2.8137 -2.8137 -1.4100 -1.4100 -1.3250 -1.3250 -0.8116 -0.8116 -0.7808 -0.7808 3.2048 3.2048 3.9899 3.9899 4.2851 4.2851 4.5303 4.5303 4.9266 4.9266 4.9718 4.9718 5.1004 5.1004 5.7712 5.7712 5.9454 5.9454 5.9833 5.9833 6.1027 6.1027 6.3983 6.3983 6.6317 6.6317 7.5009 7.5009 7.6295 7.6295 8.0547 8.0547 8.0620 8.0620 8.1455 8.1455 8.2027 8.2027 8.3086 8.3086 8.6454 8.6454 9.5023 9.5023 9.5436 9.5436 9.6847 9.6847 11.2124 11.2124 11.2738 11.2738 11.7508 11.7508 12.0429 12.0429 15.1291 15.1291 15.3370 15.3370 k = 0.2273 0.1312-0.0000 ( 4806 PWs) bands (ev): -16.4345 -16.4345 -16.2726 -16.2726 -9.3434 -9.3434 -8.0555 -8.0555 -7.9865 -7.9865 -7.9519 -7.9519 -7.6776 -7.6776 -7.6533 -7.6533 -3.1901 -3.1901 -2.8135 -2.8135 -1.3937 -1.3937 -1.2964 -1.2964 -0.8120 -0.8120 -0.7805 -0.7805 3.2282 3.2282 3.9670 3.9670 4.2544 4.2544 4.5155 4.5155 4.9297 4.9297 4.9787 4.9787 5.1179 5.1179 5.7649 5.7649 5.9355 5.9355 5.9796 5.9796 6.0957 6.0957 6.3766 6.3766 6.6256 6.6256 7.4909 7.4909 7.6149 7.6149 8.0531 8.0531 8.0571 8.0571 8.1308 8.1308 8.1979 8.1979 8.3006 8.3006 8.6321 8.6321 9.4873 9.4873 9.5384 9.5384 9.6845 9.6845 11.2245 11.2245 11.2897 11.2897 11.7161 11.7161 12.0415 12.0415 15.1274 15.1274 15.3651 15.3651 k = 0.2424 0.1400-0.0000 ( 4808 PWs) bands (ev): -16.4313 -16.4313 -16.2748 -16.2748 -9.3515 -9.3515 -8.0573 -8.0573 -7.9893 -7.9893 -7.9509 -7.9509 -7.6811 -7.6811 -7.6539 -7.6539 -3.1736 -3.1736 -2.8135 -2.8135 -1.3773 -1.3773 -1.2663 -1.2663 -0.8143 -0.8143 -0.7788 -0.7788 3.2521 3.2521 3.9440 3.9440 4.2236 4.2236 4.5006 4.5006 4.9329 4.9329 4.9858 4.9858 5.1348 5.1348 5.7585 5.7585 5.9107 5.9107 5.9891 5.9891 6.0888 6.0888 6.3563 6.3563 6.6187 6.6187 7.4792 7.4792 7.6011 7.6011 8.0437 8.0437 8.0566 8.0566 8.1191 8.1191 8.1943 8.1943 8.2934 8.2934 8.6181 8.6181 9.4712 9.4712 9.5346 9.5346 9.6842 9.6842 11.2367 11.2367 11.3057 11.3057 11.6814 11.6814 12.0401 12.0401 15.1256 15.1256 15.3953 15.3953 k = 0.2576 0.1487-0.0000 ( 4800 PWs) bands (ev): -16.4279 -16.4279 -16.2771 -16.2771 -9.3596 -9.3596 -8.0591 -8.0591 -7.9921 -7.9921 -7.9500 -7.9500 -7.6848 -7.6848 -7.6544 -7.6544 -3.1569 -3.1569 -2.8138 -2.8138 -1.3607 -1.3607 -1.2352 -1.2352 -0.8181 -0.8181 -0.7761 -0.7761 3.2763 3.2763 3.9212 3.9212 4.1930 4.1930 4.4856 4.4856 4.9361 4.9361 4.9930 4.9930 5.1510 5.1510 5.7519 5.7519 5.8817 5.8817 6.0013 6.0013 6.0823 6.0823 6.3375 6.3375 6.6109 6.6109 7.4659 7.4659 7.5884 7.5884 8.0303 8.0303 8.0571 8.0571 8.1111 8.1111 8.1912 8.1912 8.2869 8.2869 8.6034 8.6034 9.4547 9.4547 9.5315 9.5315 9.6838 9.6838 11.2489 11.2489 11.3215 11.3215 11.6470 11.6470 12.0388 12.0388 15.1237 15.1237 15.4276 15.4276 k = 0.2727 0.1575-0.0000 ( 4808 PWs) bands (ev): -16.4244 -16.4244 -16.2795 -16.2795 -9.3677 -9.3677 -8.0606 -8.0606 -7.9950 -7.9950 -7.9491 -7.9491 -7.6885 -7.6885 -7.6550 -7.6550 -3.1401 -3.1401 -2.8143 -2.8143 -1.3438 -1.3438 -1.2034 -1.2034 -0.8230 -0.8230 -0.7728 -0.7728 3.3005 3.3005 3.8988 3.8988 4.1626 4.1626 4.4707 4.4707 4.9392 4.9392 5.0001 5.0001 5.1667 5.1667 5.7454 5.7454 5.8508 5.8508 6.0136 6.0136 6.0762 6.0762 6.3204 6.3204 6.6024 6.6024 7.4511 7.4511 7.5768 7.5768 8.0146 8.0146 8.0578 8.0578 8.1061 8.1061 8.1885 8.1885 8.2811 8.2811 8.5881 8.5881 9.4385 9.4385 9.5287 9.5287 9.6833 9.6833 11.2611 11.2611 11.3370 11.3370 11.6132 11.6132 12.0377 12.0377 15.1217 15.1217 15.4619 15.4619 k = 0.2879 0.1662-0.0000 ( 4808 PWs) bands (ev): -16.4208 -16.4208 -16.2819 -16.2819 -9.3756 -9.3756 -8.0620 -8.0620 -7.9977 -7.9977 -7.9484 -7.9484 -7.6923 -7.6923 -7.6556 -7.6556 -3.1232 -3.1232 -2.8152 -2.8152 -1.3269 -1.3269 -1.1712 -1.1712 -0.8287 -0.8287 -0.7694 -0.7694 3.3244 3.3244 3.8768 3.8768 4.1328 4.1328 4.4561 4.4561 4.9424 4.9424 5.0072 5.0072 5.1819 5.1819 5.7389 5.7389 5.8189 5.8189 6.0251 6.0251 6.0710 6.0710 6.3051 6.3051 6.5932 6.5932 7.4350 7.4350 7.5664 7.5664 7.9980 7.9980 8.0585 8.0585 8.1031 8.1031 8.1860 8.1860 8.2763 8.2763 8.5724 8.5724 9.4227 9.4227 9.5261 9.5261 9.6827 9.6827 11.2730 11.2730 11.3521 11.3521 11.5804 11.5804 12.0367 12.0367 15.1196 15.1196 15.4981 15.4981 k = 0.3030 0.1750-0.0000 ( 4808 PWs) bands (ev): -16.4172 -16.4172 -16.2845 -16.2845 -9.3834 -9.3834 -8.0631 -8.0631 -8.0004 -8.0004 -7.9477 -7.9477 -7.6959 -7.6959 -7.6561 -7.6561 -3.1064 -3.1064 -2.8165 -2.8165 -1.3098 -1.3098 -1.1388 -1.1388 -0.8350 -0.8350 -0.7661 -0.7661 3.3478 3.3478 3.8556 3.8556 4.1037 4.1037 4.4417 4.4417 4.9455 4.9455 5.0141 5.0141 5.1965 5.1965 5.7325 5.7325 5.7863 5.7863 6.0349 6.0349 6.0676 6.0676 6.2915 6.2915 6.5835 6.5835 7.4179 7.4179 7.5573 7.5573 7.9815 7.9815 8.0592 8.0592 8.1014 8.1014 8.1836 8.1836 8.2723 8.2723 8.5564 8.5564 9.4075 9.4075 9.5237 9.5237 9.6821 9.6821 11.2847 11.2847 11.3665 11.3665 11.5486 11.5486 12.0358 12.0358 15.1175 15.1175 15.5360 15.5360 k = 0.3182 0.1837-0.0000 ( 4812 PWs) bands (ev): -16.4136 -16.4136 -16.2871 -16.2871 -9.3909 -9.3909 -8.0640 -8.0640 -8.0030 -8.0030 -7.9472 -7.9472 -7.6995 -7.6995 -7.6566 -7.6566 -3.0897 -3.0897 -2.8182 -2.8182 -1.2927 -1.2927 -1.1067 -1.1067 -0.8418 -0.8418 -0.7631 -0.7631 3.3704 3.3704 3.8352 3.8352 4.0757 4.0757 4.4278 4.4278 4.9484 4.9484 5.0207 5.0207 5.2109 5.2109 5.7261 5.7261 5.7536 5.7536 6.0408 6.0408 6.0679 6.0679 6.2796 6.2796 6.5735 6.5735 7.4000 7.4000 7.5494 7.5494 7.9658 7.9658 8.0599 8.0599 8.1006 8.1006 8.1814 8.1814 8.2692 8.2692 8.5402 8.5402 9.3932 9.3932 9.5215 9.5215 9.6814 9.6814 11.2960 11.2960 11.3802 11.3802 11.5183 11.5183 12.0350 12.0350 15.1155 15.1155 15.5754 15.5754 k = 0.3333 0.1925-0.0000 ( 4808 PWs) bands (ev): -16.4100 -16.4100 -16.2897 -16.2897 -9.3981 -9.3981 -8.0647 -8.0647 -8.0055 -8.0055 -7.9469 -7.9469 -7.7030 -7.7030 -7.6571 -7.6571 -3.0734 -3.0734 -2.8203 -2.8203 -1.2757 -1.2757 -1.0750 -1.0750 -0.8490 -0.8490 -0.7606 -0.7606 3.3919 3.3919 3.8158 3.8158 4.0490 4.0490 4.4144 4.4144 4.9513 4.9513 5.0271 5.0271 5.2249 5.2249 5.7175 5.7175 5.7233 5.7233 6.0414 6.0414 6.0732 6.0732 6.2693 6.2693 6.5632 6.5632 7.3817 7.3817 7.5427 7.5427 7.9512 7.9512 8.0607 8.0607 8.1003 8.1003 8.1792 8.1792 8.2670 8.2670 8.5239 8.5239 9.3798 9.3798 9.5194 9.5194 9.6806 9.6806 11.3068 11.3068 11.3930 11.3930 11.4897 11.4897 12.0343 12.0343 15.1135 15.1135 15.6160 15.6160 k = 0.3485 0.2012-0.0000 ( 4816 PWs) bands (ev): -16.4064 -16.4064 -16.2923 -16.2923 -9.4049 -9.4049 -8.0651 -8.0651 -8.0078 -8.0078 -7.9467 -7.9467 -7.7063 -7.7063 -7.6576 -7.6576 -3.0574 -3.0574 -2.8228 -2.8228 -1.2589 -1.2589 -1.0441 -1.0441 -0.8564 -0.8564 -0.7587 -0.7587 3.4122 3.4122 3.7976 3.7976 4.0240 4.0240 4.4018 4.4018 4.9541 4.9541 5.0331 5.0331 5.2389 5.2389 5.6874 5.6874 5.7151 5.7151 6.0390 6.0390 6.0812 6.0812 6.2605 6.2605 6.5529 6.5529 7.3633 7.3633 7.5370 7.5370 7.9377 7.9377 8.0614 8.0614 8.1004 8.1004 8.1770 8.1770 8.2658 8.2658 8.5076 8.5076 9.3673 9.3673 9.5174 9.5174 9.6799 9.6799 11.3169 11.3169 11.4046 11.4046 11.4632 11.4632 12.0337 12.0337 15.1116 15.1116 15.6576 15.6576 k = 0.3636 0.2099-0.0000 ( 4822 PWs) bands (ev): -16.4029 -16.4029 -16.2949 -16.2949 -9.4113 -9.4113 -8.0654 -8.0654 -8.0099 -8.0099 -7.9467 -7.9467 -7.7093 -7.7093 -7.6581 -7.6581 -3.0420 -3.0420 -2.8257 -2.8257 -1.2426 -1.2426 -1.0143 -1.0143 -0.8641 -0.8641 -0.7575 -0.7575 3.4308 3.4308 3.7806 3.7806 4.0008 4.0008 4.3899 4.3899 4.9567 4.9567 5.0387 5.0387 5.2528 5.2528 5.6554 5.6554 5.7096 5.7096 6.0356 6.0356 6.0897 6.0897 6.2531 6.2531 6.5429 6.5429 7.3453 7.3453 7.5324 7.5324 7.9256 7.9256 8.0621 8.0621 8.1007 8.1007 8.1750 8.1750 8.2655 8.2655 8.4916 8.4916 9.3559 9.3559 9.5155 9.5155 9.6791 9.6791 11.3263 11.3263 11.4139 11.4139 11.4402 11.4402 12.0332 12.0332 15.1097 15.1097 15.6997 15.6997 k = 0.3788 0.2187-0.0000 ( 4826 PWs) bands (ev): -16.3995 -16.3995 -16.2975 -16.2975 -9.4171 -9.4171 -8.0655 -8.0655 -8.0119 -8.0119 -7.9468 -7.9468 -7.7121 -7.7121 -7.6585 -7.6585 -3.0272 -3.0272 -2.8291 -2.8291 -1.2267 -1.2267 -0.9858 -0.9858 -0.8717 -0.8717 -0.7572 -0.7572 3.4476 3.4476 3.7651 3.7651 3.9798 3.9798 4.3789 4.3789 4.9591 4.9591 5.0439 5.0439 5.2669 5.2669 5.6241 5.6241 5.7046 5.7046 6.0321 6.0321 6.0980 6.0980 6.2469 6.2469 6.5332 6.5332 7.3280 7.3280 7.5287 7.5287 7.9148 7.9148 8.0627 8.0627 8.1012 8.1012 8.1731 8.1731 8.2661 8.2661 8.4760 8.4760 9.3457 9.3457 9.5138 9.5138 9.6783 9.6783 11.3347 11.3347 11.4102 11.4102 11.4314 11.4314 12.0328 12.0328 15.1080 15.1080 15.7419 15.7419 k = 0.3939 0.2274-0.0000 ( 4810 PWs) bands (ev): -16.3963 -16.3963 -16.3000 -16.3000 -9.4224 -9.4224 -8.0655 -8.0655 -8.0137 -8.0137 -7.9470 -7.9470 -7.7147 -7.7147 -7.6589 -7.6589 -3.0131 -3.0131 -2.8328 -2.8328 -1.2116 -1.2116 -0.9591 -0.9591 -0.8790 -0.8790 -0.7578 -0.7578 3.4625 3.4625 3.7511 3.7511 3.9612 3.9612 4.3691 4.3691 4.9614 4.9614 5.0486 5.0486 5.2812 5.2812 5.5936 5.5936 5.7001 5.7001 6.0288 6.0288 6.1056 6.1056 6.2419 6.2419 6.5242 6.5242 7.3118 7.3118 7.5258 7.5258 7.9054 7.9054 8.0634 8.0634 8.1019 8.1019 8.1713 8.1713 8.2676 8.2676 8.4609 8.4609 9.3366 9.3366 9.5123 9.5123 9.6777 9.6777 11.3420 11.3420 11.3930 11.3930 11.4379 11.4379 12.0325 12.0325 15.1064 15.1064 15.7835 15.7835 k = 0.4091 0.2362-0.0000 ( 4818 PWs) bands (ev): -16.3933 -16.3933 -16.3024 -16.3024 -9.4271 -9.4271 -8.0654 -8.0654 -8.0153 -8.0153 -7.9473 -7.9473 -7.7169 -7.7169 -7.6593 -7.6593 -2.9999 -2.9999 -2.8369 -2.8369 -1.1975 -1.1975 -0.9349 -0.9349 -0.8854 -0.8854 -0.7596 -0.7596 3.4753 3.4753 3.7387 3.7387 3.9450 3.9450 4.3603 4.3603 4.9634 4.9634 5.0528 5.0528 5.2959 5.2959 5.5643 5.5643 5.6961 5.6961 6.0259 6.0259 6.1123 6.1123 6.2379 6.2379 6.5159 6.5159 7.2969 7.2969 7.5235 7.5235 7.8972 7.8972 8.0639 8.0639 8.1026 8.1026 8.1696 8.1696 8.2698 8.2698 8.4467 8.4467 9.3286 9.3286 9.5109 9.5109 9.6770 9.6770 11.3471 11.3471 11.3775 11.3775 11.4451 11.4451 12.0323 12.0323 15.1050 15.1050 15.8236 15.8236 k = 0.4242 0.2449-0.0000 ( 4814 PWs) bands (ev): -16.3905 -16.3905 -16.3045 -16.3045 -9.4311 -9.4311 -8.0652 -8.0652 -8.0166 -8.0166 -7.9476 -7.9476 -7.7189 -7.7189 -7.6596 -7.6596 -2.9879 -2.9879 -2.8411 -2.8411 -1.1847 -1.1847 -0.9157 -0.9157 -0.8884 -0.8884 -0.7624 -0.7624 3.4859 3.4859 3.7280 3.7280 3.9315 3.9315 4.3527 4.3527 4.9651 4.9651 5.0564 5.0564 5.3112 5.3112 5.5362 5.5362 5.6926 5.6926 6.0233 6.0233 6.1181 6.1181 6.2348 6.2348 6.5086 6.5086 7.2838 7.2838 7.5218 7.5218 7.8904 7.8904 8.0644 8.0644 8.1033 8.1033 8.1681 8.1681 8.2726 8.2726 8.4336 8.4336 9.3218 9.3218 9.5097 9.5097 9.6764 9.6764 11.3471 11.3471 11.3684 11.3684 11.4516 11.4516 12.0320 12.0320 15.1038 15.1038 15.8613 15.8613 k = 0.4394 0.2537-0.0000 ( 4810 PWs) bands (ev): -16.3882 -16.3882 -16.3064 -16.3064 -9.4344 -9.4344 -8.0650 -8.0650 -8.0178 -8.0178 -7.9480 -7.9480 -7.7205 -7.7205 -7.6598 -7.6598 -2.9772 -2.9772 -2.8453 -2.8453 -1.1735 -1.1735 -0.9093 -0.9093 -0.8801 -0.8801 -0.7663 -0.7663 3.4944 3.4944 3.7191 3.7191 3.9207 3.9207 4.3464 4.3464 4.9665 4.9665 5.0594 5.0594 5.3269 5.3269 5.5096 5.5096 5.6898 5.6898 6.0212 6.0212 6.1229 6.1229 6.2324 6.2324 6.5025 6.5025 7.2727 7.2727 7.5206 7.5206 7.8848 7.8848 8.0649 8.0649 8.1040 8.1040 8.1668 8.1668 8.2758 8.2758 8.4218 8.4218 9.3163 9.3163 9.5087 9.5087 9.6759 9.6759 11.3401 11.3401 11.3678 11.3678 11.4570 11.4570 12.0319 12.0319 15.1028 15.1028 15.8954 15.8954 k = 0.4545 0.2624-0.0000 ( 4820 PWs) bands (ev): -16.3862 -16.3862 -16.3080 -16.3080 -9.4371 -9.4371 -8.0648 -8.0648 -8.0186 -8.0186 -7.9483 -7.9483 -7.7217 -7.7217 -7.6600 -7.6600 -2.9681 -2.9681 -2.8492 -2.8492 -1.1642 -1.1642 -0.9118 -0.9118 -0.8647 -0.8647 -0.7712 -0.7712 3.5007 3.5007 3.7121 3.7121 3.9124 3.9124 4.3415 4.3415 4.9677 4.9677 5.0617 5.0617 5.3430 5.3430 5.4849 5.4849 5.6875 5.6875 6.0195 6.0195 6.1267 6.1267 6.2306 6.2306 6.4975 6.4975 7.2638 7.2638 7.5197 7.5197 7.8805 7.8805 8.0652 8.0652 8.1045 8.1045 8.1658 8.1658 8.2790 8.2790 8.4118 8.4118 9.3120 9.3120 9.5079 9.5079 9.6754 9.6754 11.3318 11.3318 11.3701 11.3701 11.4613 11.4613 12.0318 12.0318 15.1020 15.1020 15.9244 15.9244 k = 0.4697 0.2712-0.0000 ( 4824 PWs) bands (ev): -16.3848 -16.3848 -16.3092 -16.3092 -9.4390 -9.4390 -8.0646 -8.0646 -8.0193 -8.0193 -7.9485 -7.9485 -7.7226 -7.7226 -7.6602 -7.6602 -2.9612 -2.9612 -2.8525 -2.8525 -1.1572 -1.1572 -0.9151 -0.9151 -0.8503 -0.8503 -0.7767 -0.7767 3.5052 3.5052 3.7071 3.7071 3.9065 3.9065 4.3379 4.3379 4.9685 4.9685 5.0634 5.0634 5.3590 5.3590 5.4626 5.4626 5.6858 5.6858 6.0183 6.0183 6.1294 6.1294 6.2294 6.2294 6.4939 6.4939 7.2573 7.2573 7.5192 7.5192 7.8774 7.8774 8.0654 8.0654 8.1049 8.1049 8.1650 8.1650 8.2818 8.2818 8.4041 8.4041 9.3089 9.3089 9.5073 9.5073 9.6751 9.6751 11.3252 11.3252 11.3723 11.3723 11.4643 11.4643 12.0317 12.0317 15.1014 15.1014 15.9467 15.9467 k = 0.4848 0.2799-0.0000 ( 4832 PWs) bands (ev): -16.3839 -16.3839 -16.3099 -16.3099 -9.4401 -9.4401 -8.0645 -8.0645 -8.0196 -8.0196 -7.9487 -7.9487 -7.7231 -7.7231 -7.6602 -7.6602 -2.9567 -2.9567 -2.8547 -2.8547 -1.1529 -1.1529 -0.9175 -0.9175 -0.8398 -0.8398 -0.7816 -0.7816 3.5078 3.5078 3.7040 3.7040 3.9031 3.9031 4.3357 4.3357 4.9690 4.9690 5.0643 5.0643 5.3731 5.3731 5.4447 5.4447 5.6848 5.6848 6.0175 6.0175 6.1311 6.1311 6.2287 6.2287 6.4917 6.4917 7.2534 7.2534 7.5189 7.5189 7.8756 7.8756 8.0655 8.0655 8.1052 8.1052 8.1645 8.1645 8.2838 8.2838 8.3992 8.3992 9.3070 9.3070 9.5069 9.5069 9.6749 9.6749 11.3212 11.3212 11.3738 11.3738 11.4662 11.4662 12.0316 12.0316 15.1010 15.1010 15.9608 15.9608 k = 0.5000 0.2887-0.0000 ( 4816 PWs) bands (ev): -16.3836 -16.3836 -16.3102 -16.3102 -9.4405 -9.4405 -8.0645 -8.0645 -8.0198 -8.0198 -7.9487 -7.9487 -7.7233 -7.7233 -7.6603 -7.6603 -2.9552 -2.9552 -2.8555 -2.8555 -1.1514 -1.1514 -0.9184 -0.9184 -0.8357 -0.8357 -0.7837 -0.7837 3.5087 3.5087 3.7030 3.7030 3.9020 3.9020 4.3350 4.3350 4.9692 4.9692 5.0648 5.0648 5.3797 5.3797 5.4368 5.4368 5.6845 5.6845 6.0173 6.0173 6.1316 6.1316 6.2285 6.2285 6.4910 6.4910 7.2521 7.2521 7.5188 7.5188 7.8750 7.8750 8.0656 8.0656 8.1054 8.1054 8.1643 8.1643 8.2845 8.2845 8.3975 8.3975 9.3064 9.3064 9.5068 9.5068 9.6748 9.6748 11.3199 11.3199 11.3743 11.3743 11.4668 11.4668 12.0316 12.0316 15.1009 15.1009 15.9657 15.9657 k = 0.5000 0.2887-0.0000 ( 4816 PWs) bands (ev): -16.3836 -16.3836 -16.3102 -16.3102 -9.4405 -9.4405 -8.0645 -8.0645 -8.0198 -8.0198 -7.9487 -7.9487 -7.7233 -7.7233 -7.6603 -7.6603 -2.9552 -2.9552 -2.8555 -2.8555 -1.1514 -1.1514 -0.9184 -0.9184 -0.8357 -0.8357 -0.7837 -0.7837 3.5087 3.5087 3.7030 3.7030 3.9020 3.9020 4.3350 4.3350 4.9692 4.9692 5.0648 5.0648 5.3797 5.3797 5.4368 5.4368 5.6845 5.6845 6.0173 6.0173 6.1316 6.1316 6.2285 6.2285 6.4910 6.4910 7.2521 7.2521 7.5188 7.5188 7.8750 7.8750 8.0656 8.0656 8.1054 8.1054 8.1643 8.1643 8.2845 8.2845 8.3975 8.3975 9.3064 9.3064 9.5068 9.5068 9.6748 9.6748 11.3199 11.3199 11.3743 11.3743 11.4668 11.4668 12.0316 12.0316 15.1009 15.1009 15.9657 15.9657 k = 0.4912 0.3039-0.0000 ( 4824 PWs) bands (ev): -16.3835 -16.3835 -16.3103 -16.3103 -9.4407 -9.4405 -8.0663 -8.0639 -8.0204 -8.0180 -7.9491 -7.9481 -7.7245 -7.7235 -7.6598 -7.6597 -2.9553 -2.9546 -2.8559 -2.8550 -1.1512 -1.1507 -0.9186 -0.9184 -0.8368 -0.8342 -0.7843 -0.7827 3.5093 3.5094 3.7025 3.7025 3.9018 3.9020 4.3330 4.3333 4.9689 4.9697 5.0640 5.0650 5.3809 5.3812 5.4370 5.4373 5.6856 5.6858 6.0142 6.0160 6.1308 6.1312 6.2294 6.2296 6.4911 6.4915 7.2535 7.2537 7.5154 7.5164 7.8762 7.8764 8.0654 8.0658 8.1052 8.1056 8.1642 8.1643 8.2820 8.2825 8.3973 8.3976 9.3068 9.3069 9.5067 9.5068 9.6738 9.6741 11.3210 11.3210 11.3746 11.3746 11.4668 11.4668 12.0299 12.0300 15.1004 15.1004 15.9674 15.9675 k = 0.4825 0.3191-0.0000 ( 4824 PWs) bands (ev): -16.3832 -16.3832 -16.3105 -16.3105 -9.4412 -9.4409 -8.0692 -8.0648 -8.0198 -8.0153 -7.9492 -7.9471 -7.7269 -7.7250 -7.6584 -7.6582 -2.9550 -2.9536 -2.8562 -2.8544 -1.1501 -1.1492 -0.9191 -0.9185 -0.8375 -0.8320 -0.7845 -0.7813 3.5112 3.5113 3.7010 3.7010 3.9015 3.9018 4.3276 4.3281 4.9688 4.9705 5.0630 5.0649 5.3848 5.3854 5.4379 5.4385 5.6889 5.6893 6.0070 6.0103 6.1289 6.1297 6.2322 6.2327 6.4918 6.4925 7.2578 7.2584 7.5064 7.5085 7.8798 7.8803 8.0653 8.0660 8.1052 8.1059 8.1638 8.1640 8.2750 8.2760 8.3970 8.3976 9.3083 9.3086 9.5065 9.5066 9.6710 9.6716 11.3244 11.3245 11.3756 11.3756 11.4667 11.4668 12.0248 12.0251 15.0988 15.0989 15.9726 15.9727 k = 0.4737 0.3343-0.0000 ( 4820 PWs) bands (ev): -16.3827 -16.3827 -16.3109 -16.3109 -9.4419 -9.4414 -8.0728 -8.0669 -8.0180 -8.0121 -7.9490 -7.9460 -7.7304 -7.7277 -7.6562 -7.6560 -2.9543 -2.9522 -2.8564 -2.8536 -1.1482 -1.1468 -0.9200 -0.9189 -0.8380 -0.8291 -0.7845 -0.7793 3.5143 3.5146 3.6985 3.6985 3.9011 3.9016 4.3187 4.3195 4.9690 4.9715 5.0616 5.0645 5.3912 5.3921 5.4395 5.4404 5.6945 5.6951 5.9960 6.0007 6.1258 6.1269 6.2368 6.2374 6.4930 6.4941 7.2651 7.2659 7.4925 7.4956 7.8855 7.8861 8.0652 8.0663 8.1052 8.1063 8.1632 8.1635 8.2638 8.2652 8.3966 8.3974 9.3108 9.3113 9.5062 9.5063 9.6666 9.6674 11.3301 11.3302 11.3772 11.3772 11.4666 11.4667 12.0165 12.0170 15.0963 15.0964 15.9813 15.9814 k = 0.4649 0.3494-0.0000 ( 4812 PWs) bands (ev): -16.3821 -16.3821 -16.3114 -16.3114 -9.4428 -9.4422 -8.0768 -8.0698 -8.0154 -8.0086 -7.9485 -7.9447 -7.7347 -7.7312 -7.6534 -7.6533 -2.9531 -2.9503 -2.8565 -2.8528 -1.1454 -1.1436 -0.9213 -0.9194 -0.8382 -0.8256 -0.7842 -0.7768 3.5187 3.5190 3.6950 3.6951 3.9007 3.9013 4.3066 4.3077 4.9694 4.9728 5.0598 5.0638 5.3999 5.4012 5.4418 5.4430 5.7022 5.7031 5.9818 5.9876 6.1215 6.1228 6.2427 6.2433 6.4947 6.4960 7.2752 7.2764 7.4744 7.4785 7.8927 7.8934 8.0652 8.0667 8.1054 8.1067 8.1623 8.1626 8.2486 8.2504 8.3962 8.3972 9.3144 9.3150 9.5056 9.5058 9.6606 9.6617 11.3380 11.3380 11.3795 11.3795 11.4665 11.4666 12.0052 12.0058 15.0929 15.0930 15.9932 15.9934 k = 0.4561 0.3646-0.0000 ( 4812 PWs) bands (ev): -16.3813 -16.3813 -16.3120 -16.3120 -9.4439 -9.4432 -8.0810 -8.0733 -8.0122 -8.0049 -7.9479 -7.9434 -7.7395 -7.7353 -7.6503 -7.6502 -2.9515 -2.9480 -2.8565 -2.8520 -1.1418 -1.1396 -0.9230 -0.9201 -0.8384 -0.8213 -0.7837 -0.7737 3.5243 3.5246 3.6908 3.6908 3.9002 3.9009 4.2918 4.2930 4.9700 4.9743 5.0577 5.0627 5.4106 5.4124 5.4449 5.4464 5.7119 5.7129 5.9648 5.9715 6.1161 6.1176 6.2497 6.2503 6.4968 6.4982 7.2878 7.2897 7.4529 7.4583 7.9006 7.9013 8.0652 8.0670 8.1054 8.1070 8.1607 8.1610 8.2301 8.2323 8.3956 8.3968 9.3188 9.3195 9.5049 9.5052 9.6530 9.6545 11.3477 11.3478 11.3826 11.3826 11.4663 11.4665 11.9908 11.9917 15.0888 15.0889 16.0084 16.0086 k = 0.4474 0.3798-0.0000 ( 4820 PWs) bands (ev): -16.3803 -16.3803 -16.3128 -16.3128 -9.4453 -9.4444 -8.0853 -8.0771 -8.0086 -8.0012 -7.9472 -7.9421 -7.7447 -7.7399 -7.6471 -7.6469 -2.9495 -2.9454 -2.8566 -2.8511 -1.1374 -1.1349 -0.9252 -0.9210 -0.8385 -0.8164 -0.7831 -0.7701 3.5309 3.5312 3.6859 3.6859 3.8998 3.9006 4.2743 4.2757 4.9708 4.9760 5.0554 5.0614 5.4228 5.4251 5.4487 5.4507 5.7234 5.7246 5.9455 5.9529 6.1095 6.1111 6.2574 6.2580 6.4991 6.5005 7.3026 7.3055 7.4291 7.4361 7.9086 7.9093 8.0651 8.0673 8.1051 8.1069 8.1578 8.1580 8.2098 8.2120 8.3950 8.3963 9.3240 9.3250 9.5040 9.5044 9.6441 9.6459 11.3588 11.3589 11.3867 11.3868 11.4661 11.4663 11.9738 11.9748 15.0842 15.0843 16.0265 16.0268 k = 0.4386 0.3950-0.0000 ( 4824 PWs) bands (ev): -16.3792 -16.3792 -16.3138 -16.3138 -9.4468 -9.4458 -8.0895 -8.0810 -8.0048 -7.9974 -7.9464 -7.9410 -7.7501 -7.7447 -7.6439 -7.6436 -2.9472 -2.9423 -2.8567 -2.8502 -1.1321 -1.1294 -0.9278 -0.9221 -0.8385 -0.8109 -0.7824 -0.7659 3.5385 3.5388 3.6803 3.6803 3.8994 3.9004 4.2548 4.2561 4.9718 4.9779 5.0529 5.0599 5.4360 5.4389 5.4537 5.4560 5.7364 5.7379 5.9244 5.9323 6.1018 6.1036 6.2658 6.2662 6.5014 6.5026 7.3189 7.3239 7.4036 7.4133 7.9163 7.9169 8.0652 8.0677 8.1041 8.1058 8.1515 8.1515 8.1908 8.1925 8.3943 8.3958 9.3300 9.3313 9.5030 9.5034 9.6341 9.6363 11.3704 11.3704 11.3926 11.3929 11.4659 11.4662 11.9542 11.9555 15.0791 15.0792 16.0475 16.0477 k = 0.4298 0.4102-0.0000 ( 4816 PWs) bands (ev): -16.3779 -16.3779 -16.3148 -16.3148 -9.4484 -9.4473 -8.0935 -8.0847 -8.0008 -7.9937 -7.9458 -7.9402 -7.7555 -7.7496 -7.6408 -7.6403 -2.9446 -2.9388 -2.8569 -2.8495 -1.1262 -1.1232 -0.9310 -0.9236 -0.8386 -0.8050 -0.7816 -0.7613 3.5469 3.5472 3.6744 3.6744 3.8994 3.9005 4.2335 4.2349 4.9730 4.9801 5.0502 5.0584 5.4492 5.4517 5.4615 5.4632 5.7507 5.7525 5.9019 5.9101 6.0930 6.0949 6.2747 6.2751 6.5035 6.5043 7.3337 7.3446 7.3774 7.3936 7.9232 7.9235 8.0653 8.0681 8.1006 8.1014 8.1391 8.1391 8.1783 8.1790 8.3935 8.3951 9.3367 9.3383 9.5018 9.5022 9.6232 9.6258 11.3804 11.3806 11.4021 11.4027 11.4656 11.4660 11.9326 11.9340 15.0738 15.0740 16.0710 16.0712 k = 0.4211 0.4254-0.0000 ( 4808 PWs) bands (ev): -16.3765 -16.3765 -16.3160 -16.3160 -9.4501 -9.4489 -8.0973 -8.0883 -7.9967 -7.9901 -7.9454 -7.9397 -7.7607 -7.7544 -7.6378 -7.6371 -2.9416 -2.9350 -2.8572 -2.8488 -1.1195 -1.1165 -0.9346 -0.9254 -0.8386 -0.7988 -0.7806 -0.7563 3.5560 3.5562 3.6681 3.6682 3.8996 3.9009 4.2108 4.2122 4.9743 4.9826 5.0473 5.0567 5.4602 5.4604 5.4738 5.4748 5.7660 5.7681 5.8783 5.8867 6.0832 6.0853 6.2841 6.2844 6.5051 6.5054 7.3364 7.3510 7.3675 7.3880 7.9287 7.9287 8.0654 8.0684 8.0875 8.0889 8.1258 8.1277 8.1726 8.1726 8.3927 8.3944 9.3439 9.3459 9.5003 9.5009 9.6116 9.6148 11.3878 11.3881 11.4160 11.4168 11.4654 11.4658 11.9090 11.9107 15.0684 15.0686 16.0970 16.0972 k = 0.4123 0.4406-0.0000 ( 4812 PWs) bands (ev): -16.3749 -16.3749 -16.3173 -16.3173 -9.4518 -9.4505 -8.1008 -8.0916 -7.9925 -7.9864 -7.9452 -7.9396 -7.7658 -7.7591 -7.6350 -7.6342 -2.9384 -2.9309 -2.8578 -2.8483 -1.1122 -1.1092 -0.9386 -0.9276 -0.8385 -0.7925 -0.7795 -0.7511 3.5656 3.5657 3.6618 3.6618 3.9004 3.9018 4.1872 4.1885 4.9757 4.9852 5.0444 5.0550 5.4673 5.4688 5.4878 5.4908 5.7818 5.7843 5.8543 5.8626 6.0724 6.0748 6.2939 6.2942 6.5056 6.5058 7.3211 7.3253 7.3923 7.4030 7.9312 7.9318 8.0627 8.0639 8.0657 8.0704 8.1199 8.1232 8.1695 8.1698 8.3917 8.3936 9.3517 9.3541 9.4985 9.4992 9.5996 9.6034 11.3936 11.3940 11.4328 11.4338 11.4654 11.4659 11.8838 11.8857 15.0632 15.0634 16.1251 16.1253 k = 0.4035 0.4558-0.0000 ( 4812 PWs) bands (ev): -16.3733 -16.3733 -16.3187 -16.3187 -9.4536 -9.4522 -8.1040 -8.0947 -7.9883 -7.9829 -7.9453 -7.9399 -7.7706 -7.7635 -7.6325 -7.6315 -2.9350 -2.9265 -2.8586 -2.8480 -1.1044 -1.1015 -0.9432 -0.9303 -0.8384 -0.7867 -0.7778 -0.7458 3.5754 3.5755 3.6554 3.6555 3.9018 3.9034 4.1631 4.1642 4.9771 4.9879 5.0414 5.0533 5.4744 5.4768 5.5031 5.5075 5.7962 5.7996 5.8317 5.8394 6.0607 6.0635 6.3043 6.3046 6.5045 6.5055 7.3004 7.3010 7.4190 7.4267 7.9292 7.9309 8.0357 8.0374 8.0656 8.0697 8.1183 8.1222 8.1676 8.1680 8.3907 8.3927 9.3598 9.3628 9.4964 9.4972 9.5876 9.5920 11.3988 11.3992 11.4503 11.4514 11.4667 11.4673 11.8573 11.8596 15.0581 15.0583 16.1553 16.1554 k = 0.3947 0.4710-0.0000 ( 4802 PWs) bands (ev): -16.3716 -16.3716 -16.3201 -16.3201 -9.4553 -9.4539 -8.1068 -8.0973 -7.9841 -7.9794 -7.9458 -7.9408 -7.7749 -7.7676 -7.6301 -7.6291 -2.9314 -2.9218 -2.8598 -2.8479 -1.0961 -1.0935 -0.9482 -0.9335 -0.8382 -0.7824 -0.7749 -0.7404 3.5850 3.5853 3.6493 3.6494 3.9040 3.9057 4.1390 4.1399 4.9786 4.9908 5.0385 5.0518 5.4818 5.4851 5.5184 5.5243 5.7948 5.8018 5.8250 5.8294 6.0483 6.0514 6.3151 6.3156 6.5020 6.5037 7.2786 7.2797 7.4473 7.4538 7.9190 7.9224 8.0128 8.0133 8.0657 8.0701 8.1182 8.1224 8.1663 8.1668 8.3897 8.3917 9.3683 9.3719 9.4940 9.4947 9.5758 9.5809 11.4036 11.4041 11.4598 11.4606 11.4772 11.4785 11.8299 11.8326 15.0534 15.0536 16.1872 16.1872 k = 0.3860 0.4862-0.0000 ( 4804 PWs) bands (ev): -16.3699 -16.3699 -16.3216 -16.3216 -9.4570 -9.4554 -8.1092 -8.0996 -7.9799 -7.9759 -7.9466 -7.9421 -7.7788 -7.7712 -7.6281 -7.6269 -2.9278 -2.9169 -2.8613 -2.8480 -1.0876 -1.0853 -0.9536 -0.9371 -0.8379 -0.7800 -0.7702 -0.7353 3.5943 3.5948 3.6436 3.6437 3.9072 3.9091 4.1151 4.1158 4.9801 4.9938 5.0354 5.0504 5.4897 5.4939 5.5331 5.5406 5.7732 5.7808 5.8388 5.8428 6.0351 6.0388 6.3264 6.3271 6.4978 6.5003 7.2587 7.2609 7.4770 7.4830 7.8972 7.9023 7.9978 7.9987 8.0659 8.0704 8.1184 8.1230 8.1654 8.1659 8.3886 8.3908 9.3768 9.3812 9.4909 9.4915 9.5647 9.5705 11.4082 11.4087 11.4609 11.4616 11.4970 11.4989 11.8020 11.8051 15.0492 15.0494 16.2206 16.2207 k = 0.3772 0.5014-0.0000 ( 4802 PWs) bands (ev): -16.3683 -16.3683 -16.3230 -16.3230 -9.4585 -9.4569 -8.1112 -8.1015 -7.9757 -7.9726 -7.9478 -7.9439 -7.7822 -7.7744 -7.6264 -7.6251 -2.9243 -2.9118 -2.8634 -2.8484 -1.0788 -1.0772 -0.9593 -0.9411 -0.8376 -0.7786 -0.7652 -0.7306 3.6028 3.6036 3.6383 3.6384 3.9114 3.9135 4.0921 4.0926 4.9814 4.9968 5.0324 5.0491 5.4980 5.5033 5.5468 5.5562 5.7492 5.7562 5.8555 5.8601 6.0212 6.0257 6.3381 6.3391 6.4918 6.4953 7.2417 7.2445 7.5080 7.5137 7.8660 7.8722 7.9908 7.9925 8.0660 8.0707 8.1189 8.1237 8.1645 8.1651 8.3876 8.3898 9.3854 9.3907 9.4871 9.4874 9.5549 9.5613 11.4125 11.4131 11.4606 11.4613 11.5188 11.5213 11.7738 11.7775 15.0454 15.0456 16.2552 16.2555 k = 0.3684 0.5166-0.0000 ( 4794 PWs) bands (ev): -16.3667 -16.3667 -16.3244 -16.3244 -9.4599 -9.4582 -8.1128 -8.1030 -7.9717 -7.9695 -7.9492 -7.9461 -7.7850 -7.7771 -7.6249 -7.6236 -2.9209 -2.9066 -2.8659 -2.8490 -1.0702 -1.0694 -0.9652 -0.9452 -0.8371 -0.7776 -0.7605 -0.7264 3.6104 3.6115 3.6338 3.6339 3.9167 3.9189 4.0705 4.0708 4.9827 4.9999 5.0296 5.0480 5.5066 5.5133 5.5586 5.5707 5.7259 5.7320 5.8721 5.8779 6.0069 6.0125 6.3500 6.3516 6.4841 6.4886 7.2279 7.2312 7.5401 7.5457 7.8298 7.8365 7.9884 7.9903 8.0661 8.0711 8.1194 8.1244 8.1639 8.1644 8.3866 8.3889 9.3936 9.4002 9.4823 9.4828 9.5467 9.5536 11.4164 11.4170 11.4600 11.4608 11.5411 11.5444 11.7456 11.7502 15.0423 15.0425 16.2907 16.2913 k = 0.3596 0.5318-0.0000 ( 4784 PWs) bands (ev): -16.3653 -16.3653 -16.3257 -16.3257 -9.4610 -9.4593 -8.1140 -8.1041 -7.9678 -7.9666 -7.9508 -7.9486 -7.7873 -7.7793 -7.6238 -7.6224 -2.9178 -2.9013 -2.8689 -2.8498 -1.0623 -1.0621 -0.9711 -0.9494 -0.8367 -0.7767 -0.7566 -0.7229 3.6166 3.6179 3.6300 3.6302 3.9228 3.9252 4.0510 4.0512 4.9837 5.0029 5.0268 5.0472 5.5153 5.5240 5.5676 5.5833 5.7048 5.7094 5.8880 5.8956 5.9922 5.9996 6.3616 6.3640 6.4750 6.4807 7.2174 7.2210 7.5731 7.5785 7.7917 7.7988 7.9878 7.9898 8.0662 8.0713 8.1199 8.1250 8.1634 8.1638 8.3857 8.3880 9.4012 9.4093 9.4763 9.4780 9.5405 9.5477 11.4198 11.4205 11.4593 11.4603 11.5635 11.5681 11.7179 11.7239 15.0399 15.0401 16.3261 16.3275 k = 0.3509 0.5470-0.0000 ( 4792 PWs) bands (ev): -16.3641 -16.3641 -16.3267 -16.3267 -9.4618 -9.4601 -8.1148 -8.1049 -7.9641 -7.9641 -7.9524 -7.9513 -7.7889 -7.7808 -7.6230 -7.6216 -2.9153 -2.8961 -2.8723 -2.8505 -1.0564 -1.0550 -0.9764 -0.9530 -0.8362 -0.7760 -0.7537 -0.7202 3.6213 3.6228 3.6272 3.6274 3.9291 3.9317 4.0347 4.0347 4.9845 5.0055 5.0243 5.0466 5.5235 5.5353 5.5720 5.5931 5.6878 5.6903 5.9022 5.9128 5.9772 5.9876 6.3723 6.3758 6.4653 6.4724 7.2102 7.2140 7.6066 7.6117 7.7535 7.7611 7.9878 7.9899 8.0663 8.0715 8.1202 8.1255 8.1630 8.1634 8.3850 8.3873 9.4076 9.4176 9.4699 9.4734 9.5362 9.5435 11.4223 11.4231 11.4587 11.4598 11.5849 11.5921 11.6909 11.6994 15.0381 15.0383 16.3600 16.3691 k = 0.3421 0.5622-0.0000 ( 4796 PWs) bands (ev): -16.3634 -16.3634 -16.3274 -16.3274 -9.4624 -9.4606 -8.1153 -8.1053 -7.9622 -7.9608 -7.9541 -7.9539 -7.7899 -7.7818 -7.6225 -7.6211 -2.9136 -2.8915 -2.8759 -2.8511 -1.0524 -1.0499 -0.9803 -0.9556 -0.8359 -0.7755 -0.7519 -0.7185 3.6241 3.6250 3.6256 3.6262 3.9343 3.9371 4.0233 4.0233 4.9850 5.0075 5.0224 5.0462 5.5303 5.5473 5.5698 5.5984 5.6772 5.6775 5.9129 5.9290 5.9622 5.9782 6.3804 6.3853 6.4569 6.4655 7.2062 7.2100 7.6397 7.6441 7.7172 7.7256 7.9880 7.9900 8.0663 8.0716 8.1204 8.1258 8.1627 8.1631 8.3845 8.3868 9.4119 9.4240 9.4644 9.4699 9.5338 9.5411 11.4240 11.4249 11.4583 11.4595 11.6033 11.6161 11.6649 11.6791 15.0370 15.0372 16.3867 16.3945 k = 0.3333 0.5774-0.0000 ( 4806 PWs) bands (ev): -16.3631 -16.3631 -16.3276 -16.3276 -9.4626 -9.4608 -8.1155 -8.1054 -7.9614 -7.9587 -7.9561 -7.9544 -7.7902 -7.7821 -7.6224 -7.6210 -2.9130 -2.8890 -2.8780 -2.8513 -1.0509 -1.0479 -0.9818 -0.9566 -0.8358 -0.7753 -0.7513 -0.7180 3.6246 3.6247 3.6254 3.6270 3.9364 3.9392 4.0191 4.0191 4.9851 5.0083 5.0216 5.0461 5.5332 5.5591 5.5609 5.5993 5.6732 5.6739 5.9171 5.9405 5.9511 5.9744 6.3836 6.3892 6.4532 6.4626 7.2049 7.2088 7.6626 7.6647 7.6930 7.7038 7.9881 7.9901 8.0663 8.0716 8.1204 8.1258 8.1626 8.1630 8.3843 8.3867 9.4134 9.4265 9.4621 9.4686 9.5330 9.5403 11.4246 11.4255 11.4582 11.4593 11.6118 11.6389 11.6414 11.6699 15.0367 15.0369 16.3973 16.4106 k = 0.3333 0.5774-0.0000 ( 4806 PWs) bands (ev): -16.3631 -16.3631 -16.3276 -16.3276 -9.4626 -9.4608 -8.1155 -8.1054 -7.9614 -7.9587 -7.9561 -7.9544 -7.7902 -7.7821 -7.6224 -7.6210 -2.9130 -2.8890 -2.8780 -2.8513 -1.0509 -1.0479 -0.9818 -0.9566 -0.8358 -0.7753 -0.7513 -0.7180 3.6246 3.6247 3.6254 3.6270 3.9364 3.9392 4.0191 4.0191 4.9851 5.0083 5.0216 5.0461 5.5332 5.5591 5.5609 5.5993 5.6732 5.6739 5.9171 5.9405 5.9511 5.9744 6.3836 6.3892 6.4532 6.4626 7.2049 7.2088 7.6626 7.6647 7.6930 7.7038 7.9881 7.9901 8.0663 8.0716 8.1204 8.1258 8.1626 8.1630 8.3843 8.3867 9.4134 9.4265 9.4621 9.4686 9.5330 9.5403 11.4246 11.4255 11.4582 11.4593 11.6118 11.6389 11.6414 11.6699 15.0367 15.0369 16.3974 16.4399 k = 0.3246 0.5622-0.0000 ( 4794 PWs) bands (ev): -16.3634 -16.3634 -16.3274 -16.3274 -9.4624 -9.4606 -8.1153 -8.1053 -7.9621 -7.9606 -7.9543 -7.9539 -7.7899 -7.7818 -7.6225 -7.6211 -2.9137 -2.8917 -2.8757 -2.8510 -1.0525 -1.0500 -0.9802 -0.9555 -0.8359 -0.7756 -0.7518 -0.7185 3.6241 3.6251 3.6257 3.6262 3.9344 3.9371 4.0233 4.0233 4.9850 5.0076 5.0224 5.0462 5.5293 5.5444 5.5735 5.6004 5.6764 5.6764 5.9131 5.9295 5.9618 5.9779 6.3802 6.3850 6.4573 6.4658 7.2060 7.2099 7.6407 7.6450 7.7163 7.7248 7.9880 7.9900 8.0663 8.0716 8.1204 8.1258 8.1627 8.1631 8.3845 8.3869 9.4120 9.4241 9.4643 9.4699 9.5337 9.5411 11.4240 11.4249 11.4583 11.4594 11.6038 11.6170 11.6641 11.6785 15.0370 15.0372 16.3857 16.4108 k = 0.3158 0.5470-0.0000 ( 4796 PWs) bands (ev): -16.3643 -16.3643 -16.3266 -16.3266 -9.4617 -9.4600 -8.1149 -8.1049 -7.9634 -7.9633 -7.9530 -7.9521 -7.7889 -7.7808 -7.6230 -7.6216 -2.9159 -2.8975 -2.8711 -2.8501 -1.0571 -1.0559 -0.9758 -0.9525 -0.8366 -0.7768 -0.7533 -0.7203 3.6212 3.6227 3.6274 3.6276 3.9296 3.9323 4.0344 4.0345 4.9845 5.0055 5.0241 5.0465 5.5174 5.5254 5.5877 5.6061 5.6824 5.6838 5.9035 5.9146 5.9753 5.9862 6.3710 6.3743 6.4676 6.4745 7.2089 7.2128 7.6113 7.6162 7.7501 7.7578 7.9877 7.9897 8.0663 8.0715 8.1201 8.1254 8.1630 8.1635 8.3852 8.3876 9.4083 9.4186 9.4693 9.4730 9.5359 9.5432 11.4222 11.4230 11.4586 11.4596 11.5880 11.5957 11.6876 11.6966 15.0380 15.0383 16.3542 16.3570 k = 0.3070 0.5318-0.0000 ( 4808 PWs) bands (ev): -16.3658 -16.3657 -16.3252 -16.3252 -9.4607 -9.4590 -8.1142 -8.1044 -7.9658 -7.9650 -7.9521 -7.9502 -7.7872 -7.7792 -7.6237 -7.6223 -2.9197 -2.9047 -2.8661 -2.8484 -1.0647 -1.0646 -0.9695 -0.9478 -0.8379 -0.7796 -0.7551 -0.7231 3.6163 3.6176 3.6307 3.6309 3.9243 3.9269 4.0502 4.0505 4.9835 5.0029 5.0262 5.0468 5.5003 5.5048 5.6027 5.6161 5.6904 5.6931 5.8915 5.8996 5.9881 5.9960 6.3583 6.3603 6.4812 6.4866 7.2132 7.2170 7.5845 7.5894 7.7848 7.7923 7.9871 7.9892 8.0661 8.0712 8.1197 8.1248 8.1635 8.1640 8.3866 8.3889 9.4035 9.4120 9.4749 9.4770 9.5395 9.5467 11.4194 11.4201 11.4587 11.4596 11.5711 11.5764 11.7108 11.7173 15.0397 15.0399 16.3116 16.3128 k = 0.2982 0.5166-0.0000 ( 4804 PWs) bands (ev): -16.3677 -16.3677 -16.3235 -16.3235 -9.4591 -9.4574 -8.1133 -8.1036 -7.9681 -7.9665 -7.9514 -7.9488 -7.7848 -7.7770 -7.6247 -7.6233 -2.9251 -2.9130 -2.8609 -2.8462 -1.0756 -1.0744 -0.9623 -0.9423 -0.8400 -0.7844 -0.7567 -0.7268 3.6095 3.6105 3.6355 3.6357 3.9201 3.9226 4.0690 4.0697 4.9823 4.9999 5.0283 5.0472 5.4807 5.4836 5.6185 5.6289 5.6995 5.7034 5.8786 5.8850 5.9996 6.0058 6.3442 6.3453 6.4962 6.5003 7.2181 7.2219 7.5615 7.5662 7.8194 7.8267 7.9865 7.9885 8.0659 8.0709 8.1192 8.1241 8.1643 8.1648 8.3887 8.3910 9.3983 9.4055 9.4804 9.4813 9.5445 9.5515 11.4155 11.4162 11.4585 11.4594 11.5554 11.5593 11.7335 11.7387 15.0420 15.0422 16.2644 16.2650 k = 0.2895 0.5014-0.0000 ( 4812 PWs) bands (ev): -16.3701 -16.3701 -16.3214 -16.3214 -9.4570 -9.4554 -8.1122 -8.1027 -7.9700 -7.9677 -7.9511 -7.9478 -7.7818 -7.7741 -7.6259 -7.6246 -2.9320 -2.9221 -2.8559 -2.8435 -1.0880 -1.0860 -0.9550 -0.9365 -0.8431 -0.7917 -0.7577 -0.7313 3.6008 3.6015 3.6418 3.6419 3.9177 3.9202 4.0898 4.0910 4.9808 4.9967 5.0303 5.0474 5.4600 5.4624 5.6352 5.6436 5.7092 5.7141 5.8656 5.8708 6.0100 6.0150 6.3298 6.3302 6.5118 6.5148 7.2233 7.2271 7.5431 7.5473 7.8536 7.8608 7.9858 7.9878 8.0657 8.0704 8.1185 8.1231 8.1652 8.1659 8.3918 8.3939 9.3934 9.3995 9.4853 9.4854 9.5508 9.5574 11.4107 11.4113 11.4578 11.4586 11.5415 11.5446 11.7557 11.7600 15.0448 15.0450 16.2145 16.2147 k = 0.2807 0.4862-0.0000 ( 4824 PWs) bands (ev): -16.3729 -16.3729 -16.3190 -16.3190 -9.4544 -9.4528 -8.1108 -8.1017 -7.9716 -7.9688 -7.9511 -7.9473 -7.7782 -7.7708 -7.6273 -7.6260 -2.9401 -2.9320 -2.8511 -2.8406 -1.1017 -1.0990 -0.9481 -0.9311 -0.8473 -0.8012 -0.7582 -0.7361 3.5904 3.5907 3.6495 3.6497 3.9177 3.9202 4.1121 4.1139 4.9789 4.9933 5.0319 5.0475 5.4390 5.4413 5.6526 5.6596 5.7194 5.7252 5.8529 5.8573 6.0190 6.0232 6.3157 6.3158 6.5274 6.5295 7.2283 7.2322 7.5295 7.5331 7.8871 7.8941 7.9850 7.9870 8.0654 8.0699 8.1176 8.1219 8.1664 8.1672 8.3958 8.3978 9.3891 9.3943 9.4891 9.4894 9.5580 9.5642 11.4051 11.4056 11.4565 11.4571 11.5299 11.5324 11.7772 11.7810 15.0482 15.0484 16.1627 16.1628 k = 0.2719 0.4710-0.0000 ( 4820 PWs) bands (ev): -16.3759 -16.3759 -16.3164 -16.3164 -9.4513 -9.4498 -8.1093 -8.1005 -7.9728 -7.9696 -7.9515 -7.9472 -7.7741 -7.7668 -7.6289 -7.6276 -2.9494 -2.9428 -2.8464 -2.8375 -1.1163 -1.1133 -0.9425 -0.9272 -0.8521 -0.8122 -0.7585 -0.7409 3.5783 3.5783 3.6588 3.6589 3.9202 3.9229 4.1353 4.1378 4.9769 4.9899 5.0332 5.0474 5.4182 5.4206 5.6710 5.6768 5.7302 5.7368 5.8407 5.8445 6.0266 6.0302 6.3023 6.3028 6.5427 6.5439 7.2330 7.2369 7.5209 7.5239 7.9196 7.9264 7.9843 7.9863 8.0651 8.0693 8.1168 8.1207 8.1679 8.1687 8.4011 8.4029 9.3857 9.3901 9.4925 9.4931 9.5660 9.5717 11.3988 11.3992 11.4544 11.4550 11.5207 11.5229 11.7981 11.8014 15.0519 15.0521 16.1097 16.1097 k = 0.2632 0.4558-0.0000 ( 4814 PWs) bands (ev): -16.3791 -16.3791 -16.3137 -16.3137 -9.4477 -9.4462 -8.1076 -8.0992 -7.9736 -7.9701 -7.9522 -7.9476 -7.7694 -7.7624 -7.6306 -7.6293 -2.9598 -2.9544 -2.8420 -2.8343 -1.1317 -1.1285 -0.9389 -0.9262 -0.8568 -0.8238 -0.7587 -0.7455 3.5643 3.5645 3.6695 3.6696 3.9255 3.9283 4.1593 4.1625 4.9746 4.9865 5.0341 5.0470 5.3977 5.4004 5.6901 5.6950 5.7416 5.7488 5.8293 5.8327 6.0328 6.0359 6.2902 6.2910 6.5574 6.5578 7.2374 7.2412 7.5171 7.5196 7.9509 7.9574 7.9840 7.9859 8.0647 8.0686 8.1159 8.1195 8.1696 8.1704 8.4077 8.4093 9.3833 9.3872 9.4957 9.4963 9.5746 9.5798 11.3918 11.3921 11.4514 11.4519 11.5143 11.5161 11.8183 11.8212 15.0561 15.0563 16.0560 16.0561 k = 0.2544 0.4406-0.0000 ( 4824 PWs) bands (ev): -16.3826 -16.3826 -16.3108 -16.3108 -9.4435 -9.4421 -8.1057 -8.0978 -7.9740 -7.9704 -7.9531 -7.9483 -7.7642 -7.7577 -7.6324 -7.6311 -2.9713 -2.9668 -2.8379 -2.8312 -1.1478 -1.1445 -0.9387 -0.9298 -0.8599 -0.8346 -0.7590 -0.7497 3.5487 3.5491 3.6817 3.6818 3.9334 3.9364 4.1837 4.1877 4.9721 4.9829 5.0343 5.0461 5.3776 5.3806 5.7099 5.7138 5.7536 5.7615 5.8189 5.8219 6.0376 6.0403 6.2797 6.2807 6.5711 6.5714 7.2418 7.2456 7.5176 7.5195 7.9797 7.9817 7.9868 7.9891 8.0642 8.0679 8.1149 8.1181 8.1716 8.1724 8.4156 8.4171 9.3820 9.3854 9.4986 9.4992 9.5833 9.5880 11.3840 11.3843 11.4475 11.4479 11.5105 11.5122 11.8376 11.8403 15.0605 15.0607 16.0020 16.0021 k = 0.2456 0.4254-0.0000 ( 4820 PWs) bands (ev): -16.3861 -16.3861 -16.3079 -16.3079 -9.4388 -9.4374 -8.1036 -8.0962 -7.9742 -7.9705 -7.9542 -7.9493 -7.7587 -7.7525 -7.6342 -7.6330 -2.9836 -2.9799 -2.8340 -2.8283 -1.1644 -1.1611 -0.9437 -0.9392 -0.8602 -0.8429 -0.7594 -0.7534 3.5316 3.5322 3.6954 3.6954 3.9440 3.9473 4.2083 4.2131 4.9695 4.9793 5.0340 5.0448 5.3579 5.3613 5.7301 5.7328 5.7666 5.7753 5.8098 5.8124 6.0410 6.0433 6.2710 6.2721 6.5834 6.5846 7.2467 7.2503 7.5219 7.5233 7.9832 7.9852 8.0100 8.0159 8.0638 8.0671 8.1140 8.1167 8.1738 8.1746 8.4251 8.4263 9.3820 9.3849 9.5013 9.5019 9.5921 9.5964 11.3756 11.3758 11.4425 11.4429 11.5096 11.5111 11.8562 11.8587 15.0652 15.0654 15.9481 15.9483 k = 0.2368 0.4102-0.0000 ( 4812 PWs) bands (ev): -16.3898 -16.3898 -16.3050 -16.3050 -9.4335 -9.4323 -8.1013 -8.0945 -7.9740 -7.9704 -7.9555 -7.9506 -7.7528 -7.7471 -7.6361 -7.6349 -2.9967 -2.9937 -2.8305 -2.8255 -1.1815 -1.1783 -0.9548 -0.9542 -0.8578 -0.8472 -0.7601 -0.7566 3.5132 3.5139 3.7104 3.7104 3.9573 3.9608 4.2330 4.2385 4.9667 4.9757 5.0330 5.0429 5.3387 5.3424 5.7500 5.7512 5.7807 5.7905 5.8026 5.8046 6.0429 6.0450 6.2641 6.2654 6.5948 6.5966 7.2527 7.2559 7.5291 7.5300 7.9840 7.9860 8.0367 8.0421 8.0634 8.0664 8.1131 8.1154 8.1762 8.1770 8.4361 8.4371 9.3833 9.3858 9.5040 9.5045 9.6009 9.6047 11.3666 11.3668 11.4365 11.4368 11.5116 11.5130 11.8739 11.8762 15.0701 15.0703 15.8947 15.8948 k = 0.2281 0.3950-0.0000 ( 4816 PWs) bands (ev): -16.3936 -16.3936 -16.3020 -16.3020 -9.4278 -9.4266 -8.0988 -8.0926 -7.9736 -7.9704 -7.9567 -7.9520 -7.7467 -7.7414 -7.6380 -7.6367 -3.0106 -3.0081 -2.8273 -2.8229 -1.1989 -1.1959 -0.9737 -0.9720 -0.8537 -0.8478 -0.7611 -0.7595 3.4935 3.4943 3.7267 3.7267 3.9730 3.9769 4.2576 4.2639 4.9638 4.9720 5.0314 5.0405 5.3200 5.3239 5.7670 5.7671 5.7951 5.8001 5.8003 5.8078 6.0434 6.0452 6.2593 6.2606 6.6051 6.6076 7.2600 7.2629 7.5384 7.5390 7.9854 7.9875 8.0603 8.0639 8.0643 8.0681 8.1124 8.1142 8.1790 8.1797 8.4486 8.4493 9.3859 9.3881 9.5066 9.5071 9.6094 9.6128 11.3570 11.3571 11.4295 11.4297 11.5165 11.5177 11.8907 11.8929 15.0751 15.0753 15.8419 15.8421 k = 0.2193 0.3798-0.0000 ( 4820 PWs) bands (ev): -16.3974 -16.3974 -16.2990 -16.2990 -9.4217 -9.4205 -8.0961 -8.0905 -7.9730 -7.9704 -7.9578 -7.9536 -7.7405 -7.7356 -7.6398 -7.6386 -3.0252 -3.0231 -2.8244 -2.8206 -1.2166 -1.2138 -0.9967 -0.9939 -0.8486 -0.8457 -0.7624 -0.7623 3.4726 3.4734 3.7442 3.7443 3.9910 3.9952 4.2820 4.2890 4.9608 4.9682 5.0291 5.0374 5.3016 5.3057 5.7751 5.7754 5.8033 5.8035 5.8163 5.8272 6.0426 6.0441 6.2565 6.2579 6.6143 6.6174 7.2691 7.2716 7.5492 7.5495 7.9878 7.9898 8.0618 8.0642 8.0854 8.0891 8.1121 8.1131 8.1822 8.1827 8.4624 8.4628 9.3898 9.3918 9.5091 9.5095 9.6176 9.6207 11.3468 11.3468 11.4213 11.4215 11.5243 11.5254 11.9067 11.9087 15.0801 15.0803 15.7902 15.7903 k = 0.2105 0.3646-0.0000 ( 4806 PWs) bands (ev): -16.4013 -16.4012 -16.2961 -16.2961 -9.4151 -9.4140 -8.0931 -8.0882 -7.9724 -7.9705 -7.9587 -7.9552 -7.7341 -7.7297 -7.6416 -7.6403 -3.0404 -3.0386 -2.8219 -2.8186 -1.2346 -1.2319 -1.0224 -1.0192 -0.8431 -0.8419 -0.7650 -0.7641 3.4507 3.4515 3.7629 3.7629 4.0112 4.0158 4.3062 4.3138 4.9577 4.9645 5.0262 5.0337 5.2835 5.2878 5.7743 5.7752 5.8159 5.8173 5.8377 5.8489 6.0405 6.0418 6.2558 6.2573 6.6224 6.6259 7.2803 7.2824 7.5609 7.5609 7.9912 7.9932 8.0613 8.0634 8.1059 8.1065 8.1125 8.1154 8.1859 8.1862 8.4775 8.4777 9.3953 9.3970 9.5118 9.5121 9.6255 9.6282 11.3361 11.3361 11.4120 11.4122 11.5350 11.5360 11.9218 11.9236 15.0852 15.0853 15.7397 15.7399 k = 0.2018 0.3494-0.0000 ( 4808 PWs) bands (ev): -16.4051 -16.4051 -16.2932 -16.2932 -9.4081 -9.4071 -8.0900 -8.0858 -7.9716 -7.9710 -7.9592 -7.9568 -7.7277 -7.7238 -7.6432 -7.6419 -3.0561 -3.0546 -2.8197 -2.8169 -1.2526 -1.2501 -1.0502 -1.0470 -0.8374 -0.8373 -0.7677 -0.7661 3.4278 3.4285 3.7826 3.7827 4.0333 4.0382 4.3299 4.3381 4.9545 4.9608 5.0226 5.0295 5.2656 5.2700 5.7717 5.7728 5.8313 5.8336 5.8610 5.8720 6.0372 6.0382 6.2574 6.2588 6.6293 6.6332 7.2935 7.2952 7.5726 7.5727 7.9957 7.9976 8.0607 8.0625 8.1091 8.1115 8.1261 8.1304 8.1903 8.1904 8.4935 8.4936 9.4019 9.4034 9.5144 9.5147 9.6329 9.6354 11.3248 11.3249 11.4017 11.4018 11.5484 11.5494 11.9359 11.9377 15.0901 15.0903 15.6907 15.6909 k = 0.1930 0.3343-0.0000 ( 4808 PWs) bands (ev): -16.4090 -16.4090 -16.2903 -16.2903 -9.4007 -9.3999 -8.0867 -8.0831 -7.9717 -7.9709 -7.9595 -7.9583 -7.7214 -7.7179 -7.6448 -7.6434 -3.0722 -3.0710 -2.8179 -2.8154 -1.2707 -1.2684 -1.0795 -1.0765 -0.8322 -0.8317 -0.7705 -0.7685 3.4041 3.4048 3.8033 3.8034 4.0572 4.0624 4.3532 4.3619 4.9513 4.9570 5.0184 5.0246 5.2479 5.2523 5.7694 5.7704 5.8477 5.8506 5.8852 5.8959 6.0328 6.0335 6.2613 6.2627 6.6352 6.6394 7.3088 7.3102 7.5842 7.5845 8.0016 8.0034 8.0601 8.0615 8.1096 8.1114 8.1430 8.1459 8.1955 8.1961 8.5102 8.5105 9.4099 9.4112 9.5170 9.5172 9.6399 9.6421 11.3132 11.3132 11.3903 11.3904 11.5645 11.5654 11.9492 11.9508 15.0950 15.0952 15.6434 15.6436 k = 0.1842 0.3191-0.0000 ( 4818 PWs) bands (ev): -16.4128 -16.4128 -16.2876 -16.2876 -9.3931 -9.3923 -8.0833 -8.0803 -7.9725 -7.9703 -7.9596 -7.9594 -7.7151 -7.7121 -7.6461 -7.6448 -3.0887 -3.0877 -2.8164 -2.8142 -1.2887 -1.2866 -1.1099 -1.1073 -0.8269 -0.8261 -0.7735 -0.7713 3.3797 3.3804 3.8248 3.8249 4.0826 4.0880 4.3760 4.3851 4.9481 4.9532 5.0135 5.0193 5.2303 5.2347 5.7679 5.7689 5.8647 5.8683 5.9094 5.9198 6.0277 6.0280 6.2676 6.2688 6.6400 6.6444 7.3260 7.3271 7.5952 7.5957 8.0087 8.0103 8.0594 8.0606 8.1103 8.1117 8.1572 8.1589 8.2022 8.2036 8.5274 8.5278 9.4192 9.4204 9.5197 9.5199 9.6462 9.6482 11.3011 11.3012 11.3780 11.3780 11.5831 11.5840 11.9615 11.9631 15.0997 15.0999 15.5980 15.5981 k = 0.1754 0.3039-0.0000 ( 4817 PWs) bands (ev): -16.4166 -16.4166 -16.2849 -16.2849 -9.3852 -9.3845 -8.0797 -8.0773 -7.9735 -7.9698 -7.9607 -7.9592 -7.7089 -7.7064 -7.6474 -7.6460 -3.1054 -3.1046 -2.8152 -2.8133 -1.3066 -1.3047 -1.1412 -1.1388 -0.8218 -0.8207 -0.7766 -0.7743 3.3549 3.3555 3.8471 3.8472 4.1093 4.1149 4.3981 4.4075 4.9448 4.9495 5.0082 5.0134 5.2128 5.2170 5.7673 5.7682 5.8822 5.8864 5.9330 5.9429 6.0220 6.0223 6.2764 6.2775 6.6439 6.6485 7.3449 7.3457 7.6056 7.6061 8.0170 8.0185 8.0588 8.0597 8.1117 8.1128 8.1684 8.1689 8.2111 8.2132 8.5448 8.5454 9.4297 9.4307 9.5224 9.5225 9.6521 9.6539 11.2888 11.2889 11.3648 11.3648 11.6040 11.6049 11.9730 11.9745 15.1042 15.1044 15.5546 15.5547 k = 0.1667 0.2887-0.0000 ( 4809 PWs) bands (ev): -16.4203 -16.4203 -16.2822 -16.2822 -9.3771 -9.3765 -8.0760 -8.0742 -7.9744 -7.9695 -7.9615 -7.9589 -7.7029 -7.7009 -7.6484 -7.6470 -3.1223 -3.1216 -2.8143 -2.8127 -1.3243 -1.3227 -1.1728 -1.1708 -0.8168 -0.8157 -0.7798 -0.7776 3.3298 3.3303 3.8699 3.8700 4.1371 4.1428 4.4197 4.4292 4.9415 4.9458 5.0025 5.0072 5.1951 5.1992 5.7677 5.7684 5.9001 5.9050 5.9545 5.9634 6.0166 6.0181 6.2878 6.2888 6.6470 6.6516 7.3652 7.3657 7.6151 7.6157 8.0262 8.0275 8.0583 8.0589 8.1141 8.1150 8.1765 8.1767 8.2221 8.2246 8.5622 8.5629 9.4413 9.4423 9.5253 9.5253 9.6575 9.6591 11.2763 11.2764 11.3508 11.3508 11.6272 11.6281 11.9836 11.9850 15.1085 15.1087 15.5133 15.5134 k = 0.1579 0.2735-0.0000 ( 4813 PWs) bands (ev): -16.4240 -16.4240 -16.2797 -16.2797 -9.3689 -9.3684 -8.0722 -8.0709 -7.9752 -7.9695 -7.9619 -7.9585 -7.6972 -7.6955 -7.6493 -7.6478 -3.1392 -3.1387 -2.8137 -2.8124 -1.3418 -1.3403 -1.2045 -1.2027 -0.8122 -0.8111 -0.7830 -0.7808 3.3046 3.3051 3.8932 3.8933 4.1657 4.1714 4.4406 4.4502 4.9383 4.9421 4.9964 5.0006 5.1773 5.1812 5.7688 5.7695 5.9181 5.9236 5.9707 5.9767 6.0149 6.0193 6.3018 6.3028 6.6493 6.6539 7.3863 7.3866 7.6237 7.6244 8.0357 8.0366 8.0578 8.0581 8.1179 8.1188 8.1823 8.1830 8.2345 8.2372 8.5794 8.5801 9.4538 9.4547 9.5282 9.5282 9.6623 9.6637 11.2637 11.2638 11.3361 11.3361 11.6523 11.6531 11.9933 11.9946 15.1125 15.1127 15.4743 15.4744 k = 0.1491 0.2583-0.0000 ( 4809 PWs) bands (ev): -16.4276 -16.4276 -16.2773 -16.2773 -9.3606 -9.3601 -8.0684 -8.0676 -7.9758 -7.9696 -7.9620 -7.9582 -7.6917 -7.6905 -7.6500 -7.6485 -3.1562 -3.1557 -2.8134 -2.8122 -1.3590 -1.3578 -1.2359 -1.2344 -0.8083 -0.8073 -0.7858 -0.7838 3.2795 3.2798 3.9168 3.9169 4.1949 4.2007 4.4608 4.4703 4.9351 4.9385 4.9900 4.9938 5.1594 5.1630 5.7707 5.7713 5.9357 5.9417 5.9766 5.9789 6.0222 6.0302 6.3185 6.3194 6.6510 6.6554 7.4078 7.4080 7.6317 7.6324 8.0448 8.0452 8.0575 8.0576 8.1239 8.1247 8.1873 8.1882 8.2476 8.2503 8.5961 8.5968 9.4671 9.4679 9.5314 9.5314 9.6665 9.6678 11.2510 11.2511 11.3209 11.3210 11.6791 11.6799 12.0022 12.0034 15.1163 15.1164 15.4376 15.4377 k = 0.1404 0.2431-0.0000 ( 4817 PWs) bands (ev): -16.4310 -16.4310 -16.2750 -16.2750 -9.3524 -9.3519 -8.0647 -8.0643 -7.9762 -7.9698 -7.9619 -7.9579 -7.6865 -7.6856 -7.6506 -7.6490 -3.1729 -3.1726 -2.8133 -2.8123 -1.3760 -1.3749 -1.2667 -1.2654 -0.8057 -0.8050 -0.7874 -0.7859 3.2546 3.2549 3.9405 3.9406 4.2246 4.2303 4.4802 4.4895 4.9319 4.9350 4.9834 4.9868 5.1411 5.1446 5.7733 5.7738 5.9501 5.9554 5.9770 5.9773 6.0369 6.0463 6.3377 6.3386 6.6522 6.6565 7.4292 7.4292 7.6392 7.6399 8.0516 8.0523 8.0573 8.0583 8.1323 8.1331 8.1920 8.1931 8.2610 8.2636 8.6122 8.6129 9.4808 9.4815 9.5349 9.5349 9.6702 9.6713 11.2383 11.2384 11.3054 11.3054 11.7072 11.7080 12.0103 12.0114 15.1197 15.1199 15.4032 15.4033 k = 0.1316 0.2279-0.0000 ( 4823 PWs) bands (ev): -16.4343 -16.4343 -16.2728 -16.2728 -9.3441 -9.3438 -8.0611 -8.0610 -7.9763 -7.9699 -7.9616 -7.9576 -7.6816 -7.6811 -7.6509 -7.6494 -3.1894 -3.1892 -2.8134 -2.8126 -1.3927 -1.3917 -1.2965 -1.2955 -0.8052 -0.8050 -0.7872 -0.7863 3.2301 3.2303 3.9642 3.9643 4.2545 4.2600 4.4989 4.5079 4.9288 4.9315 4.9768 4.9798 5.1226 5.1258 5.7764 5.7769 5.9524 5.9546 5.9844 5.9884 6.0533 6.0629 6.3592 6.3601 6.6529 6.6570 7.4497 7.4497 7.6466 7.6473 8.0539 8.0551 8.0601 8.0614 8.1431 8.1438 8.1970 8.1983 8.2743 8.2769 8.6275 8.6281 9.4943 9.4950 9.5392 9.5392 9.6733 9.6743 11.2257 11.2258 11.2896 11.2896 11.7364 11.7372 12.0176 12.0186 15.1228 15.1230 15.3713 15.3714 k = 0.1228 0.2127-0.0000 ( 4815 PWs) bands (ev): -16.4375 -16.4375 -16.2707 -16.2707 -9.3361 -9.3357 -8.0578 -8.0575 -7.9761 -7.9700 -7.9613 -7.9574 -7.6770 -7.6769 -7.6512 -7.6496 -3.2056 -3.2054 -2.8137 -2.8131 -1.4091 -1.4083 -1.3250 -1.3242 -0.8072 -0.8069 -0.7851 -0.7847 3.2063 3.2065 3.9877 3.9878 4.2845 4.2898 4.5169 4.5255 4.9257 4.9281 4.9703 4.9729 5.1038 5.1067 5.7799 5.7804 5.9445 5.9456 6.0004 6.0059 6.0691 6.0785 6.3826 6.3836 6.6534 6.6573 7.4686 7.4686 7.6545 7.6551 8.0542 8.0549 8.0643 8.0651 8.1554 8.1560 8.2032 8.2048 8.2877 8.2902 8.6419 8.6424 9.5069 9.5075 9.5450 9.5451 9.6759 9.6768 11.2134 11.2135 11.2738 11.2739 11.7665 11.7672 12.0242 12.0252 15.1256 15.1257 15.3418 15.3419 k = 0.1140 0.1975-0.0000 ( 4811 PWs) bands (ev): -16.4406 -16.4406 -16.2687 -16.2687 -9.3282 -9.3279 -8.0546 -8.0542 -7.9757 -7.9700 -7.9609 -7.9573 -7.6730 -7.6729 -7.6512 -7.6496 -3.2212 -3.2211 -2.8141 -2.8136 -1.4255 -1.4248 -1.3517 -1.3511 -0.8105 -0.8101 -0.7821 -0.7820 3.1832 3.1834 4.0108 4.0109 4.3143 4.3193 4.5340 4.5421 4.9227 4.9248 4.9638 4.9661 5.0846 5.0872 5.7838 5.7842 5.9338 5.9345 6.0183 6.0243 6.0837 6.0928 6.4075 6.4085 6.6536 6.6573 7.4853 7.4855 7.6632 7.6637 8.0540 8.0545 8.0674 8.0679 8.1673 8.1676 8.2119 8.2137 8.3008 8.3033 8.6553 8.6557 9.5173 9.5177 9.5532 9.5533 9.6780 9.6788 11.2013 11.2014 11.2582 11.2583 11.7969 11.7976 12.0301 12.0310 15.1280 15.1281 15.3147 15.3148 k = 0.1053 0.1823-0.0000 ( 4819 PWs) bands (ev): -16.4434 -16.4434 -16.2669 -16.2669 -9.3205 -9.3203 -8.0516 -8.0511 -7.9750 -7.9698 -7.9605 -7.9572 -7.6695 -7.6691 -7.6512 -7.6496 -3.2363 -3.2362 -2.8147 -2.8143 -1.4418 -1.4413 -1.3764 -1.3759 -0.8144 -0.8139 -0.7789 -0.7789 3.1612 3.1613 4.0334 4.0335 4.3438 4.3485 4.5505 4.5580 4.9198 4.9215 4.9576 4.9595 5.0651 5.0674 5.7879 5.7882 5.9221 5.9227 6.0364 6.0424 6.0970 6.1055 6.4333 6.4344 6.6538 6.6572 7.4993 7.4995 7.6731 7.6735 8.0537 8.0540 8.0695 8.0698 8.1768 8.1770 8.2241 8.2261 8.3139 8.3162 8.6676 8.6680 9.5248 9.5251 9.5643 9.5645 9.6797 9.6804 11.1895 11.1896 11.2429 11.2430 11.8273 11.8280 12.0353 12.0361 15.1300 15.1301 15.2901 15.2901 k = 0.0965 0.1671-0.0000 ( 4819 PWs) bands (ev): -16.4461 -16.4461 -16.2652 -16.2652 -9.3133 -9.3131 -8.0488 -8.0482 -7.9741 -7.9695 -7.9599 -7.9570 -7.6663 -7.6657 -7.6509 -7.6494 -3.2507 -3.2506 -2.8154 -2.8151 -1.4584 -1.4580 -1.3984 -1.3980 -0.8184 -0.8180 -0.7757 -0.7756 3.1403 3.1404 4.0551 4.0552 4.3727 4.3770 4.5662 4.5730 4.9169 4.9183 4.9516 4.9533 5.0453 5.0473 5.7920 5.7923 5.9102 5.9107 6.0540 6.0600 6.1089 6.1168 6.4594 6.4606 6.6540 6.6571 7.5103 7.5106 7.6844 7.6847 8.0533 8.0536 8.0709 8.0711 8.1835 8.1836 8.2397 8.2417 8.3268 8.3291 8.6789 8.6791 9.5299 9.5301 9.5776 9.5779 9.6809 9.6816 11.1781 11.1782 11.2281 11.2282 11.8574 11.8580 12.0399 12.0407 15.1315 15.1316 15.2679 15.2679 k = 0.0877 0.1519-0.0000 ( 4815 PWs) bands (ev): -16.4486 -16.4486 -16.2636 -16.2636 -9.3064 -9.3062 -8.0462 -8.0456 -7.9730 -7.9692 -7.9593 -7.9569 -7.6635 -7.6628 -7.6506 -7.6492 -3.2642 -3.2641 -2.8161 -2.8159 -1.4752 -1.4750 -1.4176 -1.4174 -0.8223 -0.8220 -0.7726 -0.7726 3.1206 3.1207 4.0759 4.0760 4.4009 4.4048 4.5813 4.5874 4.9141 4.9152 4.9461 4.9474 5.0252 5.0269 5.7961 5.7963 5.8984 5.8987 6.0710 6.0768 6.1196 6.1268 6.4852 6.4865 6.6543 6.6571 7.5184 7.5186 7.6969 7.6971 8.0530 8.0532 8.0719 8.0720 8.1881 8.1881 8.2572 8.2592 8.3397 8.3418 8.6890 8.6892 9.5336 9.5337 9.5920 9.5923 9.6818 9.6824 11.1672 11.1673 11.2141 11.2142 11.8866 11.8872 12.0440 12.0447 15.1326 15.1327 15.2482 15.2482 k = 0.0789 0.1367-0.0000 ( 4819 PWs) bands (ev): -16.4509 -16.4509 -16.2622 -16.2622 -9.2999 -9.2998 -8.0438 -8.0433 -7.9719 -7.9688 -7.9587 -7.9567 -7.6610 -7.6603 -7.6501 -7.6488 -3.2768 -3.2768 -2.8169 -2.8167 -1.4920 -1.4919 -1.4340 -1.4339 -0.8262 -0.8259 -0.7697 -0.7697 3.1024 3.1025 4.0955 4.0956 4.4281 4.4315 4.5957 4.6010 4.9114 4.9122 4.9410 4.9420 5.0049 5.0063 5.8000 5.8002 5.8869 5.8872 6.0871 6.0924 6.1291 6.1355 6.5101 6.5114 6.6549 6.6574 7.5237 7.5239 7.7102 7.7104 8.0528 8.0529 8.0725 8.0726 8.1913 8.1913 8.2752 8.2770 8.3526 8.3545 8.6980 8.6981 9.5363 9.5364 9.6065 9.6068 9.6824 9.6829 11.1569 11.1570 11.2010 11.2011 11.9146 11.9152 12.0476 12.0482 15.1331 15.1332 15.2308 15.2308 k = 0.0702 0.1215-0.0000 ( 4817 PWs) bands (ev): -16.4530 -16.4530 -16.2609 -16.2609 -9.2940 -9.2939 -8.0417 -8.0413 -7.9707 -7.9684 -7.9579 -7.9564 -7.6590 -7.6583 -7.6494 -7.6484 -3.2884 -3.2884 -2.8177 -2.8176 -1.5085 -1.5084 -1.4479 -1.4478 -0.8298 -0.8296 -0.7671 -0.7671 3.0858 3.0858 4.1137 4.1138 4.4539 4.4568 4.6097 4.6142 4.9088 4.9093 4.9365 4.9372 4.9845 4.9856 5.8036 5.8038 5.8760 5.8762 6.1019 6.1068 6.1375 6.1432 6.5334 6.5347 6.6559 6.6580 7.5269 7.5271 7.7237 7.7238 8.0525 8.0526 8.0730 8.0730 8.1938 8.1938 8.2925 8.2940 8.3655 8.3671 8.7059 8.7059 9.5385 9.5386 9.6206 9.6209 9.6828 9.6832 11.1473 11.1473 11.1890 11.1890 11.9409 11.9414 12.0508 12.0514 15.1331 15.1331 15.2160 15.2160 k = 0.0614 0.1064-0.0000 ( 4817 PWs) bands (ev): -16.4548 -16.4548 -16.2598 -16.2598 -9.2886 -9.2886 -8.0398 -8.0395 -7.9696 -7.9680 -7.9571 -7.9560 -7.6573 -7.6568 -7.6487 -7.6479 -3.2989 -3.2989 -2.8184 -2.8184 -1.5240 -1.5239 -1.4594 -1.4594 -0.8332 -0.8331 -0.7647 -0.7647 3.0708 3.0709 4.1304 4.1304 4.4781 4.4804 4.6234 4.6269 4.9062 4.9065 4.9325 4.9330 4.9641 4.9650 5.8068 5.8070 5.8660 5.8662 6.1155 6.1198 6.1450 6.1498 6.5546 6.5557 6.6575 6.6593 7.5284 7.5286 7.7369 7.7370 8.0523 8.0524 8.0733 8.0733 8.1957 8.1957 8.3083 8.3095 8.3783 8.3796 8.7127 8.7127 9.5403 9.5404 9.6339 9.6341 9.6829 9.6832 11.1383 11.1384 11.1782 11.1783 11.9651 11.9655 12.0538 12.0543 15.1324 15.1325 15.2035 15.2036 k = 0.0526 0.0912-0.0000 ( 4827 PWs) bands (ev): -16.4565 -16.4565 -16.2588 -16.2588 -9.2839 -9.2839 -8.0382 -8.0380 -7.9687 -7.9676 -7.9563 -7.9556 -7.6560 -7.6556 -7.6478 -7.6473 -3.3082 -3.3082 -2.8191 -2.8191 -1.5382 -1.5381 -1.4690 -1.4690 -0.8362 -0.8362 -0.7626 -0.7626 3.0576 3.0577 4.1452 4.1453 4.5001 4.5019 4.6368 4.6395 4.9037 4.9037 4.9290 4.9293 4.9442 4.9448 5.8094 5.8095 5.8572 5.8573 6.1276 6.1311 6.1516 6.1554 6.5729 6.5739 6.6599 6.6613 7.5287 7.5288 7.7493 7.7493 8.0521 8.0521 8.0734 8.0734 8.1972 8.1972 8.3221 8.3229 8.3908 8.3917 8.7185 8.7185 9.5418 9.5418 9.6460 9.6462 9.6829 9.6832 11.1302 11.1302 11.1688 11.1688 11.9866 11.9870 12.0566 12.0570 15.1312 15.1312 15.1935 15.1936 k = 0.0439 0.0760-0.0000 ( 4821 PWs) bands (ev): -16.4579 -16.4579 -16.2580 -16.2580 -9.2798 -9.2798 -8.0368 -8.0367 -7.9680 -7.9673 -7.9554 -7.9550 -7.6550 -7.6547 -7.6470 -7.6466 -3.3162 -3.3162 -2.8198 -2.8198 -1.5506 -1.5506 -1.4769 -1.4769 -0.8389 -0.8388 -0.7609 -0.7608 3.0463 3.0463 4.1581 4.1582 4.5196 4.5208 4.6501 4.6520 4.9008 4.9011 4.9250 4.9250 4.9264 4.9268 5.8112 5.8112 5.8499 5.8500 6.1380 6.1407 6.1573 6.1602 6.5879 6.5886 6.6633 6.6643 7.5283 7.5284 7.7603 7.7604 8.0519 8.0520 8.0736 8.0736 8.1984 8.1984 8.3336 8.3342 8.4027 8.4033 8.7232 8.7233 9.5430 9.5430 9.6566 9.6569 9.6828 9.6831 11.1230 11.1230 11.1607 11.1608 12.0050 12.0052 12.0596 12.0599 15.1294 15.1294 15.1858 15.1859 k = 0.0351 0.0608-0.0000 ( 4835 PWs) bands (ev): -16.4590 -16.4590 -16.2573 -16.2573 -9.2764 -9.2764 -8.0358 -8.0357 -7.9674 -7.9671 -7.9547 -7.9545 -7.6543 -7.6541 -7.6462 -7.6461 -3.3229 -3.3229 -2.8203 -2.8203 -1.5611 -1.5611 -1.4833 -1.4833 -0.8411 -0.8411 -0.7594 -0.7594 3.0370 3.0370 4.1689 4.1689 4.5359 4.5366 4.6632 4.6643 4.8964 4.8970 4.9088 4.9090 4.9239 4.9240 5.8120 5.8121 5.8443 5.8444 6.1466 6.1484 6.1623 6.1641 6.5993 6.5997 6.6675 6.6681 7.5275 7.5276 7.7698 7.7698 8.0518 8.0518 8.0736 8.0736 8.1994 8.1994 8.3428 8.3431 8.4133 8.4137 8.7271 8.7271 9.5440 9.5440 9.6656 9.6658 9.6828 9.6829 11.1169 11.1169 11.1541 11.1541 12.0196 12.0197 12.0628 12.0630 15.1272 15.1272 15.1802 15.1802 k = 0.0263 0.0456-0.0000 ( 4843 PWs) bands (ev): -16.4599 -16.4599 -16.2568 -16.2568 -9.2737 -9.2737 -8.0349 -8.0349 -7.9670 -7.9669 -7.9540 -7.9540 -7.6538 -7.6537 -7.6456 -7.6455 -3.3281 -3.3281 -2.8208 -2.8208 -1.5694 -1.5694 -1.4881 -1.4881 -0.8429 -0.8429 -0.7582 -0.7582 3.0296 3.0296 4.1775 4.1775 4.5488 4.5492 4.6755 4.6760 4.8857 4.8861 4.9012 4.9014 4.9221 4.9222 5.8120 5.8120 5.8406 5.8406 6.1532 6.1541 6.1664 6.1673 6.6071 6.6073 6.6721 6.6723 7.5266 7.5267 7.7774 7.7774 8.0516 8.0516 8.0736 8.0736 8.2001 8.2001 8.3499 8.3500 8.4223 8.4224 8.7300 8.7300 9.5447 9.5447 9.6726 9.6727 9.6829 9.6830 11.1120 11.1120 11.1490 11.1490 12.0301 12.0302 12.0664 12.0665 15.1251 15.1251 15.1763 15.1763 k = 0.0175 0.0304-0.0000 ( 4851 PWs) bands (ev): -16.4605 -16.4605 -16.2564 -16.2564 -9.2718 -9.2718 -8.0343 -8.0343 -7.9668 -7.9667 -7.9536 -7.9535 -7.6534 -7.6534 -7.6452 -7.6451 -3.3319 -3.3319 -2.8211 -2.8211 -1.5754 -1.5754 -1.4915 -1.4915 -0.8442 -0.8442 -0.7574 -0.7574 3.0243 3.0243 4.1837 4.1837 4.5581 4.5582 4.6861 4.6863 4.8731 4.8732 4.8989 4.8990 4.9209 4.9209 5.8114 5.8114 5.8385 5.8385 6.1578 6.1582 6.1694 6.1698 6.6121 6.6122 6.6762 6.6762 7.5259 7.5259 7.7829 7.7829 8.0515 8.0515 8.0736 8.0736 8.2006 8.2006 8.3547 8.3548 8.4290 8.4290 8.7320 8.7320 9.5452 9.5452 9.6771 9.6772 9.6835 9.6836 11.1084 11.1084 11.1453 11.1453 12.0368 12.0368 12.0700 12.0701 15.1234 15.1234 15.1737 15.1737 k = 0.0088 0.0152-0.0000 ( 4859 PWs) bands (ev): -16.4609 -16.4609 -16.2562 -16.2562 -9.2707 -9.2707 -8.0340 -8.0340 -7.9667 -7.9667 -7.9533 -7.9533 -7.6533 -7.6533 -7.6449 -7.6449 -3.3342 -3.3342 -2.8213 -2.8213 -1.5791 -1.5791 -1.4936 -1.4936 -0.8449 -0.8449 -0.7569 -0.7569 3.0211 3.0211 4.1874 4.1874 4.5636 4.5636 4.6936 4.6936 4.8641 4.8641 4.8979 4.8979 4.9201 4.9201 5.8107 5.8107 5.8374 5.8374 6.1604 6.1605 6.1713 6.1714 6.6148 6.6148 6.6789 6.6790 7.5253 7.5253 7.7863 7.7863 8.0514 8.0515 8.0736 8.0736 8.2009 8.2009 8.3576 8.3576 8.4332 8.4332 8.7332 8.7332 9.5456 9.5456 9.6791 9.6791 9.6846 9.6846 11.1062 11.1062 11.1431 11.1431 12.0403 12.0403 12.0728 12.0728 15.1222 15.1222 15.1723 15.1723 k = 0.0000 0.0000 0.0000 ( 4861 PWs) bands (ev): -16.4611 -16.4611 -16.2561 -16.2561 -9.2703 -9.2703 -8.0339 -8.0339 -7.9666 -7.9666 -7.9532 -7.9532 -7.6532 -7.6532 -7.6448 -7.6448 -3.3349 -3.3349 -2.8214 -2.8214 -1.5803 -1.5803 -1.4943 -1.4943 -0.8452 -0.8452 -0.7568 -0.7568 3.0201 3.0201 4.1887 4.1887 4.5654 4.5654 4.6963 4.6963 4.8608 4.8608 4.8976 4.8976 4.9199 4.9199 5.8104 5.8104 5.8371 5.8371 6.1613 6.1613 6.1719 6.1719 6.6156 6.6156 6.6799 6.6799 7.5251 7.5251 7.7874 7.7874 8.0514 8.0514 8.0736 8.0736 8.2010 8.2010 8.3586 8.3586 8.4346 8.4346 8.7336 8.7336 9.5457 9.5457 9.6796 9.6796 9.6852 9.6852 11.1054 11.1054 11.1424 11.1424 12.0413 12.0413 12.0738 12.0738 15.1218 15.1218 15.1719 15.1719 k = 0.0000 0.0000 0.0000 ( 4861 PWs) bands (ev): -16.4611 -16.4611 -16.2561 -16.2561 -9.2703 -9.2703 -8.0339 -8.0339 -7.9666 -7.9666 -7.9532 -7.9532 -7.6532 -7.6532 -7.6448 -7.6448 -3.3349 -3.3349 -2.8214 -2.8214 -1.5803 -1.5803 -1.4943 -1.4943 -0.8452 -0.8452 -0.7568 -0.7568 3.0201 3.0201 4.1887 4.1887 4.5654 4.5654 4.6963 4.6963 4.8608 4.8608 4.8976 4.8976 4.9199 4.9199 5.8104 5.8104 5.8371 5.8371 6.1613 6.1613 6.1719 6.1719 6.6156 6.6156 6.6799 6.6799 7.5251 7.5251 7.7874 7.7874 8.0514 8.0514 8.0736 8.0736 8.2010 8.2010 8.3586 8.3586 8.4346 8.4346 8.7336 8.7336 9.5457 9.5457 9.6796 9.6796 9.6852 9.6852 11.1054 11.1054 11.1424 11.1424 12.0413 12.0413 12.0738 12.0738 15.1218 15.1218 15.1719 15.1719 k = 0.0000 0.0000 0.0175 ( 4861 PWs) bands (ev): -16.4609 -16.4609 -16.2562 -16.2562 -9.2698 -9.2698 -8.0348 -8.0348 -7.9666 -7.9666 -7.9531 -7.9531 -7.6532 -7.6532 -7.6448 -7.6448 -3.3347 -3.3347 -2.8218 -2.8218 -1.5801 -1.5801 -1.4938 -1.4938 -0.8459 -0.8459 -0.7575 -0.7575 3.0218 3.0218 4.1885 4.1885 4.5654 4.5654 4.6963 4.6965 4.8619 4.8619 4.8979 4.8979 4.9200 4.9200 5.8035 5.8035 5.8293 5.8309 6.1693 6.1711 6.1806 6.1806 6.6125 6.6125 6.6769 6.6770 7.5231 7.5231 7.7879 7.7879 8.0539 8.0540 8.0758 8.0758 8.2013 8.2013 8.3586 8.3586 8.4346 8.4346 8.7331 8.7331 9.5451 9.5451 9.6792 9.6792 9.6848 9.6849 11.1067 11.1069 11.1436 11.1436 12.0402 12.0402 12.0725 12.0728 15.1168 15.1168 15.1656 15.1676 k = 0.0000 0.0000 0.0349 ( 4861 PWs) bands (ev): -16.4605 -16.4605 -16.2564 -16.2564 -9.2685 -9.2685 -8.0376 -8.0376 -7.9663 -7.9663 -7.9529 -7.9529 -7.6530 -7.6530 -7.6446 -7.6446 -3.3339 -3.3339 -2.8231 -2.8231 -1.5796 -1.5796 -1.4922 -1.4922 -0.8479 -0.8478 -0.7595 -0.7595 3.0269 3.0269 4.1882 4.1882 4.5655 4.5655 4.6967 4.6970 4.8652 4.8652 4.8988 4.8989 4.9204 4.9204 5.7845 5.7845 5.8096 5.8125 6.1932 6.1965 6.2046 6.2046 6.6034 6.6034 6.6678 6.6680 7.5171 7.5171 7.7892 7.7892 8.0613 8.0615 8.0823 8.0823 8.2023 8.2023 8.3585 8.3585 8.4348 8.4348 8.7315 8.7315 9.5435 9.5435 9.6779 9.6779 9.6835 9.6836 11.1105 11.1109 11.1472 11.1472 12.0368 12.0368 12.0689 12.0694 15.1023 15.1023 15.1491 15.1529 k = 0.0000 0.0000 0.0524 ( 4855 PWs) bands (ev): -16.4599 -16.4599 -16.2568 -16.2568 -9.2663 -9.2663 -8.0423 -8.0423 -7.9660 -7.9660 -7.9527 -7.9527 -7.6528 -7.6528 -7.6445 -7.6445 -3.3327 -3.3327 -2.8251 -2.8251 -1.5787 -1.5787 -1.4896 -1.4896 -0.8511 -0.8511 -0.7630 -0.7630 3.0354 3.0354 4.1876 4.1876 4.5658 4.5658 4.6973 4.6979 4.8705 4.8705 4.9003 4.9004 4.9212 4.9212 5.7572 5.7572 5.7822 5.7860 6.2290 6.2333 6.2404 6.2404 6.5885 6.5885 6.6530 6.6534 7.5068 7.5068 7.7914 7.7914 8.0735 8.0738 8.0928 8.0928 8.2043 8.2043 8.3585 8.3585 8.4350 8.4352 8.7289 8.7289 9.5408 9.5408 9.6759 9.6759 9.6814 9.6816 11.1169 11.1175 11.1531 11.1531 12.0311 12.0311 12.0630 12.0638 15.0789 15.0789 15.1234 15.1285 k = 0.0000 0.0000 0.0699 ( 4837 PWs) bands (ev): -16.4590 -16.4590 -16.2573 -16.2573 -9.2632 -9.2632 -8.0487 -8.0487 -7.9655 -7.9655 -7.9523 -7.9523 -7.6525 -7.6525 -7.6442 -7.6442 -3.3311 -3.3311 -2.8280 -2.8280 -1.5774 -1.5774 -1.4861 -1.4861 -0.8557 -0.8557 -0.7677 -0.7677 3.0473 3.0473 4.1871 4.1871 4.5665 4.5665 4.6984 4.6991 4.8775 4.8775 4.9024 4.9026 4.9221 4.9221 5.7250 5.7250 5.7507 5.7550 6.2727 6.2778 6.2843 6.2843 6.5681 6.5681 6.6329 6.6335 7.4920 7.4920 7.7944 7.7944 8.0899 8.0905 8.1070 8.1070 8.2076 8.2076 8.3586 8.3586 8.4355 8.4356 8.7252 8.7252 9.5371 9.5371 9.6730 9.6730 9.6785 9.6788 11.1258 11.1266 11.1613 11.1613 12.0233 12.0233 12.0549 12.0560 15.0477 15.0477 15.0898 15.0957 k = 0.0000 0.0000 0.0873 ( 4837 PWs) bands (ev): -16.4578 -16.4578 -16.2580 -16.2580 -9.2593 -9.2593 -8.0570 -8.0570 -7.9649 -7.9649 -7.9518 -7.9518 -7.6521 -7.6521 -7.6439 -7.6439 -3.3289 -3.3289 -2.8317 -2.8317 -1.5758 -1.5758 -1.4816 -1.4816 -0.8616 -0.8616 -0.7738 -0.7738 3.0624 3.0624 4.1868 4.1868 4.5675 4.5675 4.6996 4.7006 4.8858 4.8858 4.9051 4.9053 4.9234 4.9234 5.6904 5.6904 5.7174 5.7221 6.3219 6.3278 6.3339 6.3339 6.5428 6.5428 6.6078 6.6088 7.4722 7.4722 7.7983 7.7983 8.1102 8.1109 8.1242 8.1242 8.2128 8.2128 8.3589 8.3589 8.4362 8.4363 8.7205 8.7205 9.5324 9.5324 9.6693 9.6693 9.6747 9.6751 11.1370 11.1380 11.1716 11.1716 12.0133 12.0133 12.0445 12.0459 15.0102 15.0102 15.0497 15.0561 k = 0.0000 0.0000 0.1048 ( 4825 PWs) bands (ev): -16.4563 -16.4563 -16.2589 -16.2589 -9.2545 -9.2545 -8.0670 -8.0670 -7.9642 -7.9642 -7.9512 -7.9512 -7.6517 -7.6517 -7.6435 -7.6435 -3.3263 -3.3263 -2.8362 -2.8362 -1.5737 -1.5737 -1.4761 -1.4761 -0.8687 -0.8686 -0.7811 -0.7811 3.0807 3.0807 4.1868 4.1868 4.5690 4.5690 4.7011 4.7023 4.8952 4.8952 4.9082 4.9085 4.9248 4.9248 5.6550 5.6550 5.6839 5.6888 6.3748 6.3816 6.3876 6.3876 6.5132 6.5132 6.5785 6.5803 7.4473 7.4473 7.8030 7.8030 8.1337 8.1347 8.1435 8.1435 8.2206 8.2206 8.3595 8.3595 8.4372 8.4372 8.7148 8.7148 9.5267 9.5267 9.6648 9.6648 9.6702 9.6706 11.1503 11.1515 11.1838 11.1838 12.0012 12.0012 12.0320 12.0337 14.9676 14.9676 15.0047 15.0112 k = 0.0000 0.0000 0.1223 ( 4825 PWs) bands (ev): -16.4547 -16.4547 -16.2599 -16.2599 -9.2488 -9.2488 -8.0786 -8.0786 -7.9634 -7.9634 -7.9506 -7.9506 -7.6511 -7.6511 -7.6430 -7.6430 -3.3233 -3.3233 -2.8414 -2.8414 -1.5713 -1.5713 -1.4698 -1.4698 -0.8769 -0.8769 -0.7895 -0.7895 3.1021 3.1021 4.1875 4.1875 4.5713 4.5713 4.7030 4.7043 4.9051 4.9051 4.9118 4.9121 4.9265 4.9265 5.6197 5.6197 5.6509 5.6559 6.4289 6.4380 6.4426 6.4426 6.4813 6.4813 6.5458 6.5495 7.4168 7.4168 7.8086 7.8086 8.1598 8.1612 8.1638 8.1638 8.2321 8.2321 8.3605 8.3605 8.4384 8.4386 8.7080 8.7080 9.5200 9.5200 9.6595 9.6595 9.6647 9.6653 11.1656 11.1670 11.1978 11.1978 11.9871 11.9871 12.0174 12.0194 14.9214 14.9214 14.9562 14.9626 k = 0.0000 0.0000 0.1398 ( 4819 PWs) bands (ev): -16.4527 -16.4527 -16.2610 -16.2610 -9.2422 -9.2422 -8.0919 -8.0919 -7.9625 -7.9625 -7.9498 -7.9498 -7.6505 -7.6505 -7.6425 -7.6425 -3.3199 -3.3199 -2.8473 -2.8473 -1.5685 -1.5685 -1.4627 -1.4627 -0.8863 -0.8863 -0.7990 -0.7990 3.1265 3.1265 4.1891 4.1891 4.5744 4.5744 4.7053 4.7068 4.9151 4.9151 4.9159 4.9163 4.9285 4.9285 5.5850 5.5850 5.6189 5.6240 6.4397 6.4397 6.4734 6.4904 6.5063 6.5063 6.5160 6.5275 7.3806 7.3806 7.8150 7.8150 8.1838 8.1838 8.1879 8.1897 8.2483 8.2483 8.3621 8.3621 8.4401 8.4406 8.7003 8.7003 9.5125 9.5125 9.6533 9.6533 9.6585 9.6591 11.1825 11.1842 11.2133 11.2133 11.9711 11.9711 12.0010 12.0033 14.8727 14.8727 14.9054 14.9117 k = 0.0000 0.0000 0.1572 ( 4825 PWs) bands (ev): -16.4506 -16.4506 -16.2624 -16.2624 -9.2348 -9.2348 -8.1068 -8.1068 -7.9614 -7.9614 -7.9490 -7.9490 -7.6499 -7.6499 -7.6420 -7.6419 -3.3161 -3.3161 -2.8539 -2.8539 -1.5654 -1.5653 -1.4548 -1.4548 -0.8968 -0.8968 -0.8096 -0.8096 3.1538 3.1538 4.1919 4.1919 4.5783 4.5783 4.7078 4.7096 4.9203 4.9208 4.9247 4.9247 4.9308 4.9308 5.5515 5.5515 5.5884 5.5935 6.4004 6.4004 6.4601 6.4669 6.5613 6.5624 6.5667 6.5667 7.3386 7.3386 7.8222 7.8222 8.2026 8.2026 8.2171 8.2195 8.2692 8.2692 8.3647 8.3647 8.4426 8.4435 8.6917 8.6917 9.5041 9.5041 9.6463 9.6463 9.6513 9.6520 11.2008 11.2027 11.2301 11.2301 11.9534 11.9534 11.9827 11.9854 14.8229 14.8229 14.8537 14.8597 k = 0.0000 0.0000 0.1747 ( 4825 PWs) bands (ev): -16.4482 -16.4482 -16.2638 -16.2638 -9.2266 -9.2266 -8.1230 -8.1230 -7.9603 -7.9603 -7.9481 -7.9480 -7.6492 -7.6492 -7.6413 -7.6413 -3.3119 -3.3119 -2.8612 -2.8612 -1.5618 -1.5617 -1.4462 -1.4462 -0.9084 -0.9084 -0.8210 -0.8210 3.1837 3.1837 4.1960 4.1960 4.5831 4.5831 4.7107 4.7127 4.9250 4.9256 4.9316 4.9316 4.9354 4.9354 5.5194 5.5194 5.5594 5.5646 6.3580 6.3580 6.4220 6.4260 6.6214 6.6233 6.6294 6.6294 7.2912 7.2912 7.8303 7.8303 8.2208 8.2208 8.2466 8.2498 8.2936 8.2936 8.3689 8.3689 8.4463 8.4478 8.6821 8.6821 9.4949 9.4949 9.6385 9.6385 9.6434 9.6442 11.2202 11.2224 11.2478 11.2478 11.9341 11.9341 11.9628 11.9658 14.7729 14.7729 14.8020 14.8078 k = 0.0000 0.0000 0.1922 ( 4837 PWs) bands (ev): -16.4456 -16.4456 -16.2654 -16.2654 -9.2175 -9.2175 -8.1407 -8.1407 -7.9591 -7.9591 -7.9471 -7.9471 -7.6484 -7.6484 -7.6407 -7.6407 -3.3073 -3.3073 -2.8691 -2.8691 -1.5577 -1.5577 -1.4370 -1.4370 -0.9209 -0.9209 -0.8333 -0.8333 3.2163 3.2163 4.2018 4.2018 4.5888 4.5888 4.7140 4.7162 4.9298 4.9306 4.9345 4.9345 4.9432 4.9432 5.4889 5.4889 5.5322 5.5375 6.3135 6.3135 6.3796 6.3827 6.6841 6.6872 6.6935 6.6935 7.2383 7.2383 7.8391 7.8391 8.2391 8.2391 8.2752 8.2794 8.3177 8.3177 8.3771 8.3771 8.4519 8.4542 8.6716 8.6716 9.4851 9.4851 9.6299 9.6299 9.6346 9.6354 11.2402 11.2427 11.2662 11.2662 11.9134 11.9134 11.9413 11.9447 14.7237 14.7237 14.7513 14.7568 k = 0.0000 0.0000 0.2096 ( 4813 PWs) bands (ev): -16.4428 -16.4428 -16.2672 -16.2672 -9.2076 -9.2076 -8.1596 -8.1596 -7.9578 -7.9578 -7.9460 -7.9460 -7.6476 -7.6476 -7.6400 -7.6400 -3.3024 -3.3024 -2.8775 -2.8775 -1.5533 -1.5533 -1.4272 -1.4272 -0.9344 -0.9343 -0.8463 -0.8463 3.2513 3.2513 4.2095 4.2095 4.5955 4.5955 4.7178 4.7202 4.9351 4.9360 4.9371 4.9371 4.9503 4.9503 5.4602 5.4602 5.5069 5.5122 6.2674 6.2674 6.3352 6.3379 6.7486 6.7522 6.7586 6.7586 7.1804 7.1804 7.8486 7.8486 8.2584 8.2584 8.3016 8.3070 8.3364 8.3364 8.3936 8.3936 8.4606 8.4639 8.6602 8.6602 9.4743 9.4743 9.6204 9.6204 9.6249 9.6259 11.2608 11.2637 11.2850 11.2850 11.8914 11.8914 11.9186 11.9224 14.6760 14.6760 14.7023 14.7076 k = 0.0000 0.0000 0.2271 ( 4825 PWs) bands (ev): -16.4397 -16.4397 -16.2691 -16.2691 -9.1969 -9.1969 -8.1798 -8.1798 -7.9565 -7.9565 -7.9450 -7.9449 -7.6468 -7.6468 -7.6393 -7.6393 -3.2972 -3.2972 -2.8865 -2.8865 -1.5484 -1.5484 -1.4170 -1.4170 -0.9486 -0.9486 -0.8599 -0.8599 3.2884 3.2884 4.2193 4.2193 4.6032 4.6032 4.7219 4.7245 4.9397 4.9397 4.9403 4.9414 4.9560 4.9560 5.4332 5.4332 5.4835 5.4887 6.2199 6.2199 6.2894 6.2919 6.8141 6.8181 6.8246 6.8246 7.1176 7.1176 7.8589 7.8589 8.2788 8.2788 8.3238 8.3304 8.3466 8.3466 8.4203 8.4203 8.4738 8.4781 8.6481 8.6481 9.4630 9.4630 9.6102 9.6102 9.6144 9.6154 11.2813 11.2845 11.3037 11.3037 11.8683 11.8683 11.8947 11.8989 14.6308 14.6308 14.6560 14.6610 k = 0.0000 0.0000 0.2446 ( 4796 PWs) bands (ev): -16.4365 -16.4365 -16.2712 -16.2712 -9.1854 -9.1854 -8.2010 -8.2010 -7.9550 -7.9550 -7.9438 -7.9438 -7.6459 -7.6459 -7.6385 -7.6385 -3.2916 -3.2916 -2.8960 -2.8960 -1.5430 -1.5430 -1.4063 -1.4063 -0.9637 -0.9637 -0.8741 -0.8741 3.3277 3.3277 4.2312 4.2312 4.6119 4.6119 4.7265 4.7294 4.9423 4.9423 4.9456 4.9469 4.9602 4.9602 5.4082 5.4082 5.4620 5.4673 6.1716 6.1716 6.2428 6.2452 6.8804 6.8847 6.8911 6.8911 7.0505 7.0505 7.8700 7.8700 8.3006 8.3006 8.3409 8.3484 8.3520 8.3520 8.4532 8.4532 8.4929 8.4980 8.6352 8.6352 9.4512 9.4512 9.5992 9.5992 9.6032 9.6042 11.3015 11.3051 11.3221 11.3221 11.8445 11.8445 11.8700 11.8746 14.5886 14.5886 14.6128 14.6177 k = 0.0000 0.0000 0.2620 ( 4796 PWs) bands (ev): -16.4331 -16.4331 -16.2734 -16.2734 -9.1731 -9.1731 -8.2232 -8.2232 -7.9536 -7.9536 -7.9427 -7.9426 -7.6450 -7.6450 -7.6377 -7.6377 -3.2858 -3.2858 -2.9059 -2.9059 -1.5372 -1.5372 -1.3953 -1.3953 -0.9794 -0.9794 -0.8888 -0.8888 3.3689 3.3689 4.2453 4.2453 4.6216 4.6216 4.7315 4.7346 4.9448 4.9448 4.9508 4.9523 4.9627 4.9627 5.3850 5.3850 5.4424 5.4477 6.1227 6.1227 6.1956 6.1980 6.9472 6.9517 6.9575 6.9575 6.9800 6.9800 7.8817 7.8817 8.3233 8.3233 8.3523 8.3555 8.3555 8.3602 8.4893 8.4893 8.5180 8.5234 8.6215 8.6215 9.4387 9.4387 9.5873 9.5873 9.5910 9.5921 11.3208 11.3248 11.3396 11.3396 11.8199 11.8199 11.8444 11.8495 14.5500 14.5500 14.5735 14.5782 k = 0.0000 0.0000 0.2795 ( 4790 PWs) bands (ev): -16.4296 -16.4296 -16.2758 -16.2758 -9.1601 -9.1601 -8.2462 -8.2462 -7.9521 -7.9521 -7.9415 -7.9415 -7.6441 -7.6441 -7.6369 -7.6369 -3.2797 -3.2797 -2.9162 -2.9162 -1.5309 -1.5309 -1.3839 -1.3839 -0.9958 -0.9958 -0.9038 -0.9038 3.4119 3.4119 4.2618 4.2618 4.6322 4.6322 4.7370 4.7403 4.9474 4.9474 4.9560 4.9577 4.9635 4.9635 5.3637 5.3637 5.4248 5.4300 6.0734 6.0734 6.1483 6.1507 6.9047 6.9047 7.0143 7.0189 7.0254 7.0254 7.8941 7.8941 8.3433 8.3433 8.3590 8.3617 8.3617 8.3670 8.5269 8.5269 8.5480 8.5533 8.6071 8.6071 9.4256 9.4256 9.5745 9.5745 9.5779 9.5791 11.3390 11.3435 11.3560 11.3560 11.7949 11.7949 11.8184 11.8240 14.5158 14.5158 14.5386 14.5430 k = 0.0000 0.0000 0.2970 ( 4790 PWs) bands (ev): -16.4259 -16.4259 -16.2783 -16.2783 -9.1463 -9.1463 -8.2701 -8.2701 -7.9507 -7.9507 -7.9403 -7.9403 -7.6432 -7.6432 -7.6361 -7.6361 -3.2733 -3.2733 -2.9268 -2.9268 -1.5242 -1.5241 -1.3724 -1.3724 -1.0127 -1.0127 -0.9190 -0.9190 3.4563 3.4563 4.2805 4.2805 4.6437 4.6437 4.7430 4.7465 4.9498 4.9498 4.9609 4.9627 4.9627 4.9629 5.3443 5.3443 5.4090 5.4142 6.0241 6.0241 6.1010 6.1034 6.8271 6.8271 7.0814 7.0862 7.0925 7.0925 7.9071 7.9071 8.3503 8.3503 8.3619 8.3698 8.3811 8.3811 8.5654 8.5654 8.5814 8.5864 8.5921 8.5921 9.4120 9.4120 9.5610 9.5610 9.5640 9.5653 11.3557 11.3606 11.3709 11.3709 11.7697 11.7697 11.7922 11.7983 14.4863 14.4863 14.5084 14.5128 k = 0.0000 0.0000 0.3144 ( 4796 PWs) bands (ev): -16.4220 -16.4220 -16.2810 -16.2810 -9.1318 -9.1318 -8.2945 -8.2945 -7.9492 -7.9492 -7.9391 -7.9391 -7.6423 -7.6423 -7.6354 -7.6353 -3.2666 -3.2666 -2.9378 -2.9378 -1.5169 -1.5169 -1.3607 -1.3607 -1.0301 -1.0301 -0.9345 -0.9345 3.5021 3.5021 4.3014 4.3014 4.6562 4.6562 4.7495 4.7532 4.9519 4.9519 4.9606 4.9606 4.9656 4.9679 5.3267 5.3267 5.3952 5.4003 5.9749 5.9749 6.0541 6.0566 6.7467 6.7467 7.1483 7.1533 7.1594 7.1594 7.9206 7.9206 8.3505 8.3505 8.3621 8.3698 8.4074 8.4074 8.5764 8.5764 8.6046 8.6046 8.6170 8.6216 9.3978 9.3978 9.5466 9.5466 9.5492 9.5506 11.3705 11.3760 11.3839 11.3839 11.7446 11.7446 11.7659 11.7725 14.4619 14.4619 14.4835 14.4877 k = 0.0000 0.0000 0.3319 ( 4808 PWs) bands (ev): -16.4180 -16.4180 -16.2838 -16.2838 -9.1166 -9.1166 -8.3196 -8.3196 -7.9477 -7.9477 -7.9379 -7.9379 -7.6414 -7.6414 -7.6346 -7.6346 -3.2597 -3.2597 -2.9490 -2.9490 -1.5091 -1.5091 -1.3489 -1.3489 -1.0479 -1.0479 -0.9501 -0.9501 3.5490 3.5490 4.3241 4.3241 4.6695 4.6695 4.7565 4.7604 4.9525 4.9525 4.9586 4.9586 4.9700 4.9725 5.3109 5.3109 5.3831 5.3882 5.9260 5.9260 6.0077 6.0102 6.6641 6.6641 7.2149 7.2200 7.2259 7.2259 7.9348 7.9348 8.3487 8.3487 8.3600 8.3675 8.4358 8.4358 8.5603 8.5603 8.6439 8.6439 8.6538 8.6581 9.3831 9.3831 9.5313 9.5313 9.5336 9.5349 11.3833 11.3893 11.3949 11.3949 11.7199 11.7199 11.7399 11.7471 14.4430 14.4430 14.4641 14.4682 k = 0.0000 0.0000 0.3494 ( 4820 PWs) bands (ev): -16.4140 -16.4140 -16.2867 -16.2867 -9.1008 -9.1008 -8.3450 -8.3450 -7.9463 -7.9463 -7.9367 -7.9367 -7.6405 -7.6405 -7.6338 -7.6338 -3.2526 -3.2526 -2.9604 -2.9604 -1.5009 -1.5008 -1.3370 -1.3370 -1.0660 -1.0660 -0.9658 -0.9658 3.5969 3.5969 4.3483 4.3483 4.6837 4.6837 4.7639 4.7680 4.9499 4.9499 4.9591 4.9591 4.9741 4.9769 5.2966 5.2966 5.3729 5.3779 5.8777 5.8777 5.9621 5.9647 6.5797 6.5797 7.2809 7.2861 7.2917 7.2917 7.9494 7.9494 8.3454 8.3454 8.3559 8.3633 8.4653 8.4653 8.5437 8.5437 8.6833 8.6833 8.6913 8.6953 9.3679 9.3679 9.5151 9.5151 9.5170 9.5184 11.3937 11.4003 11.4035 11.4035 11.6959 11.6959 11.7145 11.7223 14.4299 14.4299 14.4505 14.4545 k = 0.0000 0.0000 0.3669 ( 4832 PWs) bands (ev): -16.4098 -16.4098 -16.2897 -16.2897 -9.0844 -9.0844 -8.3707 -8.3707 -7.9448 -7.9448 -7.9356 -7.9356 -7.6397 -7.6397 -7.6331 -7.6330 -3.2452 -3.2452 -2.9719 -2.9719 -1.4921 -1.4920 -1.3250 -1.3250 -1.0844 -1.0843 -0.9814 -0.9814 3.6455 3.6455 4.3735 4.3735 4.6986 4.6986 4.7718 4.7761 4.9457 4.9457 4.9609 4.9609 4.9777 4.9808 5.2840 5.2840 5.3644 5.3693 5.8302 5.8302 5.9174 5.9201 6.4938 6.4938 7.3460 7.3514 7.3567 7.3567 7.9645 7.9645 8.3408 8.3408 8.3501 8.3574 8.4952 8.4952 8.5270 8.5270 8.7226 8.7226 8.7292 8.7329 9.3523 9.3523 9.4980 9.4980 9.4995 9.5010 11.4017 11.4088 11.4097 11.4097 11.6728 11.6728 11.6900 11.6983 14.4226 14.4226 14.4429 14.4467 k = 0.0000 0.0000 0.3843 ( 4832 PWs) bands (ev): -16.4055 -16.4055 -16.2929 -16.2929 -9.0675 -9.0675 -8.3966 -8.3966 -7.9435 -7.9435 -7.9345 -7.9345 -7.6388 -7.6388 -7.6323 -7.6323 -3.2375 -3.2375 -2.9836 -2.9836 -1.4827 -1.4827 -1.3130 -1.3130 -1.1029 -1.1029 -0.9969 -0.9969 3.6946 3.6946 4.3988 4.3988 4.7143 4.7143 4.7801 4.7845 4.9419 4.9419 4.9629 4.9629 4.9809 4.9842 5.2729 5.2729 5.3576 5.3624 5.7836 5.7836 5.8740 5.8768 6.4068 6.4068 7.4102 7.4157 7.4206 7.4206 7.9800 7.9800 8.3346 8.3346 8.3426 8.3498 8.5085 8.5085 8.5271 8.5271 8.7618 8.7618 8.7672 8.7707 9.3363 9.3363 9.4801 9.4801 9.4812 9.4827 11.4072 11.4134 11.4134 11.4148 11.6509 11.6509 11.6667 11.6754 14.4214 14.4214 14.4411 14.4448 k = 0.0000 0.0000 0.4018 ( 4832 PWs) bands (ev): -16.4012 -16.4012 -16.2961 -16.2961 -9.0501 -9.0501 -8.4225 -8.4225 -7.9422 -7.9422 -7.9334 -7.9334 -7.6380 -7.6380 -7.6316 -7.6316 -3.2297 -3.2297 -2.9953 -2.9953 -1.4729 -1.4729 -1.3010 -1.3010 -1.1215 -1.1215 -1.0124 -1.0124 3.7440 3.7440 4.4232 4.4232 4.7306 4.7306 4.7888 4.7933 4.9398 4.9398 4.9650 4.9650 4.9837 4.9872 5.2633 5.2633 5.3526 5.3573 5.7383 5.7383 5.8319 5.8348 6.3192 6.3192 7.4731 7.4787 7.4833 7.4833 7.9957 7.9957 8.3269 8.3269 8.3334 8.3405 8.4915 8.4915 8.5574 8.5574 8.8007 8.8007 8.8052 8.8084 9.3199 9.3199 9.4612 9.4612 9.4619 9.4634 11.4103 11.4146 11.4146 11.4183 11.6306 11.6306 11.6449 11.6539 14.4260 14.4260 14.4452 14.4488 k = 0.0000 0.0000 0.4193 ( 4826 PWs) bands (ev): -16.3969 -16.3969 -16.2995 -16.2995 -9.0323 -9.0323 -8.4483 -8.4483 -7.9409 -7.9409 -7.9324 -7.9324 -7.6373 -7.6373 -7.6310 -7.6310 -3.2216 -3.2216 -3.0071 -3.0071 -1.4625 -1.4625 -1.2890 -1.2890 -1.1401 -1.1401 -1.0276 -1.0276 3.7933 3.7933 4.4453 4.4453 4.7472 4.7472 4.7978 4.8024 4.9409 4.9409 4.9672 4.9672 4.9860 4.9897 5.2552 5.2552 5.3491 5.3537 5.6944 5.6944 5.7915 5.7945 6.2313 6.2313 7.5345 7.5402 7.5443 7.5443 8.0117 8.0117 8.3176 8.3176 8.3225 8.3295 8.4740 8.4740 8.5882 8.5882 8.8392 8.8392 8.8429 8.8459 9.3031 9.3031 9.4414 9.4414 9.4417 9.4433 11.4112 11.4136 11.4136 11.4194 11.6119 11.6119 11.6248 11.6340 14.4364 14.4364 14.4550 14.4586 k = 0.0000 0.0000 0.4367 ( 4820 PWs) bands (ev): -16.3925 -16.3925 -16.3029 -16.3029 -9.0143 -9.0143 -8.4737 -8.4737 -7.9398 -7.9398 -7.9315 -7.9315 -7.6366 -7.6366 -7.6304 -7.6304 -3.2133 -3.2133 -3.0188 -3.0188 -1.4517 -1.4516 -1.2771 -1.2771 -1.1587 -1.1586 -1.0427 -1.0427 3.8424 3.8424 4.4637 4.4637 4.7637 4.7637 4.8069 4.8116 4.9466 4.9466 4.9697 4.9697 4.9877 4.9916 5.2486 5.2486 5.3472 5.3517 5.6520 5.6520 5.7529 5.7560 6.1434 6.1434 7.5942 7.5999 7.6036 7.6036 8.0278 8.0278 8.3065 8.3065 8.3099 8.3167 8.4564 8.4564 8.6185 8.6185 8.8772 8.8772 8.8802 8.8830 9.2863 9.2863 9.4206 9.4207 9.4207 9.4222 11.4100 11.4104 11.4104 11.4182 11.5951 11.5951 11.6066 11.6158 14.4525 14.4525 14.4704 14.4738 k = 0.0000 0.0000 0.4542 ( 4832 PWs) bands (ev): -16.3882 -16.3882 -16.3064 -16.3064 -8.9962 -8.9962 -8.4986 -8.4986 -7.9387 -7.9387 -7.9307 -7.9307 -7.6360 -7.6360 -7.6298 -7.6298 -3.2048 -3.2048 -3.0305 -3.0305 -1.4403 -1.4403 -1.2651 -1.2651 -1.1771 -1.1770 -1.0576 -1.0576 3.8908 3.8908 4.4767 4.4767 4.7796 4.7796 4.8161 4.8207 4.9571 4.9571 4.9740 4.9740 4.9889 4.9929 5.2437 5.2437 5.3468 5.3511 5.6116 5.6116 5.7163 5.7195 6.0560 6.0560 7.6518 7.6576 7.6608 7.6608 8.0438 8.0438 8.2935 8.2935 8.2953 8.3021 8.4389 8.4389 8.6482 8.6482 8.9146 8.9146 8.9170 8.9197 9.2693 9.2693 9.3985 9.3990 9.3990 9.4001 11.4056 11.4056 11.4072 11.4151 11.5802 11.5802 11.5905 11.5993 14.4737 14.4737 14.4908 14.4942 k = 0.0000 0.0000 0.4717 ( 4832 PWs) bands (ev): -16.3839 -16.3839 -16.3099 -16.3099 -8.9782 -8.9782 -8.5227 -8.5227 -7.9377 -7.9377 -7.9299 -7.9299 -7.6354 -7.6354 -7.6293 -7.6293 -3.1961 -3.1961 -3.0421 -3.0421 -1.4285 -1.4285 -1.2531 -1.2531 -1.1952 -1.1952 -1.0721 -1.0721 3.9382 3.9382 4.4834 4.4834 4.7944 4.7944 4.8252 4.8297 4.9658 4.9658 4.9883 4.9883 4.9896 4.9936 5.2404 5.2404 5.3478 5.3520 5.5734 5.5734 5.6821 5.6853 5.9695 5.9695 7.7071 7.7129 7.7155 7.7155 8.0596 8.0596 8.2787 8.2787 8.2790 8.2857 8.4218 8.4218 8.6766 8.6766 8.9514 8.9514 8.9533 8.9559 9.2523 9.2523 9.3754 9.3763 9.3763 9.3771 11.3998 11.3998 11.4031 11.4106 11.5672 11.5672 11.5766 11.5848 14.4999 14.4999 14.5160 14.5193 k = 0.0000 0.0000 0.4891 ( 4832 PWs) bands (ev): -16.3798 -16.3798 -16.3133 -16.3133 -8.9606 -8.9606 -8.5457 -8.5457 -7.9369 -7.9369 -7.9292 -7.9292 -7.6349 -7.6349 -7.6289 -7.6289 -3.1872 -3.1872 -3.0535 -3.0535 -1.4163 -1.4163 -1.2411 -1.2411 -1.2131 -1.2130 -1.0865 -1.0865 3.9840 3.9840 4.4835 4.4835 4.8079 4.8079 4.8339 4.8383 4.9690 4.9690 4.9900 4.9939 5.0164 5.0164 5.2389 5.2389 5.3502 5.3541 5.5377 5.5377 5.6506 5.6537 5.8844 5.8844 7.7597 7.7655 7.7675 7.7675 8.0750 8.0750 8.2610 8.2621 8.2621 8.2675 8.4053 8.4053 8.7035 8.7035 8.9875 8.9875 8.9890 8.9914 9.2359 9.2359 9.3514 9.3527 9.3527 9.3531 11.3933 11.3933 11.3984 11.4052 11.5560 11.5560 11.5648 11.5722 14.5304 14.5304 14.5454 14.5487 k = 0.0000 0.0000 0.5066 ( 4826 PWs) bands (ev): -16.3758 -16.3758 -16.3167 -16.3167 -8.9438 -8.9438 -8.5671 -8.5671 -7.9362 -7.9362 -7.9286 -7.9286 -7.6344 -7.6344 -7.6285 -7.6285 -3.1783 -3.1783 -3.0647 -3.0647 -1.4038 -1.4037 -1.2304 -1.2304 -1.2291 -1.2291 -1.1005 -1.1005 4.0276 4.0276 4.4774 4.4774 4.8200 4.8200 4.8422 4.8462 4.9706 4.9706 4.9900 4.9936 5.0537 5.0537 5.2392 5.2392 5.3537 5.3573 5.5051 5.5051 5.6221 5.6251 5.8014 5.8014 7.8091 7.8148 7.8162 7.8162 8.0895 8.0895 8.2414 8.2440 8.2440 8.2477 8.3898 8.3898 8.7283 8.7283 9.0228 9.0228 9.0240 9.0263 9.2203 9.2203 9.3265 9.3281 9.3281 9.3282 11.3868 11.3868 11.3935 11.3994 11.5466 11.5466 11.5550 11.5615 14.5650 14.5650 14.5787 14.5819 k = 0.0000 0.0000 0.5241 ( 4826 PWs) bands (ev): -16.3721 -16.3721 -16.3199 -16.3199 -8.9283 -8.9283 -8.5865 -8.5865 -7.9355 -7.9355 -7.9281 -7.9281 -7.6341 -7.6341 -7.6282 -7.6281 -3.1693 -3.1693 -3.0755 -3.0755 -1.3911 -1.3911 -1.2471 -1.2470 -1.2171 -1.2171 -1.1143 -1.1143 4.0681 4.0681 4.4665 4.4665 4.8304 4.8304 4.8496 4.8531 4.9716 4.9716 4.9897 4.9930 5.0974 5.0974 5.2416 5.2416 5.3580 5.3613 5.4760 5.4760 5.5972 5.6000 5.7213 5.7213 7.8547 7.8602 7.8608 7.8608 8.1027 8.1027 8.2207 8.2247 8.2247 8.2267 8.3756 8.3756 8.7502 8.7502 9.0572 9.0572 9.0582 9.0604 9.2060 9.2060 9.3005 9.3023 9.3025 9.3025 11.3807 11.3807 11.3888 11.3937 11.5389 11.5389 11.5473 11.5527 14.6029 14.6029 14.6151 14.6183 k = 0.0000 0.0000 0.5416 ( 4802 PWs) bands (ev): -16.3689 -16.3689 -16.3228 -16.3228 -8.9147 -8.9147 -8.6031 -8.6031 -7.9350 -7.9350 -7.9277 -7.9277 -7.6338 -7.6338 -7.6279 -7.6279 -3.1606 -3.1606 -3.0857 -3.0857 -1.3787 -1.3786 -1.2627 -1.2627 -1.2049 -1.2049 -1.1277 -1.1277 4.1040 4.1040 4.4528 4.4528 4.8391 4.8391 4.8561 4.8589 4.9723 4.9723 4.9894 4.9921 5.1443 5.1443 5.2464 5.2464 5.3627 5.3655 5.4514 5.4514 5.5765 5.5789 5.6456 5.6456 7.8955 7.9005 7.9005 7.9005 8.1142 8.1142 8.2000 8.2052 8.2052 8.2053 8.3634 8.3634 8.7686 8.7686 9.0906 9.0906 9.0916 9.0937 9.1939 9.1939 9.2736 9.2754 9.2761 9.2761 11.3756 11.3756 11.3849 11.3887 11.5330 11.5330 11.5416 11.5457 14.6437 14.6437 14.6540 14.6573 k = 0.0000 0.0000 0.5590 ( 4802 PWs) bands (ev): -16.3663 -16.3663 -16.3251 -16.3251 -8.9040 -8.9040 -8.6159 -8.6159 -7.9347 -7.9347 -7.9274 -7.9274 -7.6336 -7.6336 -7.6277 -7.6277 -3.1524 -3.1524 -3.0949 -3.0949 -1.3671 -1.3670 -1.2766 -1.2765 -1.1928 -1.1928 -1.1409 -1.1409 4.1332 4.1332 4.4389 4.4389 4.8455 4.8455 4.8611 4.8631 4.9727 4.9727 4.9892 4.9911 5.1879 5.1879 5.2557 5.2557 5.3672 5.3692 5.4320 5.4320 5.5608 5.5626 5.5775 5.5775 7.9296 7.9330 7.9330 7.9336 8.1230 8.1230 8.1809 8.1852 8.1873 8.1873 8.3539 8.3539 8.7826 8.7826 9.1226 9.1226 9.1241 9.1261 9.1844 9.1844 9.2458 9.2476 9.2490 9.2490 11.3717 11.3717 11.3821 11.3846 11.5288 11.5288 11.5377 11.5404 14.6864 14.6864 14.6948 14.6980 k = 0.0000 0.0000 0.5765 ( 4802 PWs) bands (ev): -16.3645 -16.3645 -16.3267 -16.3267 -8.8971 -8.8971 -8.6242 -8.6242 -7.9345 -7.9345 -7.9273 -7.9273 -7.6335 -7.6335 -7.6276 -7.6276 -3.1459 -3.1459 -3.1020 -3.1020 -1.3579 -1.3579 -1.2870 -1.2870 -1.1808 -1.1808 -1.1535 -1.1535 4.1529 4.1529 4.4283 4.4283 4.8495 4.8495 4.8644 4.8655 4.9730 4.9730 4.9893 4.9903 5.2157 5.2157 5.2736 5.2736 5.3706 5.3717 5.4188 5.4188 5.5242 5.5242 5.5511 5.5521 7.9537 7.9555 7.9555 7.9561 8.1284 8.1284 8.1669 8.1694 8.1740 8.1740 8.3477 8.3477 8.7914 8.7914 9.1522 9.1522 9.1556 9.1576 9.1786 9.1786 9.2171 9.2189 9.2221 9.2221 11.3692 11.3692 11.3805 11.3818 11.5262 11.5262 11.5356 11.5370 14.7296 14.7296 14.7356 14.7385 k = 0.0000 0.0000 0.5940 ( 4796 PWs) bands (ev): -16.3639 -16.3639 -16.3273 -16.3273 -8.8947 -8.8947 -8.6270 -8.6270 -7.9344 -7.9344 -7.9272 -7.9272 -7.6334 -7.6334 -7.6276 -7.6276 -3.1432 -3.1432 -3.1050 -3.1050 -1.3542 -1.3542 -1.2912 -1.2912 -1.1721 -1.1721 -1.1623 -1.1623 4.1599 4.1599 4.4243 4.4243 4.8509 4.8509 4.8660 4.8660 4.9730 4.9730 4.9896 4.9896 5.2233 5.2233 5.2861 5.2861 5.3723 5.3723 5.4138 5.4138 5.5022 5.5022 5.5481 5.5481 7.9635 7.9635 7.9637 7.9637 8.1302 8.1302 8.1624 8.1624 8.1689 8.1689 8.3456 8.3456 8.7943 8.7943 9.1691 9.1691 9.1784 9.1784 9.1827 9.1827 9.1929 9.1929 9.2044 9.2044 11.3684 11.3684 11.3804 11.3804 11.5253 11.5253 11.5354 11.5354 14.7593 14.7593 14.7640 14.7641 k = 0.0000 0.0000 0.5940 ( 4796 PWs) bands (ev): -16.3639 -16.3639 -16.3273 -16.3273 -8.8947 -8.8947 -8.6270 -8.6270 -7.9344 -7.9344 -7.9272 -7.9272 -7.6334 -7.6334 -7.6276 -7.6276 -3.1432 -3.1432 -3.1050 -3.1050 -1.3542 -1.3542 -1.2912 -1.2912 -1.1721 -1.1721 -1.1623 -1.1623 4.1599 4.1599 4.4243 4.4243 4.8509 4.8509 4.8660 4.8660 4.9730 4.9730 4.9896 4.9896 5.2233 5.2233 5.2861 5.2861 5.3723 5.3723 5.4138 5.4138 5.5022 5.5022 5.5481 5.5481 7.9635 7.9635 7.9637 7.9637 8.1302 8.1302 8.1624 8.1624 8.1689 8.1689 8.3456 8.3456 8.7943 8.7943 9.1691 9.1691 9.1784 9.1784 9.1827 9.1827 9.1929 9.1929 9.2044 9.2044 11.3684 11.3684 11.3804 11.3804 11.5253 11.5253 11.5354 11.5354 14.7593 14.7593 14.7640 14.7641 k = 0.0152 0.0087 0.5940 ( 4802 PWs) bands (ev): -16.3639 -16.3639 -16.3272 -16.3272 -8.8947 -8.8947 -8.6271 -8.6271 -7.9346 -7.9346 -7.9275 -7.9275 -7.6337 -7.6337 -7.6278 -7.6278 -3.1427 -3.1427 -3.1045 -3.1045 -1.3535 -1.3535 -1.2906 -1.2906 -1.1714 -1.1714 -1.1617 -1.1617 4.1602 4.1602 4.4246 4.4246 4.8508 4.8508 4.8659 4.8659 4.9729 4.9729 4.9895 4.9895 5.2223 5.2223 5.2847 5.2847 5.3701 5.3701 5.4139 5.4139 5.5039 5.5039 5.5477 5.5477 7.9625 7.9625 7.9633 7.9633 8.1292 8.1292 8.1617 8.1617 8.1682 8.1682 8.3446 8.3446 8.7946 8.7946 9.1666 9.1666 9.1788 9.1788 9.1834 9.1834 9.1923 9.1923 9.2048 9.2048 11.3683 11.3683 11.3803 11.3803 11.5252 11.5252 11.5353 11.5353 14.7611 14.7611 14.7659 14.7659 k = 0.0303 0.0175 0.5940 ( 4802 PWs) bands (ev): -16.3638 -16.3638 -16.3272 -16.3272 -8.8948 -8.8948 -8.6272 -8.6272 -7.9353 -7.9353 -7.9281 -7.9281 -7.6344 -7.6344 -7.6285 -7.6285 -3.1412 -3.1412 -3.1029 -3.1029 -1.3516 -1.3516 -1.2890 -1.2890 -1.1693 -1.1693 -1.1598 -1.1598 4.1612 4.1612 4.4256 4.4256 4.8507 4.8507 4.8658 4.8658 4.9724 4.9724 4.9892 4.9892 5.2191 5.2191 5.2803 5.2803 5.3640 5.3640 5.4145 5.4145 5.5086 5.5086 5.5465 5.5465 7.9594 7.9594 7.9623 7.9623 8.1263 8.1263 8.1592 8.1592 8.1663 8.1663 8.3415 8.3415 8.7953 8.7953 9.1608 9.1608 9.1789 9.1789 9.1846 9.1846 9.1905 9.1905 9.2060 9.2060 11.3679 11.3679 11.3800 11.3800 11.5246 11.5246 11.5349 11.5349 14.7664 14.7664 14.7718 14.7718 k = 0.0455 0.0262 0.5940 ( 4804 PWs) bands (ev): -16.3637 -16.3637 -16.3270 -16.3270 -8.8951 -8.8951 -8.6274 -8.6274 -7.9366 -7.9366 -7.9291 -7.9291 -7.6359 -7.6359 -7.6295 -7.6295 -3.1387 -3.1387 -3.1004 -3.1004 -1.3483 -1.3483 -1.2862 -1.2862 -1.1657 -1.1657 -1.1568 -1.1568 4.1627 4.1627 4.4273 4.4273 4.8504 4.8504 4.8656 4.8656 4.9715 4.9715 4.9887 4.9887 5.2136 5.2136 5.2733 5.2733 5.3550 5.3550 5.4151 5.4151 5.5154 5.5154 5.5447 5.5447 7.9542 7.9542 7.9607 7.9607 8.1215 8.1215 8.1545 8.1545 8.1635 8.1635 8.3365 8.3365 8.7965 8.7965 9.1532 9.1532 9.1787 9.1787 9.1838 9.1838 9.1890 9.1890 9.2082 9.2082 11.3671 11.3671 11.3797 11.3797 11.5235 11.5235 11.5344 11.5344 14.7745 14.7745 14.7822 14.7822 k = 0.0606 0.0350 0.5940 ( 4806 PWs) bands (ev): -16.3635 -16.3635 -16.3268 -16.3268 -8.8954 -8.8954 -8.6276 -8.6276 -7.9386 -7.9386 -7.9303 -7.9303 -7.6381 -7.6381 -7.6307 -7.6307 -3.1352 -3.1352 -3.0970 -3.0970 -1.3437 -1.3437 -1.2824 -1.2824 -1.1608 -1.1608 -1.1525 -1.1525 4.1649 4.1649 4.4297 4.4297 4.8501 4.8501 4.8654 4.8654 4.9702 4.9702 4.9882 4.9882 5.2056 5.2056 5.2639 5.2639 5.3441 5.3441 5.4156 5.4156 5.5234 5.5234 5.5422 5.5422 7.9469 7.9469 7.9582 7.9582 8.1149 8.1149 8.1474 8.1474 8.1603 8.1603 8.3297 8.3297 8.7981 8.7981 9.1441 9.1441 9.1777 9.1777 9.1796 9.1796 9.1891 9.1891 9.2112 9.2112 11.3657 11.3657 11.3796 11.3796 11.5216 11.5216 11.5342 11.5342 14.7855 14.7855 14.7970 14.7970 k = 0.0758 0.0437 0.5940 ( 4804 PWs) bands (ev): -16.3632 -16.3632 -16.3266 -16.3266 -8.8957 -8.8957 -8.6279 -8.6279 -7.9413 -7.9413 -7.9315 -7.9315 -7.6412 -7.6412 -7.6318 -7.6318 -3.1308 -3.1308 -3.0926 -3.0926 -1.3380 -1.3380 -1.2777 -1.2777 -1.1543 -1.1543 -1.1470 -1.1470 4.1676 4.1676 4.4327 4.4327 4.8495 4.8495 4.8652 4.8652 4.9683 4.9683 4.9875 4.9875 5.1948 5.1948 5.2528 5.2528 5.3323 5.3323 5.4160 5.4160 5.5316 5.5316 5.5396 5.5396 7.9378 7.9378 7.9549 7.9549 8.1069 8.1069 8.1380 8.1380 8.1564 8.1564 8.3213 8.3213 8.8001 8.8001 9.1338 9.1338 9.1721 9.1721 9.1778 9.1778 9.1894 9.1894 9.2148 9.2148 11.3635 11.3635 11.3798 11.3798 11.5188 11.5188 11.5342 11.5342 14.7994 14.7994 14.8160 14.8160 k = 0.0909 0.0525 0.5940 ( 4808 PWs) bands (ev): -16.3629 -16.3629 -16.3263 -16.3263 -8.8962 -8.8962 -8.6283 -8.6283 -7.9449 -7.9449 -7.9327 -7.9327 -7.6452 -7.6452 -7.6330 -7.6330 -3.1254 -3.1254 -3.0873 -3.0873 -1.3312 -1.3312 -1.2720 -1.2720 -1.1465 -1.1465 -1.1401 -1.1401 4.1709 4.1709 4.4362 4.4362 4.8487 4.8487 4.8651 4.8651 4.9657 4.9657 4.9869 4.9869 5.1809 5.1809 5.2406 5.2406 5.3199 5.3199 5.4159 5.4159 5.5335 5.5335 5.5430 5.5430 7.9267 7.9267 7.9508 7.9508 8.0975 8.0975 8.1265 8.1265 8.1516 8.1516 8.3115 8.3115 8.8024 8.8024 9.1223 9.1223 9.1640 9.1640 9.1769 9.1769 9.1896 9.1896 9.2188 9.2188 11.3604 11.3604 11.3803 11.3803 11.5149 11.5149 11.5345 11.5345 14.8164 14.8164 14.8390 14.8390 k = 0.1061 0.0612 0.5940 ( 4812 PWs) bands (ev): -16.3625 -16.3625 -16.3260 -16.3260 -8.8967 -8.8967 -8.6288 -8.6288 -7.9491 -7.9491 -7.9340 -7.9340 -7.6499 -7.6499 -7.6343 -7.6343 -3.1193 -3.1193 -3.0812 -3.0812 -1.3234 -1.3234 -1.2657 -1.2657 -1.1374 -1.1374 -1.1320 -1.1320 4.1747 4.1747 4.4402 4.4402 4.8477 4.8477 4.8651 4.8651 4.9622 4.9622 4.9863 4.9863 5.1637 5.1637 5.2276 5.2276 5.3074 5.3074 5.4153 5.4153 5.5297 5.5297 5.5515 5.5515 7.9138 7.9138 7.9455 7.9455 8.0870 8.0870 8.1130 8.1130 8.1459 8.1459 8.3007 8.3007 8.8051 8.8051 9.1096 9.1096 9.1546 9.1546 9.1759 9.1759 9.1894 9.1894 9.2233 9.2233 11.3564 11.3564 11.3810 11.3810 11.5102 11.5102 11.5350 11.5350 14.8364 14.8364 14.8654 14.8654 k = 0.1212 0.0700 0.5940 ( 4812 PWs) bands (ev): -16.3622 -16.3622 -16.3256 -16.3256 -8.8973 -8.8973 -8.6293 -8.6293 -7.9541 -7.9541 -7.9353 -7.9353 -7.6553 -7.6553 -7.6356 -7.6356 -3.1124 -3.1124 -3.0743 -3.0743 -1.3147 -1.3147 -1.2586 -1.2586 -1.1271 -1.1271 -1.1223 -1.1223 4.1790 4.1790 4.4447 4.4447 4.8464 4.8464 4.8651 4.8651 4.9577 4.9577 4.9858 4.9858 5.1435 5.1435 5.2144 5.2144 5.2950 5.2950 5.4142 5.4142 5.5250 5.5250 5.5602 5.5602 7.8992 7.8992 7.9390 7.9390 8.0758 8.0758 8.0978 8.0978 8.1390 8.1390 8.2891 8.2891 8.8079 8.8079 9.0961 9.0961 9.1443 9.1443 9.1748 9.1748 9.1892 9.1892 9.2281 9.2281 11.3517 11.3517 11.3820 11.3820 11.5046 11.5046 11.5356 11.5356 14.8595 14.8595 14.8945 14.8945 k = 0.1364 0.0787 0.5940 ( 4812 PWs) bands (ev): -16.3617 -16.3617 -16.3252 -16.3252 -8.8979 -8.8979 -8.6298 -8.6298 -7.9596 -7.9596 -7.9366 -7.9366 -7.6613 -7.6613 -7.6371 -7.6371 -3.1048 -3.1048 -3.0668 -3.0668 -1.3053 -1.3053 -1.2510 -1.2510 -1.1157 -1.1157 -1.1110 -1.1110 4.1837 4.1837 4.4496 4.4496 4.8447 4.8447 4.8654 4.8654 4.9521 4.9521 4.9854 4.9854 5.1205 5.1205 5.2011 5.2011 5.2826 5.2826 5.4124 5.4124 5.5200 5.5200 5.5687 5.5687 7.8829 7.8829 7.9312 7.9312 8.0640 8.0640 8.0813 8.0813 8.1309 8.1309 8.2772 8.2772 8.8110 8.8110 9.0816 9.0816 9.1332 9.1332 9.1735 9.1735 9.1888 9.1888 9.2333 9.2333 11.3462 11.3462 11.3831 11.3831 11.4982 11.4982 11.5363 11.5363 14.8857 14.8857 14.9239 14.9239 k = 0.1515 0.0875 0.5940 ( 4824 PWs) bands (ev): -16.3612 -16.3612 -16.3247 -16.3247 -8.8986 -8.8986 -8.6304 -8.6304 -7.9655 -7.9655 -7.9381 -7.9381 -7.6678 -7.6678 -7.6386 -7.6386 -3.0965 -3.0965 -3.0586 -3.0586 -1.2952 -1.2952 -1.2429 -1.2429 -1.1035 -1.1035 -1.0980 -1.0980 4.1887 4.1887 4.4547 4.4547 4.8427 4.8427 4.8657 4.8657 4.9452 4.9452 4.9851 4.9851 5.0953 5.0953 5.1879 5.1879 5.2704 5.2704 5.4098 5.4098 5.5148 5.5148 5.5769 5.5769 7.8652 7.8652 7.9218 7.9218 8.0509 8.0509 8.0646 8.0646 8.1214 8.1214 8.2652 8.2652 8.8140 8.8140 9.0665 9.0665 9.1215 9.1215 9.1721 9.1721 9.1881 9.1881 9.2387 9.2387 11.3400 11.3400 11.3843 11.3843 11.4910 11.4910 11.5370 11.5370 14.9150 14.9150 14.9534 14.9534 k = 0.1667 0.0962 0.5940 ( 4816 PWs) bands (ev): -16.3607 -16.3607 -16.3242 -16.3242 -8.8994 -8.8994 -8.6311 -8.6311 -7.9720 -7.9720 -7.9396 -7.9396 -7.6748 -7.6748 -7.6402 -7.6402 -3.0877 -3.0877 -3.0498 -3.0498 -1.2847 -1.2847 -1.2345 -1.2345 -1.0905 -1.0905 -1.0835 -1.0835 4.1941 4.1941 4.4601 4.4601 4.8404 4.8404 4.8662 4.8662 4.9371 4.9371 4.9849 4.9849 5.0683 5.0683 5.1749 5.1749 5.2582 5.2582 5.4065 5.4065 5.5096 5.5096 5.5846 5.5846 7.8462 7.8462 7.9108 7.9108 8.0345 8.0345 8.0500 8.0500 8.1104 8.1104 8.2536 8.2536 8.8171 8.8171 9.0509 9.0509 9.1095 9.1095 9.1707 9.1707 9.1875 9.1875 9.2445 9.2445 11.3332 11.3332 11.3854 11.3854 11.4831 11.4831 11.5378 11.5378 14.9472 14.9472 14.9851 14.9851 k = 0.1818 0.1050 0.5940 ( 4816 PWs) bands (ev): -16.3602 -16.3602 -16.3237 -16.3237 -8.9002 -8.9002 -8.6317 -8.6317 -7.9788 -7.9788 -7.9411 -7.9411 -7.6822 -7.6822 -7.6418 -7.6418 -3.0784 -3.0784 -3.0406 -3.0406 -1.2738 -1.2738 -1.2258 -1.2258 -1.0765 -1.0765 -1.0676 -1.0676 4.1996 4.1996 4.4655 4.4655 4.8378 4.8378 4.8667 4.8667 4.9276 4.9276 4.9847 4.9847 5.0399 5.0399 5.1624 5.1624 5.2460 5.2460 5.4024 5.4024 5.5045 5.5045 5.5920 5.5920 7.8260 7.8260 7.8981 7.8981 8.0144 8.0144 8.0387 8.0387 8.0980 8.0980 8.2427 8.2427 8.8199 8.8199 9.0349 9.0349 9.0975 9.0975 9.1691 9.1691 9.1867 9.1867 9.2505 9.2505 11.3257 11.3257 11.3866 11.3866 11.4746 11.4746 11.5384 11.5384 14.9824 14.9824 15.0193 15.0193 k = 0.1970 0.1137 0.5940 ( 4828 PWs) bands (ev): -16.3596 -16.3596 -16.3232 -16.3232 -8.9010 -8.9010 -8.6324 -8.6324 -7.9859 -7.9859 -7.9428 -7.9428 -7.6898 -7.6898 -7.6436 -7.6436 -3.0687 -3.0687 -3.0310 -3.0310 -1.2626 -1.2626 -1.2168 -1.2168 -1.0615 -1.0615 -1.0505 -1.0505 4.2053 4.2053 4.4708 4.4708 4.8347 4.8347 4.8673 4.8673 4.9168 4.9168 4.9843 4.9843 5.0107 5.0107 5.1506 5.1506 5.2339 5.2339 5.3975 5.3975 5.4997 5.4997 5.5991 5.5991 7.8047 7.8047 7.8839 7.8839 7.9919 7.9919 8.0294 8.0294 8.0842 8.0842 8.2325 8.2325 8.8225 8.8225 9.0186 9.0186 9.0856 9.0856 9.1675 9.1675 9.1859 9.1859 9.2566 9.2566 11.3177 11.3177 11.3877 11.3877 11.4654 11.4654 11.5390 11.5390 15.0205 15.0205 15.0563 15.0563 k = 0.2121 0.1225 0.5940 ( 4832 PWs) bands (ev): -16.3590 -16.3590 -16.3226 -16.3226 -8.9018 -8.9018 -8.6331 -8.6331 -7.9932 -7.9932 -7.9444 -7.9444 -7.6978 -7.6978 -7.6454 -7.6454 -3.0588 -3.0588 -3.0212 -3.0212 -1.2514 -1.2514 -1.2078 -1.2078 -1.0456 -1.0456 -1.0325 -1.0325 4.2110 4.2110 4.4759 4.4759 4.8311 4.8311 4.8680 4.8680 4.9048 4.9048 4.9781 4.9781 4.9868 4.9868 5.1396 5.1396 5.2218 5.2218 5.3917 5.3917 5.4953 5.4953 5.6058 5.6058 7.7826 7.7826 7.8685 7.8685 7.9681 7.9681 8.0214 8.0214 8.0692 8.0692 8.2231 8.2231 8.8247 8.8247 9.0024 9.0024 9.0742 9.0742 9.1658 9.1658 9.1849 9.1849 9.2630 9.2630 11.3092 11.3092 11.3887 11.3887 11.4558 11.4558 11.5396 11.5396 15.0613 15.0613 15.0958 15.0958 k = 0.2273 0.1312 0.5940 ( 4836 PWs) bands (ev): -16.3584 -16.3584 -16.3221 -16.3221 -8.9027 -8.9027 -8.6339 -8.6339 -8.0006 -8.0006 -7.9461 -7.9461 -7.7058 -7.7058 -7.6472 -7.6472 -3.0486 -3.0486 -3.0111 -3.0111 -1.2402 -1.2402 -1.1987 -1.1987 -1.0289 -1.0289 -1.0136 -1.0136 4.2166 4.2166 4.4807 4.4807 4.8271 4.8271 4.8684 4.8684 4.8923 4.8923 4.9495 4.9495 4.9852 4.9852 5.1295 5.1295 5.2098 5.2098 5.3852 5.3852 5.4913 5.4913 5.6122 5.6122 7.7598 7.7598 7.8520 7.8520 7.9433 7.9433 8.0144 8.0144 8.0533 8.0533 8.2146 8.2146 8.8264 8.8264 8.9862 8.9862 9.0634 9.0634 9.1641 9.1641 9.1839 9.1839 9.2696 9.2696 11.3003 11.3003 11.3895 11.3895 11.4457 11.4457 11.5400 11.5400 15.1048 15.1048 15.1378 15.1378 k = 0.2424 0.1400 0.5940 ( 4832 PWs) bands (ev): -16.3578 -16.3578 -16.3215 -16.3215 -8.9036 -8.9036 -8.6346 -8.6346 -8.0082 -8.0082 -7.9478 -7.9478 -7.7140 -7.7140 -7.6490 -7.6490 -3.0384 -3.0384 -3.0009 -3.0009 -1.2291 -1.2291 -1.1896 -1.1896 -1.0115 -1.0115 -0.9942 -0.9942 4.2221 4.2221 4.4850 4.4850 4.8222 4.8222 4.8677 4.8677 4.8803 4.8803 4.9196 4.9196 4.9851 4.9851 5.1204 5.1204 5.1979 5.1979 5.3779 5.3779 5.4878 5.4878 5.6183 5.6183 7.7366 7.7366 7.8348 7.8348 7.9178 7.9178 8.0081 8.0081 8.0368 8.0368 8.2069 8.2069 8.8274 8.8274 8.9703 8.9703 9.0534 9.0534 9.1623 9.1623 9.1829 9.1829 9.2762 9.2762 11.2910 11.2910 11.3903 11.3903 11.4353 11.4353 11.5404 11.5404 15.1507 15.1507 15.1822 15.1822 k = 0.2576 0.1487 0.5940 ( 4826 PWs) bands (ev): -16.3572 -16.3572 -16.3209 -16.3209 -8.9044 -8.9044 -8.6353 -8.6353 -8.0157 -8.0157 -7.9495 -7.9495 -7.7221 -7.7221 -7.6509 -7.6509 -3.0281 -3.0281 -2.9908 -2.9908 -1.2181 -1.2181 -1.1806 -1.1806 -0.9935 -0.9935 -0.9743 -0.9743 4.2274 4.2274 4.4885 4.4885 4.8162 4.8162 4.8616 4.8616 4.8732 4.8732 4.8910 4.8910 4.9851 4.9851 5.1122 5.1122 5.1862 5.1862 5.3701 5.3701 5.4849 5.4849 5.6241 5.6241 7.7130 7.7130 7.8172 7.8172 7.8920 7.8920 8.0024 8.0024 8.0202 8.0202 8.1999 8.1999 8.8277 8.8277 8.9547 8.9547 9.0445 9.0445 9.1606 9.1606 9.1818 9.1818 9.2828 9.2828 11.2816 11.2816 11.3909 11.3909 11.4248 11.4248 11.5407 11.5407 15.1988 15.1988 15.2287 15.2287 k = 0.2727 0.1575 0.5940 ( 4826 PWs) bands (ev): -16.3566 -16.3566 -16.3203 -16.3203 -8.9053 -8.9053 -8.6360 -8.6360 -8.0232 -8.0232 -7.9512 -7.9512 -7.7302 -7.7302 -7.6527 -7.6527 -3.0180 -3.0180 -2.9807 -2.9807 -1.2075 -1.2075 -1.1717 -1.1717 -0.9752 -0.9752 -0.9542 -0.9542 4.2323 4.2323 4.4912 4.4912 4.8086 4.8086 4.8503 4.8503 4.8590 4.8590 4.8766 4.8766 4.9852 4.9852 5.1048 5.1048 5.1747 5.1747 5.3617 5.3617 5.4825 5.4825 5.6297 5.6297 7.6895 7.6895 7.7994 7.7994 7.8660 7.8660 7.9958 7.9958 8.0048 8.0048 8.1936 8.1936 8.8271 8.8271 8.9396 8.9396 9.0368 9.0368 9.1588 9.1588 9.1807 9.1807 9.2895 9.2895 11.2720 11.2720 11.3913 11.3913 11.4142 11.4142 11.5408 11.5408 15.2489 15.2489 15.2770 15.2770 k = 0.2879 0.1662 0.5940 ( 4822 PWs) bands (ev): -16.3560 -16.3560 -16.3198 -16.3198 -8.9061 -8.9061 -8.6367 -8.6367 -8.0306 -8.0306 -7.9529 -7.9529 -7.7382 -7.7382 -7.6545 -7.6545 -3.0079 -3.0079 -2.9708 -2.9708 -1.1972 -1.1972 -1.1630 -1.1630 -0.9567 -0.9567 -0.9341 -0.9341 4.2368 4.2368 4.4928 4.4928 4.7988 4.7988 4.8299 4.8299 4.8431 4.8431 4.8762 4.8762 4.9852 4.9852 5.0979 5.0979 5.1638 5.1638 5.3530 5.3530 5.4807 5.4807 5.6351 5.6351 7.6660 7.6660 7.7818 7.7818 7.8402 7.8402 7.9835 7.9835 7.9961 7.9961 8.1878 8.1878 8.8257 8.8257 8.9251 8.9251 9.0304 9.0304 9.1570 9.1570 9.1796 9.1796 9.2961 9.2961 11.2623 11.2623 11.3911 11.3911 11.4041 11.4041 11.5409 11.5409 15.3008 15.3008 15.3268 15.3268 k = 0.3030 0.1750 0.5940 ( 4834 PWs) bands (ev): -16.3554 -16.3554 -16.3192 -16.3192 -8.9070 -8.9070 -8.6374 -8.6374 -8.0378 -8.0378 -7.9545 -7.9545 -7.7460 -7.7460 -7.6562 -7.6562 -2.9982 -2.9982 -2.9612 -2.9612 -1.1873 -1.1873 -1.1546 -1.1546 -0.9383 -0.9383 -0.9142 -0.9142 4.2406 4.2406 4.4932 4.4932 4.7862 4.7862 4.8053 4.8053 4.8348 4.8348 4.8771 4.8771 4.9853 4.9853 5.0915 5.0915 5.1534 5.1534 5.3441 5.3441 5.4794 5.4794 5.6402 5.6402 7.6429 7.6429 7.7643 7.7643 7.8149 7.8149 7.9678 7.9678 7.9914 7.9914 8.1825 8.1825 8.8234 8.8234 8.9113 8.9113 9.0253 9.0253 9.1553 9.1553 9.1785 9.1785 9.3025 9.3025 11.2527 11.2527 11.3883 11.3883 11.3966 11.3966 11.5409 11.5409 15.3540 15.3540 15.3776 15.3776 k = 0.3182 0.1837 0.5940 ( 4834 PWs) bands (ev): -16.3548 -16.3548 -16.3187 -16.3187 -8.9077 -8.9077 -8.6380 -8.6380 -8.0447 -8.0447 -7.9561 -7.9561 -7.7534 -7.7534 -7.6579 -7.6579 -2.9888 -2.9888 -2.9519 -2.9519 -1.1779 -1.1779 -1.1464 -1.1464 -0.9200 -0.9200 -0.8946 -0.8946 4.2439 4.2439 4.4922 4.4922 4.7689 4.7689 4.7858 4.7858 4.8285 4.8285 4.8782 4.8782 4.9855 4.9855 5.0852 5.0852 5.1439 5.1439 5.3352 5.3352 5.4785 5.4785 5.6451 5.6451 7.6204 7.6204 7.7473 7.7473 7.7905 7.7905 7.9522 7.9522 7.9878 7.9878 8.1777 8.1777 8.8204 8.8204 8.8983 8.8983 9.0214 9.0214 9.1536 9.1536 9.1774 9.1774 9.3088 9.3088 11.2432 11.2432 11.3801 11.3801 11.3945 11.3945 11.5409 11.5409 15.4080 15.4080 15.4287 15.4287 k = 0.3333 0.1925 0.5940 ( 4838 PWs) bands (ev): -16.3543 -16.3543 -16.3181 -16.3181 -8.9085 -8.9085 -8.6386 -8.6386 -8.0513 -8.0513 -7.9576 -7.9576 -7.7606 -7.7606 -7.6596 -7.6596 -2.9798 -2.9798 -2.9430 -2.9430 -1.1690 -1.1690 -1.1387 -1.1387 -0.9023 -0.9023 -0.8757 -0.8757 4.2464 4.2464 4.4899 4.4899 4.7476 4.7476 4.7721 4.7721 4.8234 4.8234 4.8794 4.8794 4.9856 4.9856 5.0789 5.0789 5.1354 5.1354 5.3264 5.3264 5.4780 5.4780 5.6498 5.6498 7.5987 7.5987 7.7306 7.7306 7.7673 7.7673 7.9372 7.9372 7.9846 7.9846 8.1733 8.1733 8.8168 8.8168 8.8861 8.8861 9.0186 9.0186 9.1520 9.1520 9.1763 9.1763 9.3148 9.3148 11.2340 11.2340 11.3704 11.3704 11.3942 11.3942 11.5408 11.5408 15.4616 15.4616 15.4789 15.4789 k = 0.3485 0.2012 0.5940 ( 4824 PWs) bands (ev): -16.3538 -16.3538 -16.3177 -16.3177 -8.9092 -8.9092 -8.6392 -8.6392 -8.0576 -8.0576 -7.9590 -7.9590 -7.7673 -7.7673 -7.6611 -7.6611 -2.9714 -2.9714 -2.9346 -2.9346 -1.1606 -1.1606 -1.1314 -1.1314 -0.8852 -0.8852 -0.8576 -0.8576 4.2482 4.2482 4.4863 4.4863 4.7263 4.7263 4.7613 4.7613 4.8191 4.8191 4.8807 4.8807 4.9857 4.9857 5.0725 5.0725 5.1280 5.1280 5.3178 5.3178 5.4780 5.4780 5.6542 5.6542 7.5781 7.5781 7.7143 7.7143 7.7458 7.7458 7.9232 7.9232 7.9818 7.9818 8.1693 8.1693 8.8128 8.8128 8.8748 8.8748 9.0169 9.0169 9.1504 9.1504 9.1753 9.1753 9.3206 9.3206 11.2252 11.2252 11.3609 11.3609 11.3942 11.3942 11.5406 11.5406 15.5122 15.5122 15.5277 15.5277 k = 0.3636 0.2099 0.5940 ( 4824 PWs) bands (ev): -16.3533 -16.3533 -16.3172 -16.3172 -8.9099 -8.9099 -8.6397 -8.6397 -8.0634 -8.0634 -7.9604 -7.9604 -7.7736 -7.7736 -7.6625 -7.6625 -2.9635 -2.9635 -2.9268 -2.9268 -1.1529 -1.1529 -1.1246 -1.1246 -0.8689 -0.8689 -0.8405 -0.8405 4.2493 4.2493 4.4815 4.4815 4.7065 4.7065 4.7522 4.7522 4.8154 4.8154 4.8820 4.8820 4.9859 4.9859 5.0660 5.0660 5.1219 5.1219 5.3096 5.3096 5.4782 5.4782 5.6583 5.6583 7.5586 7.5586 7.6981 7.6981 7.7266 7.7266 7.9101 7.9101 7.9793 7.9793 8.1657 8.1657 8.8085 8.8085 8.8645 8.8645 9.0160 9.0160 9.1490 9.1490 9.1744 9.1744 9.3260 9.3260 11.2169 11.2169 11.3518 11.3518 11.3941 11.3941 11.5404 11.5404 15.5563 15.5563 15.5750 15.5750 k = 0.3788 0.2187 0.5940 ( 4832 PWs) bands (ev): -16.3529 -16.3529 -16.3168 -16.3168 -8.9105 -8.9105 -8.6402 -8.6402 -8.0688 -8.0688 -7.9616 -7.9616 -7.7794 -7.7794 -7.6638 -7.6638 -2.9562 -2.9562 -2.9197 -2.9197 -1.1459 -1.1459 -1.1184 -1.1184 -0.8538 -0.8538 -0.8247 -0.8247 4.2496 4.2496 4.4757 4.4757 4.6887 4.6887 4.7448 4.7448 4.8121 4.8121 4.8834 4.8834 4.9860 4.9860 5.0593 5.0593 5.1168 5.1168 5.3019 5.3019 5.4786 5.4786 5.6621 5.6621 7.5406 7.5406 7.6820 7.6820 7.7100 7.7100 7.8982 7.8982 7.9771 7.9771 8.1625 8.1625 8.8041 8.8041 8.8551 8.8551 9.0156 9.0156 9.1477 9.1477 9.1735 9.1735 9.3310 9.3310 11.2091 11.2091 11.3433 11.3433 11.3941 11.3941 11.5402 11.5402 15.5939 15.5939 15.6171 15.6171 k = 0.3939 0.2274 0.5940 ( 4832 PWs) bands (ev): -16.3525 -16.3525 -16.3164 -16.3164 -8.9110 -8.9110 -8.6406 -8.6406 -8.0736 -8.0736 -7.9627 -7.9627 -7.7846 -7.7846 -7.6650 -7.6650 -2.9497 -2.9497 -2.9132 -2.9132 -1.1396 -1.1396 -1.1127 -1.1127 -0.8399 -0.8399 -0.8102 -0.8102 4.2493 4.2493 4.4695 4.4695 4.6731 4.6731 4.7389 4.7389 4.8092 4.8092 4.8846 4.8846 4.9862 4.9862 5.0528 5.0528 5.1128 5.1128 5.2948 5.2948 5.4792 5.4792 5.6656 5.6656 7.5242 7.5242 7.6664 7.6664 7.6961 7.6961 7.8876 7.8876 7.9751 7.9751 8.1596 8.1596 8.7999 8.7999 8.8467 8.8467 9.0157 9.0157 9.1465 9.1465 9.1727 9.1727 9.3355 9.3355 11.2021 11.2021 11.3355 11.3355 11.3941 11.3941 11.5400 11.5400 15.6268 15.6268 15.6520 15.6520 k = 0.4091 0.2362 0.5940 ( 4832 PWs) bands (ev): -16.3521 -16.3521 -16.3161 -16.3161 -8.9115 -8.9115 -8.6410 -8.6410 -8.0779 -8.0779 -7.9637 -7.9637 -7.7892 -7.7892 -7.6660 -7.6660 -2.9439 -2.9439 -2.9075 -2.9075 -1.1340 -1.1340 -1.1077 -1.1077 -0.8275 -0.8275 -0.7973 -0.7973 4.2485 4.2485 4.4630 4.4630 4.6598 4.6598 4.7342 4.7342 4.8066 4.8066 4.8858 4.8858 4.9863 4.9863 5.0466 5.0466 5.1097 5.1097 5.2884 5.2884 5.4799 5.4799 5.6687 5.6687 7.5096 7.5096 7.6517 7.6517 7.6846 7.6846 7.8782 7.8782 7.9735 7.9735 8.1571 8.1571 8.7959 8.7959 8.8394 8.8394 9.0161 9.0161 9.1454 9.1454 9.1720 9.1720 9.3396 9.3396 11.1957 11.1957 11.3286 11.3286 11.3940 11.3940 11.5397 11.5397 15.6553 15.6553 15.6811 15.6811 k = 0.4242 0.2449 0.5940 ( 4830 PWs) bands (ev): -16.3518 -16.3518 -16.3158 -16.3158 -8.9119 -8.9119 -8.6413 -8.6413 -8.0815 -8.0815 -7.9645 -7.9645 -7.7931 -7.7931 -7.6669 -7.6669 -2.9389 -2.9389 -2.9026 -2.9026 -1.1293 -1.1293 -1.1034 -1.1034 -0.8167 -0.8167 -0.7860 -0.7860 4.2474 4.2474 4.4567 4.4567 4.6488 4.6488 4.7308 4.7308 4.8045 4.8045 4.8870 4.8870 4.9864 4.9864 5.0409 5.0409 5.1072 5.1072 5.2829 5.2829 5.4806 5.4806 5.6715 5.6715 7.4969 7.4969 7.6385 7.6385 7.6751 7.6751 7.8702 7.8702 7.9721 7.9721 8.1550 8.1550 8.7924 8.7924 8.8333 8.8333 9.0167 9.0167 9.1445 9.1445 9.1713 9.1713 9.3431 9.3431 11.1902 11.1902 11.3225 11.3225 11.3940 11.3940 11.5395 11.5395 15.6797 15.6797 15.7055 15.7055 k = 0.4394 0.2537 0.5940 ( 4822 PWs) bands (ev): -16.3515 -16.3515 -16.3155 -16.3155 -8.9123 -8.9123 -8.6416 -8.6416 -8.0846 -8.0846 -7.9652 -7.9652 -7.7964 -7.7964 -7.6677 -7.6677 -2.9348 -2.9348 -2.8985 -2.8985 -1.1253 -1.1253 -1.0998 -1.0998 -0.8076 -0.8076 -0.7767 -0.7767 4.2461 4.2461 4.4511 4.4511 4.6400 4.6400 4.7282 4.7282 4.8027 4.8027 4.8879 4.8879 4.9866 4.9866 5.0360 5.0360 5.1055 5.1055 5.2782 5.2782 5.4813 5.4813 5.6738 5.6738 7.4863 7.4863 7.6273 7.6273 7.6675 7.6675 7.8637 7.8637 7.9709 7.9709 8.1533 8.1533 8.7893 8.7893 8.8282 8.8282 9.0173 9.0173 9.1437 9.1437 9.1708 9.1708 9.3460 9.3460 11.1857 11.1857 11.3175 11.3175 11.3939 11.3939 11.5394 11.5394 15.6998 15.6998 15.7254 15.7254 k = 0.4545 0.2624 0.5940 ( 4822 PWs) bands (ev): -16.3513 -16.3513 -16.3153 -16.3153 -8.9125 -8.9125 -8.6418 -8.6418 -8.0870 -8.0870 -7.9658 -7.9658 -7.7990 -7.7990 -7.6683 -7.6683 -2.9316 -2.9316 -2.8953 -2.8953 -1.1222 -1.1222 -1.0970 -1.0970 -0.8004 -0.8004 -0.7693 -0.7693 4.2449 4.2449 4.4463 4.4463 4.6333 4.6333 4.7264 4.7264 4.8013 4.8013 4.8888 4.8888 4.9867 4.9867 5.0320 5.0320 5.1041 5.1041 5.2745 5.2745 5.4819 5.4819 5.6756 5.6756 7.4780 7.4780 7.6183 7.6183 7.6617 7.6617 7.8585 7.8585 7.9700 7.9700 8.1519 8.1519 8.7869 8.7869 8.8242 8.8242 9.0179 9.0179 9.1431 9.1431 9.1704 9.1704 9.3484 9.3484 11.1820 11.1820 11.3136 11.3136 11.3939 11.3939 11.5392 11.5392 15.7157 15.7157 15.7409 15.7409 k = 0.4697 0.2712 0.5940 ( 4822 PWs) bands (ev): -16.3512 -16.3512 -16.3152 -16.3152 -8.9127 -8.9127 -8.6420 -8.6420 -8.0887 -8.0887 -7.9662 -7.9662 -7.8009 -7.8009 -7.6687 -7.6687 -2.9292 -2.9292 -2.8930 -2.8930 -1.1200 -1.1200 -1.0950 -1.0950 -0.7952 -0.7952 -0.7639 -0.7639 4.2439 4.2439 4.4427 4.4427 4.6285 4.6285 4.7252 4.7252 4.8003 4.8003 4.8894 4.8894 4.9868 4.9868 5.0290 5.0290 5.1033 5.1033 5.2719 5.2719 5.4824 5.4824 5.6769 5.6769 7.4719 7.4719 7.6117 7.6117 7.6575 7.6575 7.8548 7.8548 7.9694 7.9694 8.1509 8.1509 8.7851 8.7851 8.8214 8.8214 9.0183 9.0183 9.1427 9.1427 9.1701 9.1701 9.3500 9.3500 11.1794 11.1794 11.3107 11.3107 11.3938 11.3938 11.5391 11.5391 15.7271 15.7271 15.7521 15.7521 k = 0.4848 0.2799 0.5940 ( 4814 PWs) bands (ev): -16.3511 -16.3511 -16.3151 -16.3151 -8.9128 -8.9128 -8.6421 -8.6421 -8.0897 -8.0897 -7.9664 -7.9664 -7.8020 -7.8020 -7.6690 -7.6690 -2.9278 -2.9278 -2.8916 -2.8916 -1.1187 -1.1187 -1.0938 -1.0938 -0.7921 -0.7921 -0.7607 -0.7607 4.2432 4.2432 4.4405 4.4405 4.6257 4.6257 4.7245 4.7245 4.7997 4.7997 4.8898 4.8898 4.9868 4.9868 5.0271 5.0271 5.1027 5.1027 5.2703 5.2703 5.4827 5.4827 5.6777 5.6777 7.4683 7.4683 7.6077 7.6077 7.6551 7.6551 7.8526 7.8526 7.9690 7.9690 8.1504 8.1504 8.7840 8.7840 8.8197 8.8197 9.0186 9.0186 9.1425 9.1425 9.1700 9.1700 9.3511 9.3511 11.1778 11.1778 11.3090 11.3090 11.3938 11.3938 11.5391 11.5391 15.7340 15.7340 15.7588 15.7588 k = 0.5000 0.2887 0.5940 ( 4808 PWs) bands (ev): -16.3511 -16.3511 -16.3151 -16.3151 -8.9129 -8.9129 -8.6421 -8.6421 -8.0901 -8.0901 -7.9665 -7.9665 -7.8024 -7.8024 -7.6690 -7.6690 -2.9273 -2.9273 -2.8911 -2.8911 -1.1182 -1.1182 -1.0934 -1.0934 -0.7910 -0.7910 -0.7596 -0.7596 4.2430 4.2430 4.4397 4.4397 4.6248 4.6248 4.7243 4.7243 4.7995 4.7995 4.8899 4.8899 4.9869 4.9869 5.0265 5.0265 5.1026 5.1026 5.2697 5.2697 5.4828 5.4828 5.6780 5.6780 7.4671 7.4671 7.6064 7.6064 7.6543 7.6543 7.8519 7.8519 7.9689 7.9689 8.1502 8.1502 8.7836 8.7836 8.8191 8.8191 9.0187 9.0187 9.1424 9.1424 9.1699 9.1699 9.3514 9.3514 11.1773 11.1773 11.3084 11.3084 11.3938 11.3938 11.5391 11.5391 15.7363 15.7363 15.7610 15.7610 k = 0.5000 0.2887 0.5940 ( 4808 PWs) bands (ev): -16.3511 -16.3511 -16.3151 -16.3151 -8.9129 -8.9129 -8.6421 -8.6421 -8.0901 -8.0901 -7.9665 -7.9665 -7.8024 -7.8024 -7.6690 -7.6690 -2.9273 -2.9273 -2.8911 -2.8911 -1.1182 -1.1182 -1.0934 -1.0934 -0.7910 -0.7910 -0.7596 -0.7596 4.2430 4.2430 4.4397 4.4397 4.6248 4.6248 4.7243 4.7243 4.7995 4.7995 4.8899 4.8899 4.9869 4.9869 5.0265 5.0265 5.1026 5.1026 5.2697 5.2697 5.4828 5.4828 5.6780 5.6780 7.4671 7.4671 7.6064 7.6064 7.6543 7.6543 7.8519 7.8519 7.9689 7.9689 8.1502 8.1502 8.7836 8.7836 8.8191 8.8191 9.0187 9.0187 9.1424 9.1424 9.1699 9.1699 9.3514 9.3514 11.1773 11.1773 11.3084 11.3084 11.3938 11.3938 11.5391 11.5391 15.7363 15.7363 15.7610 15.7610 k = 0.4912 0.3039 0.5940 ( 4816 PWs) bands (ev): -16.3511 -16.3511 -16.3151 -16.3151 -8.9133 -8.9123 -8.6426 -8.6414 -8.0913 -8.0908 -7.9661 -7.9653 -7.8039 -7.8029 -7.6685 -7.6680 -2.9285 -2.9258 -2.8918 -2.8900 -1.1210 -1.1144 -1.0953 -1.0905 -0.7921 -0.7904 -0.7601 -0.7594 4.2433 4.2439 4.4399 4.4406 4.6235 4.6250 4.7229 4.7246 4.7975 4.8000 4.8892 4.8919 4.9837 4.9898 5.0208 5.0319 5.1008 5.1040 5.2690 5.2713 5.4821 5.4830 5.6771 5.6786 7.4675 7.4677 7.6066 7.6070 7.6535 7.6547 7.8507 7.8525 7.9673 7.9675 8.1482 8.1490 8.7823 8.7862 8.8162 8.8228 9.0167 9.0202 9.1401 9.1434 9.1671 9.1716 9.3511 9.3517 11.1769 11.1783 11.3081 11.3094 11.3931 11.3937 11.5383 11.5389 15.7323 15.7396 15.7569 15.7645 k = 0.4825 0.3191 0.5940 ( 4824 PWs) bands (ev): -16.3511 -16.3510 -16.3151 -16.3151 -8.9136 -8.9115 -8.6429 -8.6406 -8.0945 -8.0934 -7.9643 -7.9627 -7.8074 -7.8055 -7.6665 -7.6654 -2.9292 -2.9238 -2.8921 -2.8885 -1.1227 -1.1095 -1.0962 -1.0866 -0.7936 -0.7901 -0.7611 -0.7596 4.2449 4.2459 4.4411 4.4426 4.6210 4.6240 4.7206 4.7240 4.7941 4.7988 4.8898 4.8950 4.9803 4.9926 5.0149 5.0369 5.0987 5.1051 5.2692 5.2736 5.4807 5.4826 5.6758 5.6789 7.4688 7.4692 7.6076 7.6086 7.6526 7.6549 7.8490 7.8526 7.9628 7.9631 8.1431 8.1446 8.7822 8.7902 8.8142 8.8274 9.0141 9.0212 9.1367 9.1434 9.1633 9.1722 9.3509 9.3521 11.1771 11.1799 11.3083 11.3110 11.3916 11.3928 11.5366 11.5379 15.7279 15.7423 15.7525 15.7673 k = 0.4737 0.3343 0.5940 ( 4824 PWs) bands (ev): -16.3510 -16.3510 -16.3150 -16.3150 -8.9138 -8.9106 -8.6431 -8.6396 -8.0993 -8.0977 -7.9613 -7.9589 -7.8126 -7.8098 -7.6632 -7.6616 -2.9296 -2.9215 -2.8920 -2.8866 -1.1234 -1.1035 -1.0961 -1.0817 -0.7955 -0.7902 -0.7624 -0.7601 4.2476 4.2492 4.4434 4.4457 4.6174 4.6219 4.7174 4.7225 4.7896 4.7960 4.8918 4.8991 4.9766 4.9951 5.0092 5.0413 5.0964 5.1058 5.2701 5.2766 5.4788 5.4817 5.6743 5.6789 7.4711 7.4718 7.6092 7.6109 7.6517 7.6549 7.8468 7.8522 7.9554 7.9559 8.1350 8.1371 8.7834 8.7953 8.8131 8.8329 9.0111 9.0216 9.1321 9.1424 9.1584 9.1719 9.3507 9.3524 11.1778 11.1821 11.3092 11.3131 11.3894 11.3911 11.5341 11.5361 15.7234 15.7444 15.7479 15.7693 k = 0.4649 0.3494 0.5940 ( 4820 PWs) bands (ev): -16.3509 -16.3509 -16.3150 -16.3149 -8.9138 -8.9096 -8.6430 -8.6385 -8.1054 -8.1031 -7.9574 -7.9543 -7.8192 -7.8154 -7.6589 -7.6569 -2.9295 -2.9188 -2.8915 -2.8843 -1.1232 -1.0966 -1.0951 -1.0758 -0.7979 -0.7907 -0.7641 -0.7609 4.2515 4.2536 4.4468 4.4498 4.6129 4.6188 4.7133 4.7201 4.7843 4.7916 4.8947 4.9038 4.9724 4.9974 5.0038 5.0452 5.0942 5.1061 5.2718 5.2802 5.4764 5.4803 5.6726 5.6786 7.4744 7.4753 7.6114 7.6142 7.6510 7.6547 7.8442 7.8514 7.9452 7.9459 8.1241 8.1266 8.7857 8.8017 8.8126 8.8390 9.0077 9.0216 9.1265 9.1406 9.1526 9.1706 9.3506 9.3528 11.1792 11.1849 11.3106 11.3159 11.3865 11.3887 11.5309 11.5334 15.7192 15.7436 15.7460 15.7709 k = 0.4561 0.3646 0.5940 ( 4828 PWs) bands (ev): -16.3509 -16.3508 -16.3149 -16.3149 -8.9137 -8.9085 -8.6429 -8.6373 -8.1124 -8.1095 -7.9529 -7.9492 -7.8268 -7.8221 -7.6541 -7.6515 -2.9290 -2.9157 -2.8907 -2.8817 -1.1220 -1.0932 -1.0888 -1.0691 -0.8007 -0.7913 -0.7662 -0.7621 4.2565 4.2591 4.4511 4.4548 4.6074 4.6148 4.7084 4.7167 4.7783 4.7859 4.8983 4.9089 4.9674 4.9990 4.9993 5.0484 5.0921 5.1063 5.2740 5.2841 5.4734 5.4784 5.6706 5.6781 7.4787 7.4797 7.6139 7.6182 7.6507 7.6543 7.8412 7.8501 7.9326 7.9333 8.1105 8.1134 8.7890 8.8090 8.8127 8.8457 9.0039 9.0210 9.1199 9.1380 9.1459 9.1686 9.3505 9.3532 11.1810 11.1881 11.3126 11.3191 11.3828 11.3855 11.5268 11.5299 15.7156 15.7399 15.7474 15.7722 k = 0.4474 0.3798 0.5940 ( 4820 PWs) bands (ev): -16.3508 -16.3508 -16.3148 -16.3148 -8.9134 -8.9073 -8.6426 -8.6359 -8.1201 -8.1165 -7.9480 -7.9438 -7.8351 -7.8295 -7.6489 -7.6459 -2.9282 -2.9125 -2.8895 -2.8789 -1.1200 -1.0906 -1.0801 -1.0616 -0.8040 -0.7923 -0.7686 -0.7634 4.2625 4.2656 4.4563 4.4608 4.6012 4.6100 4.7028 4.7126 4.7719 4.7790 4.9025 4.9144 4.9617 4.9951 5.0006 5.0511 5.0902 5.1063 5.2767 5.2884 5.4699 5.4761 5.6685 5.6774 7.4838 7.4851 7.6162 7.6228 7.6514 7.6541 7.8379 7.8485 7.9176 7.9185 8.0947 8.0977 8.7931 8.8133 8.8172 8.8528 8.9997 9.0199 9.1125 9.1349 9.1386 9.1659 9.3506 9.3535 11.1834 11.1918 11.3150 11.3228 11.3786 11.3818 11.5221 11.5258 15.7127 15.7370 15.7490 15.7735 k = 0.4386 0.3950 0.5940 ( 4816 PWs) bands (ev): -16.3507 -16.3506 -16.3147 -16.3147 -8.9131 -8.9060 -8.6422 -8.6345 -8.1281 -8.1239 -7.9430 -7.9383 -7.8437 -7.8372 -7.6436 -7.6402 -2.9271 -2.9090 -2.8881 -2.8758 -1.1172 -1.0872 -1.0706 -1.0534 -0.8077 -0.7934 -0.7714 -0.7649 4.2694 4.2730 4.4622 4.4676 4.5944 4.6046 4.6964 4.7077 4.7651 4.7712 4.9068 4.9200 4.9553 4.9920 5.0014 5.0534 5.0887 5.1062 5.2796 5.2927 5.4660 5.4734 5.6663 5.6765 7.4899 7.4915 7.6180 7.6279 7.6536 7.6543 7.8343 7.8467 7.9007 7.9017 8.0768 8.0798 8.7977 8.8142 8.8261 8.8602 8.9953 9.0183 9.1045 9.1307 9.1316 9.1627 9.3507 9.3539 11.1861 11.1958 11.3179 11.3269 11.3740 11.3774 11.5169 11.5209 15.7109 15.7350 15.7510 15.7752 k = 0.4298 0.4102 0.5940 ( 4822 PWs) bands (ev): -16.3505 -16.3505 -16.3146 -16.3146 -8.9127 -8.9047 -8.6417 -8.6331 -8.1363 -8.1313 -7.9382 -7.9330 -7.8524 -7.8451 -7.6384 -7.6346 -2.9258 -2.9054 -2.8864 -2.8726 -1.1138 -1.0833 -1.0604 -1.0445 -0.8118 -0.7946 -0.7745 -0.7666 4.2771 4.2812 4.4689 4.4751 4.5871 4.5986 4.6895 4.7022 4.7580 4.7625 4.9109 4.9256 4.9486 4.9896 5.0015 5.0554 5.0873 5.1061 5.2825 5.2969 5.4618 5.4705 5.6640 5.6754 7.4969 7.4987 7.6190 7.6328 7.6555 7.6576 7.8304 7.8446 7.8819 7.8833 8.0571 8.0600 8.8026 8.8152 8.8354 8.8677 8.9907 9.0161 9.0960 9.1225 9.1280 9.1591 9.3509 9.3543 11.1891 11.2001 11.3212 11.3313 11.3688 11.3726 11.5112 11.5156 15.7101 15.7340 15.7535 15.7773 k = 0.4211 0.4254 0.5940 ( 4832 PWs) bands (ev): -16.3504 -16.3504 -16.3145 -16.3144 -8.9123 -8.9034 -8.6412 -8.6316 -8.1444 -8.1387 -7.9335 -7.9280 -7.8610 -7.8529 -7.6334 -7.6293 -2.9242 -2.9018 -2.8845 -2.8694 -1.1098 -1.0789 -1.0497 -1.0352 -0.8163 -0.7959 -0.7778 -0.7683 4.2855 4.2901 4.4761 4.4832 4.5794 4.5923 4.6821 4.6961 4.7508 4.7531 4.9144 4.9312 4.9422 4.9878 5.0009 5.0572 5.0860 5.1060 5.2855 5.3009 5.4573 5.4673 5.6617 5.6743 7.5047 7.5069 7.6192 7.6367 7.6586 7.6635 7.8259 7.8424 7.8617 7.8639 8.0361 8.0385 8.8074 8.8164 8.8450 8.8751 8.9861 9.0134 9.0873 9.1142 9.1245 9.1552 9.3511 9.3547 11.1924 11.2046 11.3246 11.3359 11.3634 11.3674 11.5051 11.5097 15.7104 15.7340 15.7567 15.7801 k = 0.4123 0.4406 0.5940 ( 4828 PWs) bands (ev): -16.3503 -16.3503 -16.3143 -16.3143 -8.9118 -8.9021 -8.6406 -8.6301 -8.1521 -8.1458 -7.9291 -7.9233 -7.8694 -7.8604 -7.6288 -7.6244 -2.9225 -2.8981 -2.8825 -2.8660 -1.1055 -1.0743 -1.0387 -1.0255 -0.8212 -0.7972 -0.7812 -0.7701 4.2945 4.2995 4.4838 4.4918 4.5716 4.5857 4.6743 4.6896 4.7433 4.7436 4.9164 4.9366 4.9371 4.9864 4.9998 5.0590 5.0846 5.1060 5.2884 5.3047 5.4526 5.4640 5.6595 5.6732 7.5134 7.5159 7.6189 7.6392 7.6642 7.6711 7.8197 7.8385 7.8421 7.8452 8.0140 8.0157 8.8115 8.8183 8.8547 8.8826 8.9815 9.0103 9.0786 9.1060 9.1212 9.1512 9.3514 9.3551 11.1958 11.2093 11.3283 11.3406 11.3579 11.3621 11.4988 11.5036 15.7118 15.7351 15.7607 15.7835 k = 0.4035 0.4558 0.5940 ( 4824 PWs) bands (ev): -16.3502 -16.3501 -16.3142 -16.3142 -8.9112 -8.9009 -8.6400 -8.6287 -8.1595 -8.1525 -7.9252 -7.9190 -7.8772 -7.8676 -7.6246 -7.6199 -2.9207 -2.8946 -2.8805 -2.8628 -1.1010 -1.0694 -1.0276 -1.0157 -0.8264 -0.7984 -0.7848 -0.7718 4.3037 4.3092 4.4917 4.5006 4.5637 4.5791 4.6664 4.6828 4.7332 4.7364 4.9155 4.9349 4.9418 4.9853 4.9983 5.0608 5.0831 5.1060 5.2911 5.3080 5.4479 5.4606 5.6575 5.6721 7.5228 7.5257 7.6184 7.6404 7.6720 7.6802 7.8076 7.8176 7.8318 7.8386 7.9912 7.9920 8.8140 8.8214 8.8641 8.8898 8.9772 9.0067 9.0702 9.0981 9.1182 9.1472 9.3518 9.3555 11.1993 11.2139 11.3320 11.3451 11.3524 11.3568 11.4924 11.4972 15.7140 15.7370 15.7652 15.7876 k = 0.3947 0.4710 0.5940 ( 4812 PWs) bands (ev): -16.3500 -16.3500 -16.3141 -16.3141 -8.9107 -8.8997 -8.6394 -8.6273 -8.1663 -8.1588 -7.9216 -7.9152 -7.8845 -7.8742 -7.6208 -7.6159 -2.9189 -2.8912 -2.8784 -2.8597 -1.0964 -1.0646 -1.0166 -1.0058 -0.8317 -0.7995 -0.7883 -0.7734 4.3130 4.3190 4.4997 4.5096 4.5560 4.5726 4.6584 4.6759 4.7231 4.7294 4.9116 4.9359 4.9467 4.9843 4.9965 5.0627 5.0815 5.1061 5.2934 5.3110 5.4434 5.4574 5.6556 5.6711 7.5331 7.5364 7.6180 7.6412 7.6814 7.6904 7.7882 7.7948 7.8255 7.8365 7.9677 7.9681 8.8150 8.8254 8.8730 8.8970 8.9733 9.0027 9.0622 9.0907 9.1157 9.1432 9.3523 9.3560 11.2027 11.2185 11.3356 11.3471 11.3477 11.3535 11.4861 11.4909 15.7170 15.7396 15.7703 15.7921 k = 0.3860 0.4862 0.5940 ( 4800 PWs) bands (ev): -16.3499 -16.3499 -16.3140 -16.3140 -8.9103 -8.8986 -8.6389 -8.6261 -8.1724 -8.1643 -7.9185 -7.9119 -7.8911 -7.8801 -7.6176 -7.6125 -2.9171 -2.8880 -2.8765 -2.8568 -1.0919 -1.0600 -1.0061 -0.9961 -0.8372 -0.8005 -0.7917 -0.7748 4.3222 4.3286 4.5076 4.5184 4.5485 4.5662 4.6506 4.6689 4.7132 4.7229 4.9065 4.9382 4.9513 4.9834 4.9946 5.0644 5.0796 5.1061 5.2955 5.3134 5.4392 5.4543 5.6540 5.6702 7.5440 7.5478 7.6179 7.6418 7.6919 7.7016 7.7658 7.7718 7.8222 7.8346 7.9431 7.9453 8.8153 8.8293 8.8809 8.9041 8.9699 8.9985 9.0549 9.0840 9.1137 9.1395 9.3527 9.3564 11.2059 11.2228 11.3381 11.3431 11.3442 11.3562 11.4801 11.4847 15.7206 15.7428 15.7758 15.7969 k = 0.3772 0.5014 0.5940 ( 4796 PWs) bands (ev): -16.3498 -16.3498 -16.3139 -16.3138 -8.9098 -8.8977 -8.6383 -8.6250 -8.1778 -8.1692 -7.9159 -7.9092 -7.8968 -7.8854 -7.6148 -7.6096 -2.9154 -2.8852 -2.8746 -2.8541 -1.0877 -1.0558 -0.9966 -0.9867 -0.8426 -0.8012 -0.7948 -0.7759 4.3308 4.3377 4.5151 4.5267 4.5416 4.5603 4.6431 4.6622 4.7040 4.7168 4.9014 4.9408 4.9554 4.9825 4.9928 5.0659 5.0777 5.1062 5.2972 5.3152 5.4353 5.4515 5.6526 5.6694 7.5557 7.5599 7.6184 7.6426 7.7029 7.7133 7.7429 7.7490 7.8203 7.8325 7.9186 7.9233 8.8152 8.8327 8.8875 8.9111 8.9670 8.9940 9.0485 9.0781 9.1121 9.1361 9.3532 9.3568 11.2088 11.2268 11.3359 11.3395 11.3438 11.3602 11.4746 11.4789 15.7244 15.7462 15.7813 15.8018 k = 0.3684 0.5166 0.5940 ( 4786 PWs) bands (ev): -16.3497 -16.3497 -16.3138 -16.3137 -8.9095 -8.8969 -8.6379 -8.6241 -8.1823 -8.1733 -7.9138 -7.9069 -7.9017 -7.8897 -7.6126 -7.6072 -2.9139 -2.8827 -2.8730 -2.8518 -1.0840 -1.0520 -0.9883 -0.9779 -0.8477 -0.8018 -0.7975 -0.7769 4.3387 4.3459 4.5218 4.5342 4.5354 4.5551 4.6363 4.6560 4.6956 4.7115 4.8969 4.9432 4.9591 4.9818 4.9911 5.0670 5.0760 5.1063 5.2985 5.3166 5.4321 5.4490 5.6516 5.6687 7.5679 7.5728 7.6194 7.6434 7.7132 7.7161 7.7281 7.7295 7.8193 7.8300 7.8947 7.9030 8.8149 8.8354 8.8926 8.9178 8.9647 8.9897 9.0430 9.0730 9.1110 9.1330 9.3537 9.3573 11.2112 11.2303 11.3322 11.3351 11.3463 11.3639 11.4698 11.4738 15.7282 15.7497 15.7866 15.8066 k = 0.3596 0.5318 0.5940 ( 4782 PWs) bands (ev): -16.3496 -16.3496 -16.3137 -16.3137 -8.9092 -8.8962 -8.6376 -8.6234 -8.1858 -8.1766 -7.9122 -7.9055 -7.9052 -7.8932 -7.6109 -7.6054 -2.9127 -2.8807 -2.8717 -2.8499 -1.0809 -1.0489 -0.9816 -0.9701 -0.8522 -0.8021 -0.7997 -0.7775 4.3452 4.3528 4.5275 4.5302 4.5398 4.5514 4.6304 4.6506 4.6887 4.7070 4.8932 4.9453 4.9621 4.9810 4.9897 5.0676 5.0747 5.1064 5.2995 5.3174 5.4296 5.4471 5.6508 5.6683 7.5805 7.5862 7.6211 7.6441 7.6947 7.7036 7.7286 7.7411 7.8188 7.8262 7.8720 7.8859 8.8145 8.8374 8.8962 8.9239 8.9631 8.9858 9.0388 9.0690 9.1103 9.1304 9.3541 9.3577 11.2132 11.2331 11.3290 11.3314 11.3484 11.3670 11.4658 11.4694 15.7318 15.7530 15.7913 15.8109 k = 0.3509 0.5470 0.5940 ( 4792 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9090 -8.8958 -8.6373 -8.6229 -8.1884 -8.1790 -7.9111 -7.9082 -7.9040 -7.8958 -7.6097 -7.6042 -2.9117 -2.8792 -2.8706 -2.8485 -1.0786 -1.0466 -0.9767 -0.9640 -0.8557 -0.8022 -0.8013 -0.7778 4.3502 4.3581 4.5262 4.5318 4.5419 4.5507 4.6260 4.6462 4.6834 4.7037 4.8905 4.9469 4.9643 4.9804 4.9886 5.0674 5.0741 5.1064 5.3001 5.3177 5.4278 5.4456 5.6502 5.6679 7.5934 7.6003 7.6236 7.6436 7.6724 7.6860 7.7393 7.7541 7.8185 7.8203 7.8518 7.8737 8.8141 8.8386 8.8985 8.9286 8.9621 8.9827 9.0358 9.0660 9.1100 9.1284 9.3544 9.3580 11.2145 11.2351 11.3266 11.3286 11.3500 11.3693 11.4629 11.4661 15.7347 15.7556 15.7952 15.8143 k = 0.3421 0.5622 0.5940 ( 4788 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9088 -8.8955 -8.6372 -8.6226 -8.1900 -8.1804 -7.9107 -7.9098 -7.9033 -7.8974 -7.6090 -7.6035 -2.9111 -2.8782 -2.8700 -2.8476 -1.0772 -1.0452 -0.9738 -0.9600 -0.8580 -0.8022 -0.8021 -0.7780 4.3533 4.3614 4.5238 4.5344 4.5412 4.5523 4.6232 4.6435 4.6802 4.7016 4.8888 4.9479 4.9658 4.9800 4.9879 5.0669 5.0740 5.1064 5.3004 5.3179 5.4268 5.4448 5.6500 5.6678 7.6058 7.6147 7.6270 7.6397 7.6510 7.6741 7.7483 7.7659 7.8135 7.8163 7.8377 7.8671 8.8138 8.8393 8.8998 8.9316 8.9616 8.9808 9.0340 9.0641 9.1099 9.1271 9.3546 9.3582 11.2152 11.2363 11.3252 11.3270 11.3509 11.3706 11.4612 11.4642 15.7367 15.7575 15.7977 15.8167 k = 0.3333 0.5774 0.5940 ( 4788 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9088 -8.8954 -8.6371 -8.6225 -8.1905 -8.1809 -7.9108 -7.9099 -7.9030 -7.8979 -7.6088 -7.6032 -2.9109 -2.8779 -2.8697 -2.8473 -1.0767 -1.0447 -0.9728 -0.9586 -0.8587 -0.8024 -0.8022 -0.7780 4.3544 4.3625 4.5230 4.5353 4.5407 4.5531 4.6223 4.6425 4.6791 4.7009 4.8883 4.9483 4.9663 4.9798 4.9876 5.0667 5.0740 5.1064 5.3005 5.3179 5.4264 5.4445 5.6499 5.6677 7.6130 7.6269 7.6322 7.6323 7.6346 7.6707 7.7521 7.7716 7.8100 7.8131 7.8336 7.8653 8.8136 8.8394 8.9001 8.9326 8.9614 8.9802 9.0335 9.0635 9.1099 9.1267 9.3547 9.3583 11.2155 11.2366 11.3247 11.3264 11.3512 11.3710 11.4606 11.4635 15.7375 15.7582 15.7987 15.8175 k = 0.3333 0.5774 0.5940 ( 4788 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9088 -8.8954 -8.6371 -8.6225 -8.1905 -8.1809 -7.9108 -7.9099 -7.9030 -7.8979 -7.6088 -7.6032 -2.9109 -2.8779 -2.8697 -2.8473 -1.0767 -1.0447 -0.9728 -0.9586 -0.8587 -0.8024 -0.8022 -0.7780 4.3544 4.3625 4.5230 4.5353 4.5407 4.5531 4.6223 4.6425 4.6791 4.7009 4.8883 4.9483 4.9663 4.9798 4.9876 5.0667 5.0740 5.1064 5.3005 5.3179 5.4264 5.4445 5.6499 5.6677 7.6130 7.6269 7.6322 7.6323 7.6346 7.6707 7.7521 7.7716 7.8100 7.8131 7.8336 7.8653 8.8136 8.8394 8.9001 8.9326 8.9614 8.9802 9.0335 9.0635 9.1099 9.1267 9.3547 9.3583 11.2155 11.2366 11.3247 11.3264 11.3512 11.3710 11.4606 11.4635 15.7375 15.7582 15.7987 15.8175 k = 0.3246 0.5622 0.5940 ( 4780 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9088 -8.8955 -8.6372 -8.6226 -8.1900 -8.1804 -7.9107 -7.9098 -7.9032 -7.8974 -7.6090 -7.6035 -2.9111 -2.8782 -2.8700 -2.8476 -1.0772 -1.0452 -0.9737 -0.9599 -0.8581 -0.8023 -0.8022 -0.7780 4.3534 4.3614 4.5238 4.5346 4.5413 4.5524 4.6232 4.6434 4.6802 4.7016 4.8888 4.9479 4.9658 4.9800 4.9879 5.0670 5.0739 5.1064 5.3005 5.3179 5.4267 5.4448 5.6499 5.6678 7.6051 7.6111 7.6355 7.6418 7.6461 7.6728 7.7483 7.7656 7.8140 7.8186 7.8357 7.8667 8.8138 8.8393 8.8999 8.9318 8.9616 8.9806 9.0340 9.0642 9.1099 9.1272 9.3546 9.3582 11.2153 11.2363 11.3252 11.3269 11.3510 11.3707 11.4612 11.4641 15.7366 15.7574 15.7976 15.8166 k = 0.3158 0.5470 0.5940 ( 4796 PWs) bands (ev): -16.3496 -16.3495 -16.3136 -16.3136 -8.9089 -8.8958 -8.6373 -8.6229 -8.1884 -8.1790 -7.9110 -7.9083 -7.9039 -7.8958 -7.6096 -7.6041 -2.9118 -2.8793 -2.8707 -2.8486 -1.0787 -1.0467 -0.9766 -0.9638 -0.8564 -0.8026 -0.8018 -0.7782 4.3505 4.3583 4.5261 4.5326 4.5425 4.5511 4.6255 4.6460 4.6832 4.7038 4.8904 4.9469 4.9642 4.9805 4.9886 5.0679 5.0739 5.1064 5.3003 5.3182 5.4275 5.4456 5.6501 5.6678 7.5913 7.5939 7.6410 7.6545 7.6618 7.6777 7.7394 7.7533 7.8240 7.8306 7.8410 7.8703 8.8143 8.8390 8.8991 8.9297 8.9618 8.9817 9.0354 9.0660 9.1099 9.1284 9.3543 9.3579 11.2148 11.2355 11.3264 11.3284 11.3504 11.3697 11.4627 11.4659 15.7339 15.7549 15.7943 15.8135 k = 0.3070 0.5318 0.5940 ( 4796 PWs) bands (ev): -16.3496 -16.3496 -16.3137 -16.3137 -8.9091 -8.8962 -8.6375 -8.6233 -8.1858 -8.1766 -7.9119 -7.9055 -7.9049 -7.8932 -7.6106 -7.6051 -2.9131 -2.8810 -2.8720 -2.8503 -1.0812 -1.0491 -0.9811 -0.9696 -0.8542 -0.8032 -0.8014 -0.7788 4.3462 4.3535 4.5290 4.5307 4.5422 4.5519 4.6290 4.6500 4.6881 4.7073 4.8930 4.9454 4.9617 4.9814 4.9897 5.0690 5.0745 5.1065 5.3001 5.3189 5.4288 5.4468 5.6503 5.6680 7.5777 7.5785 7.6472 7.6676 7.6779 7.6848 7.7293 7.7405 7.8370 7.8415 7.8515 7.8758 8.8153 8.8386 8.8980 8.9271 8.9621 8.9829 9.0375 9.0689 9.1099 9.1304 9.3537 9.3574 11.2143 11.2343 11.3283 11.3306 11.3497 11.3683 11.4651 11.4686 15.7291 15.7504 15.7884 15.8081 k = 0.2982 0.5166 0.5940 ( 4792 PWs) bands (ev): -16.3498 -16.3497 -16.3138 -16.3138 -8.9093 -8.8967 -8.6378 -8.6239 -8.1822 -8.1732 -7.9132 -7.9062 -7.9016 -7.8897 -7.6119 -7.6065 -2.9149 -2.8835 -2.8739 -2.8527 -1.0846 -1.0524 -0.9873 -0.9769 -0.8522 -0.8045 -0.8014 -0.7798 4.3406 4.3474 4.5266 4.5352 4.5393 4.5564 4.6333 4.6550 4.6945 4.7121 4.8964 4.9435 4.9585 4.9825 4.9912 5.0692 5.0766 5.1066 5.3001 5.3202 5.4302 5.4485 5.6505 5.6680 7.5652 7.5655 7.6539 7.6794 7.6941 7.6943 7.7204 7.7292 7.8495 7.8509 7.8672 7.8830 8.8168 8.8383 8.8967 8.9244 8.9625 8.9840 9.0403 9.0728 9.1102 9.1329 9.3529 9.3565 11.2139 11.2332 11.3308 11.3334 11.3491 11.3670 11.4682 11.4720 15.7220 15.7438 15.7798 15.8001 k = 0.2895 0.5014 0.5940 ( 4792 PWs) bands (ev): -16.3499 -16.3499 -16.3140 -16.3140 -8.9095 -8.8973 -8.6381 -8.6247 -8.1776 -8.1690 -7.9146 -7.9078 -7.8967 -7.8852 -7.6135 -7.6081 -2.9173 -2.8868 -2.8764 -2.8558 -1.0889 -1.0566 -0.9948 -0.9853 -0.8508 -0.8065 -0.8020 -0.7816 4.3344 4.3405 4.5237 4.5356 4.5414 4.5631 4.6383 4.6608 4.7021 4.7181 4.9004 4.9415 4.9546 4.9840 4.9930 5.0686 5.0803 5.1068 5.3002 5.3221 5.4319 5.4505 5.6506 5.6680 7.5541 7.5553 7.6608 7.6892 7.7025 7.7107 7.7171 7.7206 7.8574 7.8647 7.8845 7.8923 8.8188 8.8381 8.8951 8.9219 8.9628 8.9850 9.0434 9.0775 9.1107 9.1359 9.3517 9.3554 11.2137 11.2322 11.3337 11.3367 11.3488 11.3658 11.4717 11.4759 15.7123 15.7348 15.7682 15.7895 k = 0.2807 0.4862 0.5940 ( 4800 PWs) bands (ev): -16.3501 -16.3501 -16.3142 -16.3141 -8.9098 -8.8980 -8.6384 -8.6255 -8.1721 -8.1640 -7.9163 -7.9095 -7.8907 -7.8798 -7.6153 -7.6100 -2.9203 -2.8908 -2.8795 -2.8596 -1.0940 -1.0615 -1.0036 -0.9945 -0.8503 -0.8094 -0.8036 -0.7844 4.3276 4.3330 4.5210 4.5319 4.5489 4.5716 4.6437 4.6672 4.7106 4.7249 4.9046 4.9396 4.9502 4.9857 4.9949 5.0676 5.0853 5.1071 5.3006 5.3247 5.4337 5.4528 5.6505 5.6679 7.5454 7.5472 7.6676 7.6959 7.7043 7.7143 7.7265 7.7279 7.8659 7.8775 7.9025 7.9039 8.8213 8.8380 8.8933 8.9200 8.9632 8.9860 9.0470 9.0827 9.1115 9.1392 9.3501 9.3539 11.2139 11.2315 11.3368 11.3402 11.3489 11.3650 11.4757 11.4801 15.7000 15.7233 15.7538 15.7760 k = 0.2719 0.4710 0.5940 ( 4800 PWs) bands (ev): -16.3503 -16.3503 -16.3144 -16.3144 -8.9100 -8.8987 -8.6388 -8.6264 -8.1657 -8.1581 -7.9182 -7.9115 -7.8839 -7.8735 -7.6173 -7.6121 -2.9239 -2.8956 -2.8833 -2.8641 -1.0999 -1.0672 -1.0135 -1.0043 -0.8511 -0.8133 -0.8064 -0.7882 4.3207 4.3253 4.5188 4.5286 4.5577 4.5817 4.6495 4.6744 4.7197 4.7325 4.9085 4.9383 4.9455 4.9877 4.9969 5.0664 5.0911 5.1077 5.3013 5.3281 5.4354 5.4552 5.6502 5.6675 7.5393 7.5415 7.6739 7.6959 7.7107 7.7124 7.7410 7.7445 7.8751 7.8892 7.9178 7.9208 8.8245 8.8382 8.8912 8.9189 8.9636 8.9870 9.0508 9.0884 9.1125 9.1427 9.3482 9.3521 11.2146 11.2312 11.3401 11.3438 11.3498 11.3648 11.4799 11.4846 15.6851 15.7092 15.7363 15.7596 k = 0.2632 0.4558 0.5940 ( 4804 PWs) bands (ev): -16.3506 -16.3506 -16.3146 -16.3146 -8.9102 -8.8994 -8.6391 -8.6273 -8.1585 -8.1515 -7.9202 -7.9136 -7.8762 -7.8665 -7.6194 -7.6143 -2.9281 -2.9011 -2.8876 -2.8694 -1.1064 -1.0735 -1.0243 -1.0145 -0.8533 -0.8184 -0.8104 -0.7932 4.3137 4.3176 4.5171 4.5258 4.5678 4.5934 4.6559 4.6822 4.7292 4.7405 4.9112 4.9385 4.9406 4.9901 4.9988 5.0653 5.0978 5.1085 5.3023 5.3322 5.4370 5.4577 5.6497 5.6670 7.5357 7.5384 7.6794 7.6954 7.7145 7.7199 7.7565 7.7612 7.8851 7.9003 7.9333 7.9392 8.8284 8.8387 8.8889 8.9188 8.9642 8.9883 9.0549 9.0941 9.1139 9.1463 9.3459 9.3499 11.2160 11.2316 11.3434 11.3475 11.3513 11.3653 11.4842 11.4891 15.6674 15.6925 15.7158 15.7403 k = 0.2544 0.4406 0.5940 ( 4806 PWs) bands (ev): -16.3509 -16.3509 -16.3149 -16.3149 -8.9103 -8.9002 -8.6393 -8.6283 -8.1506 -8.1443 -7.9223 -7.9158 -7.8677 -7.8587 -7.6216 -7.6165 -2.9330 -2.9073 -2.8926 -2.8753 -1.1136 -1.0804 -1.0359 -1.0251 -0.8571 -0.8247 -0.8159 -0.7995 4.3068 4.3100 4.5160 4.5235 4.5793 4.6069 4.6628 4.6908 4.7388 4.7489 4.9121 4.9356 4.9407 4.9930 5.0005 5.0645 5.1052 5.1095 5.3037 5.3370 5.4384 5.4602 5.6489 5.6661 7.5348 7.5378 7.6846 7.6969 7.7203 7.7298 7.7723 7.7779 7.8957 7.9111 7.9497 7.9576 8.8327 8.8395 8.8862 8.9196 8.9650 8.9900 9.0593 9.1000 9.1156 9.1499 9.3432 9.3472 11.2180 11.2325 11.3467 11.3512 11.3537 11.3665 11.4885 11.4936 15.6469 15.6732 15.6924 15.7182 k = 0.2456 0.4254 0.5940 ( 4808 PWs) bands (ev): -16.3513 -16.3513 -16.3153 -16.3153 -8.9104 -8.9009 -8.6396 -8.6292 -8.1420 -8.1364 -7.9245 -7.9180 -7.8585 -7.8503 -7.6239 -7.6189 -2.9384 -2.9143 -2.8982 -2.8820 -1.1212 -1.0878 -1.0481 -1.0360 -0.8625 -0.8324 -0.8229 -0.8073 4.3001 4.3026 4.5152 4.5217 4.5925 4.6220 4.6705 4.7002 4.7484 4.7575 4.9111 4.9306 4.9446 4.9965 5.0020 5.0640 5.1110 5.1132 5.3056 5.3425 5.4397 5.4627 5.6477 5.6650 7.5365 7.5398 7.6905 7.7010 7.7288 7.7402 7.7882 7.7944 7.9069 7.9221 7.9667 7.9759 8.8369 8.8414 8.8834 8.9213 8.9661 8.9920 9.0639 9.1059 9.1176 9.1536 9.3401 9.3442 11.2207 11.2342 11.3500 11.3548 11.3569 11.3685 11.4929 11.4981 15.6238 15.6513 15.6663 15.6934 k = 0.2368 0.4102 0.5940 ( 4812 PWs) bands (ev): -16.3517 -16.3517 -16.3156 -16.3156 -8.9104 -8.9015 -8.6397 -8.6300 -8.1329 -8.1279 -7.9266 -7.9203 -7.8487 -7.8413 -7.6262 -7.6212 -2.9445 -2.9218 -2.9045 -2.8892 -1.1293 -1.0956 -1.0607 -1.0472 -0.8694 -0.8414 -0.8315 -0.8165 4.2935 4.2955 4.5148 4.5201 4.6073 4.6390 4.6791 4.7106 4.7579 4.7661 4.9089 4.9256 4.9493 5.0009 5.0030 5.0641 5.1128 5.1217 5.3079 5.3486 5.4408 5.4652 5.6463 5.6635 7.5409 7.5444 7.6979 7.7076 7.7389 7.7510 7.8041 7.8108 7.9187 7.9333 7.9839 7.9941 8.8392 8.8461 8.8804 8.9240 8.9676 8.9945 9.0687 9.1116 9.1198 9.1572 9.3365 9.3407 11.2241 11.2366 11.3535 11.3583 11.3606 11.3713 11.4972 11.5024 15.5982 15.6268 15.6374 15.6658 k = 0.2281 0.3950 0.5940 ( 4816 PWs) bands (ev): -16.3521 -16.3521 -16.3161 -16.3160 -8.9103 -8.9021 -8.6398 -8.6308 -8.1233 -8.1190 -7.9288 -7.9225 -7.8384 -7.8318 -7.6284 -7.6235 -2.9511 -2.9301 -2.9113 -2.8971 -1.1379 -1.1037 -1.0737 -1.0586 -0.8780 -0.8518 -0.8416 -0.8271 4.2872 4.2886 4.5144 4.5187 4.6237 4.6577 4.6888 4.7221 4.7671 4.7747 4.9061 4.9207 4.9542 5.0036 5.0062 5.0648 5.1152 5.1308 5.3107 5.3553 5.4417 5.4677 5.6444 5.6617 7.5479 7.5516 7.7073 7.7169 7.7501 7.7621 7.8199 7.8269 7.9310 7.9448 8.0011 8.0121 8.8404 8.8527 8.8772 8.9276 8.9696 8.9977 9.0737 9.1172 9.1224 9.1608 9.3325 9.3368 11.2283 11.2398 11.3571 11.3617 11.3650 11.3749 11.5014 11.5066 15.5700 15.6000 15.6059 15.6356 k = 0.2193 0.3798 0.5940 ( 4820 PWs) bands (ev): -16.3526 -16.3526 -16.3165 -16.3165 -8.9101 -8.9025 -8.6397 -8.6315 -8.1133 -8.1097 -7.9308 -7.9246 -7.8276 -7.8218 -7.6305 -7.6257 -2.9583 -2.9389 -2.9186 -2.9056 -1.1468 -1.1122 -1.0870 -1.0702 -0.8880 -0.8635 -0.8532 -0.8392 4.2809 4.2819 4.5140 4.5173 4.6419 4.6781 4.6997 4.7346 4.7761 4.7832 4.9030 4.9160 4.9587 5.0038 5.0126 5.0662 5.1180 5.1403 5.3140 5.3624 5.4425 5.4701 5.6423 5.6596 7.5573 7.5612 7.7189 7.7286 7.7621 7.7735 7.8356 7.8428 7.9437 7.9565 8.0184 8.0299 8.8411 8.8603 8.8739 8.9321 8.9723 9.0014 9.0789 9.1227 9.1252 9.1642 9.3282 9.3326 11.2331 11.2436 11.3606 11.3650 11.3701 11.3792 11.5054 11.5106 15.5396 15.5708 15.5720 15.6028 k = 0.2105 0.3646 0.5940 ( 4816 PWs) bands (ev): -16.3531 -16.3531 -16.3170 -16.3170 -8.9098 -8.9029 -8.6396 -8.6321 -8.1029 -8.1001 -7.9327 -7.9266 -7.8164 -7.8115 -7.6325 -7.6278 -2.9660 -2.9482 -2.9265 -2.9145 -1.1560 -1.1209 -1.1005 -1.0820 -0.8994 -0.8765 -0.8662 -0.8526 4.2748 4.2753 4.5133 4.5157 4.6617 4.7002 4.7121 4.7482 4.7849 4.7916 4.8998 4.9115 4.9626 5.0035 5.0201 5.0683 5.1215 5.1502 5.3178 5.3698 5.4431 5.4725 5.6397 5.6570 7.5692 7.5731 7.7326 7.7427 7.7747 7.7851 7.8511 7.8584 7.9568 7.9685 8.0356 8.0474 8.8417 8.8689 8.8705 8.9374 8.9758 9.0059 9.0843 9.1279 9.1282 9.1676 9.3235 9.3279 11.2386 11.2481 11.3640 11.3682 11.3760 11.3843 11.5092 11.5144 15.5069 15.5358 15.5394 15.5676 k = 0.2018 0.3494 0.5940 ( 4816 PWs) bands (ev): -16.3536 -16.3536 -16.3175 -16.3175 -8.9094 -8.9031 -8.6394 -8.6326 -8.0923 -8.0902 -7.9345 -7.9285 -7.8050 -7.8009 -7.6344 -7.6297 -2.9742 -2.9580 -2.9348 -2.9240 -1.1655 -1.1298 -1.1143 -1.0939 -0.9120 -0.8906 -0.8804 -0.8673 4.2687 4.2689 4.5123 4.5139 4.6830 4.7236 4.7259 4.7627 4.7937 4.7998 4.8967 4.9073 4.9659 5.0028 5.0287 5.0711 5.1255 5.1603 5.3220 5.3775 5.4438 5.4749 5.6368 5.6541 7.5832 7.5872 7.7483 7.7590 7.7877 7.7968 7.8665 7.8737 7.9702 7.9808 8.0526 8.0645 8.8419 8.8670 8.8783 8.9435 8.9802 9.0111 9.0898 9.1314 9.1330 9.1708 9.3184 9.3229 11.2448 11.2532 11.3671 11.3711 11.3826 11.3901 11.5127 11.5179 15.4723 15.4973 15.5061 15.5298 k = 0.1930 0.3343 0.5940 ( 4824 PWs) bands (ev): -16.3541 -16.3541 -16.3180 -16.3180 -8.9089 -8.9033 -8.6390 -8.6329 -8.0815 -8.0801 -7.9361 -7.9302 -7.7934 -7.7902 -7.6361 -7.6314 -2.9828 -2.9682 -2.9436 -2.9338 -1.1752 -1.1389 -1.1282 -1.1058 -0.9257 -0.9057 -0.8959 -0.8831 4.2626 4.2626 4.5106 4.5117 4.7053 4.7414 4.7479 4.7778 4.8028 4.8081 4.8938 4.9034 4.9686 5.0019 5.0381 5.0746 5.1303 5.1707 5.3267 5.3853 5.4446 5.4774 5.6336 5.6508 7.5993 7.6033 7.7658 7.7773 7.8013 7.8086 7.8816 7.8887 7.9839 7.9931 8.0696 8.0813 8.8418 8.8634 8.8885 8.9503 8.9855 9.0170 9.0954 9.1347 9.1378 9.1738 9.3130 9.3175 11.2514 11.2588 11.3699 11.3739 11.3898 11.3964 11.5161 11.5211 15.4358 15.4566 15.4708 15.4892 k = 0.1842 0.3191 0.5940 ( 4830 PWs) bands (ev): -16.3547 -16.3547 -16.3185 -16.3185 -8.9083 -8.9033 -8.6386 -8.6332 -8.0706 -8.0699 -7.9376 -7.9317 -7.7817 -7.7793 -7.6376 -7.6329 -2.9918 -2.9787 -2.9527 -2.9440 -1.1851 -1.1481 -1.1423 -1.1178 -0.9403 -0.9217 -0.9123 -0.8999 4.2563 4.2564 4.5084 4.5089 4.7278 4.7588 4.7716 4.7937 4.8132 4.8164 4.8912 4.8999 4.9708 5.0007 5.0483 5.0788 5.1357 5.1812 5.3319 5.3929 5.4457 5.4799 5.6301 5.6472 7.6172 7.6212 7.7846 7.7974 7.8154 7.8205 7.8966 7.9034 7.9977 8.0056 8.0863 8.0977 8.8412 8.8596 8.8996 8.9580 8.9919 9.0236 9.1011 9.1382 9.1425 9.1766 9.3073 9.3118 11.2585 11.2649 11.3725 11.3763 11.3977 11.4034 11.5192 11.5240 15.3976 15.4137 15.4338 15.4452 k = 0.1754 0.3039 0.5940 ( 4832 PWs) bands (ev): -16.3553 -16.3553 -16.3191 -16.3191 -8.9077 -8.9032 -8.6381 -8.6333 -8.0597 -8.0597 -7.9388 -7.9330 -7.7700 -7.7683 -7.6389 -7.6342 -3.0012 -2.9895 -2.9622 -2.9545 -1.1952 -1.1573 -1.1564 -1.1297 -0.9557 -0.9384 -0.9295 -0.9176 4.2500 4.2502 4.5055 4.5057 4.7494 4.7786 4.7909 4.8120 4.8252 4.8263 4.8894 4.8969 4.9726 4.9994 5.0592 5.0837 5.1419 5.1919 5.3374 5.4002 5.4474 5.4826 5.6262 5.6432 7.6367 7.6407 7.8041 7.8189 7.8304 7.8323 7.9115 7.9178 8.0116 8.0181 8.1030 8.1139 8.8403 8.8558 8.9114 8.9664 8.9993 9.0309 9.1068 9.1418 9.1469 9.1793 9.3014 9.3059 11.2660 11.2715 11.3747 11.3785 11.4061 11.4109 11.5220 11.5267 15.3579 15.3683 15.3949 15.3976 k = 0.1667 0.2887 0.5940 ( 4830 PWs) bands (ev): -16.3559 -16.3559 -16.3197 -16.3197 -8.9069 -8.9030 -8.6375 -8.6333 -8.0495 -8.0489 -7.9398 -7.9340 -7.7584 -7.7574 -7.6399 -7.6353 -3.0108 -3.0005 -2.9719 -2.9651 -1.2055 -1.1706 -1.1666 -1.1416 -0.9715 -0.9557 -0.9473 -0.9359 4.2436 4.2440 4.5020 4.5021 4.7686 4.8011 4.8033 4.8325 4.8347 4.8435 4.8892 4.8947 4.9740 4.9980 5.0706 5.0894 5.1488 5.2025 5.3433 5.4067 5.4498 5.4854 5.6221 5.6389 7.6576 7.6615 7.8232 7.8406 7.8450 7.8470 7.9262 7.9320 8.0254 8.0304 8.1194 8.1297 8.8390 8.8519 8.9240 8.9756 9.0077 9.0390 9.1125 9.1454 9.1511 9.1817 9.2952 9.2997 11.2737 11.2784 11.3767 11.3803 11.4149 11.4188 11.5245 11.5290 15.3167 15.3203 15.3476 15.3522 k = 0.1579 0.2735 0.5940 ( 4818 PWs) bands (ev): -16.3565 -16.3565 -16.3203 -16.3203 -8.9061 -8.9027 -8.6369 -8.6332 -8.0394 -8.0382 -7.9405 -7.9349 -7.7469 -7.7466 -7.6407 -7.6361 -3.0206 -3.0117 -2.9818 -2.9759 -1.2158 -1.1847 -1.1759 -1.1534 -0.9876 -0.9732 -0.9654 -0.9546 4.2373 4.2377 4.4979 4.4980 4.7848 4.8116 4.8253 4.8454 4.8508 4.8615 4.8941 4.8948 4.9753 4.9966 5.0826 5.0960 5.1565 5.2132 5.3496 5.4122 5.4534 5.4884 5.6177 5.6342 7.6796 7.6834 7.8406 7.8544 7.8662 7.8664 7.9407 7.9459 8.0390 8.0427 8.1357 8.1451 8.8372 8.8479 8.9374 8.9854 9.0171 9.0477 9.1182 9.1490 9.1552 9.1840 9.2890 9.2934 11.2817 11.2856 11.3784 11.3819 11.4239 11.4271 11.5267 11.5311 15.2701 15.2737 15.2972 15.3003 k = 0.1491 0.2583 0.5940 ( 4818 PWs) bands (ev): -16.3572 -16.3571 -16.3208 -16.3208 -8.9052 -8.9023 -8.6361 -8.6330 -8.0295 -8.0277 -7.9411 -7.9355 -7.7360 -7.7356 -7.6412 -7.6367 -3.0305 -3.0228 -2.9918 -2.9868 -1.2263 -1.1989 -1.1851 -1.1650 -1.0037 -0.9908 -0.9838 -0.9737 4.2310 4.2314 4.4932 4.4935 4.7980 4.8179 4.8474 4.8579 4.8670 4.8702 4.8974 4.9136 4.9764 4.9953 5.0951 5.1034 5.1650 5.2237 5.3561 5.4164 5.4583 5.4916 5.6130 5.6291 7.7023 7.7060 7.8558 7.8657 7.8879 7.8908 7.9552 7.9597 8.0524 8.0546 8.1519 8.1604 8.8351 8.8438 8.9514 8.9959 9.0274 9.0570 9.1239 9.1526 9.1590 9.1860 9.2826 9.2869 11.2898 11.2930 11.3798 11.3831 11.4331 11.4356 11.5287 11.5328 15.2192 15.2280 15.2474 15.2481 k = 0.1404 0.2431 0.5940 ( 4818 PWs) bands (ev): -16.3578 -16.3578 -16.3214 -16.3214 -8.9043 -8.9019 -8.6354 -8.6327 -8.0197 -8.0175 -7.9414 -7.9359 -7.7256 -7.7246 -7.6415 -7.6370 -3.0405 -3.0340 -3.0019 -2.9977 -1.2367 -1.2129 -1.1942 -1.1765 -1.0198 -1.0084 -1.0022 -0.9927 4.2246 4.2250 4.4882 4.4885 4.8086 4.8232 4.8622 4.8708 4.8709 4.8832 4.9102 4.9407 4.9773 4.9940 5.1081 5.1117 5.1742 5.2341 5.3627 5.4194 5.4643 5.4950 5.6081 5.6236 7.7256 7.7292 7.8694 7.8763 7.9113 7.9156 7.9697 7.9734 8.0653 8.0662 8.1680 8.1754 8.8326 8.8397 8.9661 9.0070 9.0385 9.0668 9.1294 9.1562 9.1625 9.1878 9.2761 9.2803 11.2979 11.3004 11.3809 11.3840 11.4423 11.4441 11.5303 11.5342 15.1688 15.1793 15.1987 15.2005 k = 0.1316 0.2279 0.5940 ( 4814 PWs) bands (ev): -16.3584 -16.3584 -16.3220 -16.3220 -8.9034 -8.9013 -8.6346 -8.6324 -8.0103 -8.0077 -7.9414 -7.9360 -7.7154 -7.7140 -7.6416 -7.6371 -3.0505 -3.0450 -3.0120 -3.0084 -1.2472 -1.2268 -1.2032 -1.1877 -1.0356 -1.0256 -1.0203 -1.0116 4.2184 4.2187 4.4829 4.4832 4.8170 4.8278 4.8682 4.8703 4.8837 4.8976 4.9337 4.9700 4.9782 4.9929 5.1211 5.1215 5.1842 5.2443 5.3694 5.4213 5.4712 5.4986 5.6028 5.6177 7.7491 7.7525 7.8818 7.8865 7.9354 7.9405 7.9841 7.9871 8.0774 8.0778 8.1839 8.1902 8.8299 8.8355 8.9812 9.0186 9.0503 9.0772 9.1348 9.1596 9.1659 9.1894 9.2696 9.2737 11.3059 11.3077 11.3817 11.3846 11.4515 11.4527 11.5316 11.5353 15.1201 15.1301 15.1517 15.1558 k = 0.1228 0.2127 0.5940 ( 4818 PWs) bands (ev): -16.3590 -16.3590 -16.3226 -16.3226 -8.9025 -8.9008 -8.6338 -8.6320 -8.0012 -7.9983 -7.9413 -7.9360 -7.7057 -7.7038 -7.6414 -7.6370 -3.0603 -3.0558 -3.0219 -3.0190 -1.2577 -1.2405 -1.2121 -1.1987 -1.0509 -1.0424 -1.0379 -1.0301 4.2121 4.2124 4.4774 4.4777 4.8238 4.8318 4.8692 4.8694 4.8970 4.9107 4.9619 4.9789 4.9921 5.0000 5.1315 5.1353 5.1951 5.2542 5.3760 5.4225 5.4786 5.5024 5.5972 5.6114 7.7725 7.7758 7.8932 7.8962 7.9596 7.9651 7.9985 8.0008 8.0881 8.0896 8.1996 8.2049 8.8269 8.8314 8.9968 9.0307 9.0626 9.0879 9.1400 9.1629 9.1690 9.1907 9.2631 9.2670 11.3138 11.3150 11.3822 11.3849 11.4605 11.4612 11.5327 11.5360 15.0738 15.0827 15.1069 15.1125 k = 0.1140 0.1975 0.5940 ( 4822 PWs) bands (ev): -16.3596 -16.3596 -16.3232 -16.3232 -8.9016 -8.9002 -8.6330 -8.6315 -7.9925 -7.9893 -7.9409 -7.9358 -7.6963 -7.6941 -7.6410 -7.6367 -3.0700 -3.0663 -3.0316 -3.0293 -1.2681 -1.2539 -1.2208 -1.2095 -1.0656 -1.0585 -1.0550 -1.0480 4.2060 4.2063 4.4717 4.4720 4.8292 4.8353 4.8681 4.8690 4.9098 4.9225 4.9796 4.9874 4.9955 5.0295 5.1430 5.1493 5.2067 5.2640 5.3824 5.4232 5.4862 5.5063 5.5913 5.6046 7.7955 7.7987 7.9037 7.9052 7.9834 7.9889 8.0131 8.0146 8.0982 8.1007 8.2151 8.2194 8.8238 8.8273 9.0126 9.0430 9.0753 9.0988 9.1450 9.1660 9.1718 9.1917 9.2568 9.2604 11.3213 11.3221 11.3824 11.3849 11.4692 11.4694 11.5334 11.5365 15.0302 15.0380 15.0648 15.0705 k = 0.1053 0.1823 0.5940 ( 4822 PWs) bands (ev): -16.3602 -16.3602 -16.3237 -16.3237 -8.9006 -8.8995 -8.6322 -8.6311 -7.9842 -7.9808 -7.9403 -7.9354 -7.6875 -7.6849 -7.6404 -7.6362 -3.0794 -3.0765 -3.0411 -3.0392 -1.2784 -1.2668 -1.2292 -1.2198 -1.0795 -1.0738 -1.0711 -1.0651 4.2001 4.2003 4.4661 4.4663 4.8338 4.8383 4.8672 4.8683 4.9216 4.9327 4.9804 4.9892 5.0229 5.0581 5.1554 5.1634 5.2193 5.2735 5.3885 5.4235 5.4939 5.5105 5.5851 5.5974 7.8179 7.8210 7.9133 7.9137 8.0061 8.0112 8.0283 8.0288 8.1076 8.1110 8.2304 8.2338 8.8206 8.8232 9.0286 9.0556 9.0882 9.1098 9.1497 9.1689 9.1745 9.1926 9.2505 9.2539 11.3285 11.3289 11.3824 11.3847 11.4774 11.4775 11.5339 11.5368 14.9896 14.9964 15.0254 15.0305 k = 0.0965 0.1671 0.5940 ( 4816 PWs) bands (ev): -16.3607 -16.3607 -16.3242 -16.3242 -8.8998 -8.8989 -8.6315 -8.6306 -7.9764 -7.9729 -7.9396 -7.9349 -7.6791 -7.6763 -7.6396 -7.6356 -3.0885 -3.0862 -3.0502 -3.0487 -1.2884 -1.2793 -1.2374 -1.2298 -1.0927 -1.0882 -1.0863 -1.0812 4.1944 4.1946 4.4605 4.4606 4.8376 4.8410 4.8663 4.8674 4.9321 4.9415 4.9812 4.9888 5.0524 5.0853 5.1686 5.1774 5.2327 5.2829 5.3942 5.4234 5.5014 5.5147 5.5785 5.5897 7.8393 7.8423 7.9215 7.9220 8.0270 8.0309 8.0437 8.0448 8.1164 8.1205 8.2454 8.2479 8.8173 8.8193 9.0446 9.0683 9.1012 9.1208 9.1541 9.1716 9.1769 9.1931 9.2445 9.2476 11.3353 11.3353 11.3821 11.3842 11.4850 11.4854 11.5342 11.5368 14.9523 14.9582 14.9890 14.9929 k = 0.0877 0.1519 0.5940 ( 4824 PWs) bands (ev): -16.3612 -16.3612 -16.3247 -16.3247 -8.8990 -8.8983 -8.6308 -8.6301 -7.9692 -7.9656 -7.9387 -7.9343 -7.6713 -7.6684 -7.6387 -7.6349 -3.0971 -3.0953 -3.0588 -3.0577 -1.2982 -1.2911 -1.2454 -1.2393 -1.1051 -1.1016 -1.1002 -1.0961 4.1890 4.1891 4.4550 4.4551 4.8407 4.8433 4.8657 4.8667 4.9412 4.9489 4.9820 4.9883 5.0810 5.1106 5.1823 5.1911 5.2471 5.2920 5.3993 5.4231 5.5086 5.5191 5.5716 5.5815 7.8596 7.8625 7.9286 7.9298 8.0451 8.0473 8.0600 8.0629 8.1246 8.1290 8.2599 8.2618 8.8140 8.8155 9.0604 9.0809 9.1140 9.1315 9.1583 9.1739 9.1791 9.1934 9.2386 9.2415 11.3414 11.3416 11.3817 11.3836 11.4921 11.4927 11.5343 11.5365 14.9183 14.9234 14.9556 14.9573 k = 0.0789 0.1367 0.5940 ( 4816 PWs) bands (ev): -16.3617 -16.3617 -16.3252 -16.3252 -8.8982 -8.8977 -8.6301 -8.6296 -7.9625 -7.9590 -7.9377 -7.9336 -7.6641 -7.6612 -7.6377 -7.6341 -3.1052 -3.1039 -3.0669 -3.0661 -1.3075 -1.3023 -1.2529 -1.2483 -1.1169 -1.1142 -1.1126 -1.1094 4.1838 4.1839 4.4498 4.4499 4.8433 4.8452 4.8652 4.8661 4.9489 4.9550 4.9829 4.9879 5.1082 5.1337 5.1963 5.2046 5.2622 5.3011 5.4038 5.4225 5.5154 5.5234 5.5643 5.5728 7.8784 7.8812 7.9351 7.9368 8.0604 8.0616 8.0773 8.0813 8.1320 8.1366 8.2739 8.2752 8.8109 8.8119 9.0758 9.0933 9.1266 9.1420 9.1621 9.1760 9.1810 9.1934 9.2330 9.2356 11.3470 11.3474 11.3812 11.3828 11.4987 11.4995 11.5342 11.5362 14.8877 14.8920 14.9236 14.9246 k = 0.0702 0.1215 0.5940 ( 4812 PWs) bands (ev): -16.3621 -16.3621 -16.3256 -16.3256 -8.8975 -8.8971 -8.6295 -8.6291 -7.9564 -7.9531 -7.9366 -7.9329 -7.6575 -7.6547 -7.6366 -7.6333 -3.1127 -3.1118 -3.0744 -3.0739 -1.3163 -1.3126 -1.2600 -1.2567 -1.1279 -1.1259 -1.1234 -1.1211 4.1791 4.1792 4.4448 4.4449 4.8455 4.8468 4.8650 4.8656 4.9553 4.9599 4.9839 4.9877 5.1333 5.1542 5.2103 5.2178 5.2780 5.3102 5.4075 5.4216 5.5216 5.5277 5.5567 5.5637 7.8956 7.8983 7.9409 7.9429 8.0738 8.0745 8.0943 8.0986 8.1387 8.1433 8.2872 8.2881 8.8078 8.8086 9.0908 9.1053 9.1385 9.1518 9.1657 9.1778 9.1828 9.1931 9.2278 9.2301 11.3521 11.3526 11.3806 11.3820 11.5048 11.5056 11.5340 11.5358 14.8605 14.8642 14.8920 14.8949 k = 0.0614 0.1064 0.5940 ( 4812 PWs) bands (ev): -16.3625 -16.3625 -16.3260 -16.3260 -8.8968 -8.8966 -8.6289 -8.6287 -7.9510 -7.9480 -7.9354 -7.9321 -7.6517 -7.6491 -7.6354 -7.6325 -3.1195 -3.1189 -3.0813 -3.0809 -1.3245 -1.3220 -1.2666 -1.2643 -1.1380 -1.1365 -1.1326 -1.1311 4.1748 4.1749 4.4403 4.4404 4.8471 4.8480 4.8649 4.8654 4.9605 4.9637 4.9849 4.9877 5.1559 5.1717 5.2243 5.2306 5.2941 5.3194 5.4104 5.4206 5.5270 5.5318 5.5490 5.5542 7.9111 7.9136 7.9461 7.9481 8.0859 8.0864 8.1100 8.1142 8.1447 8.1491 8.2996 8.3001 8.8050 8.8055 9.1050 9.1169 9.1498 9.1607 9.1690 9.1792 9.1842 9.1926 9.2228 9.2249 11.3565 11.3570 11.3801 11.3812 11.5101 11.5109 11.5338 11.5353 14.8366 14.8398 14.8630 14.8663 k = 0.0526 0.0912 0.5940 ( 4816 PWs) bands (ev): -16.3629 -16.3629 -16.3263 -16.3263 -8.8963 -8.8961 -8.6284 -8.6283 -7.9463 -7.9438 -7.9340 -7.9313 -7.6466 -7.6443 -7.6342 -7.6317 -3.1255 -3.1252 -3.0873 -3.0871 -1.3319 -1.3303 -1.2727 -1.2712 -1.1469 -1.1459 -1.1405 -1.1396 4.1710 4.1710 4.4362 4.4363 4.8484 4.8489 4.8650 4.8653 4.9645 4.9667 4.9859 4.9878 5.1754 5.1862 5.2379 5.2431 5.3102 5.3287 5.4125 5.4194 5.5309 5.5357 5.5419 5.5444 7.9247 7.9269 7.9505 7.9526 8.0969 8.0972 8.1240 8.1279 8.1500 8.1540 8.3110 8.3113 8.8024 8.8027 9.1184 9.1277 9.1600 9.1680 9.1725 9.1803 9.1855 9.1917 9.2182 9.2201 11.3603 11.3608 11.3796 11.3805 11.5147 11.5154 11.5336 11.5348 14.8162 14.8188 14.8372 14.8400 k = 0.0439 0.0760 0.5940 ( 4808 PWs) bands (ev): -16.3632 -16.3632 -16.3266 -16.3266 -8.8958 -8.8957 -8.6280 -8.6279 -7.9423 -7.9404 -7.9325 -7.9305 -7.6422 -7.6404 -7.6328 -7.6308 -3.1308 -3.1306 -3.0926 -3.0925 -1.3384 -1.3375 -1.2780 -1.2771 -1.1545 -1.1540 -1.1472 -1.1466 4.1677 4.1677 4.4327 4.4327 4.8493 4.8496 4.8652 4.8653 4.9676 4.9689 4.9869 4.9881 5.1914 5.1980 5.2508 5.2547 5.3258 5.3381 5.4138 5.4181 5.5291 5.5345 5.5392 5.5396 7.9363 7.9383 7.9543 7.9562 8.1065 8.1068 8.1361 8.1394 8.1547 8.1582 8.3210 8.3212 8.8000 8.8002 9.1307 9.1377 9.1690 9.1723 9.1774 9.1810 9.1865 9.1907 9.2141 9.2158 11.3633 11.3637 11.3794 11.3800 11.5185 11.5191 11.5337 11.5345 14.7990 14.8011 14.8148 14.8171 k = 0.0351 0.0608 0.5940 ( 4808 PWs) bands (ev): -16.3635 -16.3635 -16.3268 -16.3268 -8.8954 -8.8953 -8.6276 -8.6276 -7.9392 -7.9380 -7.9309 -7.9297 -7.6388 -7.6375 -7.6314 -7.6300 -3.1352 -3.1351 -3.0970 -3.0969 -1.3439 -1.3434 -1.2826 -1.2821 -1.1608 -1.1605 -1.1526 -1.1523 4.1649 4.1649 4.4297 4.4297 4.8500 4.8501 4.8654 4.8655 4.9698 4.9705 4.9879 4.9884 5.2038 5.2073 5.2626 5.2651 5.3404 5.3476 5.4145 5.4168 5.5221 5.5249 5.5420 5.5422 7.9459 7.9476 7.9575 7.9591 8.1148 8.1149 8.1460 8.1486 8.1589 8.1616 8.3296 8.3296 8.7981 8.7981 9.1419 9.1468 9.1747 9.1765 9.1816 9.1824 9.1874 9.1895 9.2105 9.2120 11.3656 11.3658 11.3794 11.3798 11.5214 11.5218 11.5339 11.5344 14.7851 14.7866 14.7962 14.7979 k = 0.0263 0.0456 0.5940 ( 4804 PWs) bands (ev): -16.3637 -16.3637 -16.3270 -16.3270 -8.8951 -8.8951 -8.6274 -8.6273 -7.9369 -7.9363 -7.9294 -7.9288 -7.6362 -7.6356 -7.6299 -7.6292 -3.1387 -3.1386 -3.1004 -3.1004 -1.3483 -1.3481 -1.2863 -1.2861 -1.1658 -1.1656 -1.1568 -1.1567 4.1627 4.1627 4.4274 4.4274 4.8504 4.8505 4.8656 4.8656 4.9714 4.9717 4.9886 4.9889 5.2128 5.2143 5.2726 5.2738 5.3532 5.3566 5.4146 5.4156 5.5148 5.5161 5.5446 5.5447 7.9535 7.9548 7.9600 7.9613 8.1214 8.1215 8.1537 8.1553 8.1626 8.1643 8.3365 8.3365 8.7965 8.7965 9.1517 9.1548 9.1764 9.1803 9.1833 9.1851 9.1886 9.1888 9.2077 9.2088 11.3671 11.3672 11.3797 11.3798 11.5234 11.5236 11.5343 11.5346 14.7742 14.7752 14.7817 14.7828 k = 0.0175 0.0304 0.5940 ( 4800 PWs) bands (ev): -16.3638 -16.3638 -16.3272 -16.3272 -8.8949 -8.8948 -8.6272 -8.6272 -7.9354 -7.9353 -7.9282 -7.9280 -7.6345 -7.6343 -7.6286 -7.6284 -3.1412 -3.1412 -3.1029 -3.1029 -1.3516 -1.3515 -1.2890 -1.2889 -1.1693 -1.1693 -1.1598 -1.1598 4.1612 4.1612 4.4256 4.4256 4.8507 4.8507 4.8658 4.8658 4.9724 4.9724 4.9892 4.9893 5.2188 5.2193 5.2801 5.2805 5.3634 5.3645 5.4143 5.4146 5.5084 5.5088 5.5465 5.5466 7.9589 7.9598 7.9618 7.9627 8.1263 8.1263 8.1589 8.1595 8.1659 8.1666 8.3415 8.3415 8.7953 8.7953 9.1601 9.1615 9.1777 9.1801 9.1843 9.1850 9.1900 9.1908 9.2058 9.2063 11.3679 11.3679 11.3800 11.3801 11.5246 11.5247 11.5348 11.5349 14.7662 14.7666 14.7717 14.7721 k = 0.0088 0.0152 0.5940 ( 4804 PWs) bands (ev): -16.3639 -16.3639 -16.3272 -16.3272 -8.8947 -8.8947 -8.6271 -8.6271 -7.9347 -7.9346 -7.9275 -7.9274 -7.6337 -7.6336 -7.6278 -7.6278 -3.1427 -3.1427 -3.1045 -3.1044 -1.3535 -1.3535 -1.2906 -1.2906 -1.1714 -1.1714 -1.1617 -1.1617 4.1602 4.1602 4.4246 4.4246 4.8508 4.8508 4.8659 4.8659 4.9729 4.9729 4.9895 4.9895 5.2222 5.2223 5.2846 5.2847 5.3700 5.3702 5.4139 5.4140 5.5039 5.5039 5.5477 5.5477 7.9623 7.9628 7.9630 7.9635 8.1292 8.1292 8.1616 8.1617 8.1682 8.1682 8.3446 8.3446 8.7946 8.7946 9.1664 9.1667 9.1784 9.1791 9.1833 9.1835 9.1922 9.1923 9.2047 9.2048 11.3683 11.3683 11.3803 11.3803 11.5252 11.5252 11.5352 11.5353 14.7611 14.7612 14.7659 14.7660 k = 0.0000 0.0000 0.5940 ( 4796 PWs) bands (ev): -16.3639 -16.3639 -16.3273 -16.3273 -8.8947 -8.8947 -8.6270 -8.6270 -7.9344 -7.9344 -7.9272 -7.9272 -7.6334 -7.6334 -7.6276 -7.6276 -3.1432 -3.1432 -3.1050 -3.1050 -1.3542 -1.3542 -1.2912 -1.2912 -1.1721 -1.1721 -1.1623 -1.1623 4.1599 4.1599 4.4243 4.4243 4.8509 4.8509 4.8660 4.8660 4.9730 4.9730 4.9896 4.9896 5.2233 5.2233 5.2861 5.2861 5.3723 5.3723 5.4138 5.4138 5.5022 5.5022 5.5481 5.5481 7.9635 7.9635 7.9637 7.9637 8.1302 8.1302 8.1624 8.1624 8.1689 8.1689 8.3456 8.3456 8.7943 8.7943 9.1691 9.1691 9.1784 9.1784 9.1827 9.1827 9.1929 9.1929 9.2044 9.2044 11.3684 11.3684 11.3804 11.3804 11.5253 11.5253 11.5354 11.5354 14.7593 14.7593 14.7640 14.7640 k = 0.5000 0.2887 0.5940 ( 4808 PWs) bands (ev): -16.3511 -16.3511 -16.3151 -16.3151 -8.9129 -8.9129 -8.6421 -8.6421 -8.0901 -8.0901 -7.9665 -7.9665 -7.8024 -7.8024 -7.6690 -7.6690 -2.9273 -2.9273 -2.8911 -2.8911 -1.1182 -1.1182 -1.0934 -1.0934 -0.7910 -0.7910 -0.7596 -0.7596 4.2430 4.2430 4.4397 4.4397 4.6248 4.6248 4.7243 4.7243 4.7995 4.7995 4.8899 4.8899 4.9869 4.9869 5.0265 5.0265 5.1026 5.1026 5.2697 5.2697 5.4828 5.4828 5.6780 5.6780 7.4671 7.4671 7.6064 7.6064 7.6543 7.6543 7.8519 7.8519 7.9689 7.9689 8.1502 8.1502 8.7836 8.7836 8.8191 8.8191 9.0187 9.0187 9.1424 9.1424 9.1699 9.1699 9.3514 9.3514 11.1773 11.1773 11.3084 11.3084 11.3938 11.3938 11.5391 11.5391 15.7363 15.7363 15.7610 15.7610 k = 0.5000 0.2887 0.5765 ( 4824 PWs) bands (ev): -16.3512 -16.3512 -16.3151 -16.3151 -8.9166 -8.9165 -8.6383 -8.6381 -8.0900 -8.0898 -7.9666 -7.9666 -7.8023 -7.8021 -7.6690 -7.6690 -2.9290 -2.9259 -2.8926 -2.8894 -1.1229 -1.1138 -1.0978 -1.0881 -0.7912 -0.7910 -0.7600 -0.7593 4.2347 4.2369 4.4452 4.4466 4.6212 4.6225 4.7155 4.7328 4.7906 4.8114 4.8853 4.8869 4.9860 4.9869 5.0258 5.0286 5.1020 5.1044 5.2753 5.2759 5.4579 5.4611 5.7047 5.7052 7.4547 7.4554 7.6136 7.6148 7.6538 7.6540 7.8455 7.8482 7.9690 7.9713 8.1527 8.1528 8.7716 8.7831 8.8158 8.8311 9.0164 9.0226 9.1199 9.1277 9.1842 9.1917 9.3508 9.3527 11.1727 11.1746 11.3113 11.3135 11.3938 11.3952 11.5389 11.5401 15.7206 15.7215 15.7774 15.7783 k = 0.5000 0.2887 0.5590 ( 4824 PWs) bands (ev): -16.3514 -16.3514 -16.3150 -16.3150 -8.9271 -8.9268 -8.6272 -8.6269 -8.0896 -8.0892 -7.9670 -7.9670 -7.8020 -7.8015 -7.6689 -7.6689 -2.9309 -2.9247 -2.8937 -2.8875 -1.1276 -1.1112 -1.0999 -1.0824 -0.7915 -0.7912 -0.7605 -0.7590 4.2147 4.2186 4.4610 4.4633 4.6120 4.6134 4.7105 4.7376 4.7888 4.8236 4.8739 4.8767 4.9843 4.9865 5.0271 5.0314 5.1010 5.1070 5.2918 5.2925 5.4096 5.4153 5.7644 5.7648 7.4247 7.4257 7.6270 7.6296 7.6557 7.6566 7.8299 7.8345 7.9721 7.9759 8.1598 8.1599 8.7553 8.7687 8.8228 8.8435 9.0158 9.0282 9.0907 9.1001 9.2106 9.2189 9.3510 9.3549 11.1623 11.1656 11.3210 11.3250 11.3952 11.3981 11.5398 11.5422 15.6986 15.6997 15.8041 15.8049 k = 0.5000 0.2887 0.5416 ( 4830 PWs) bands (ev): -16.3519 -16.3519 -16.3148 -16.3148 -8.9429 -8.9426 -8.6104 -8.6099 -8.0888 -8.0883 -7.9676 -7.9676 -7.8013 -7.8005 -7.6688 -7.6688 -2.9328 -2.9238 -2.8944 -2.8854 -1.1320 -1.1129 -1.0973 -1.0765 -0.7919 -0.7914 -0.7610 -0.7588 4.1874 4.1925 4.4821 4.4851 4.5968 4.5972 4.7115 4.7394 4.7946 4.8343 4.8572 4.8607 4.9819 4.9857 5.0304 5.0348 5.0957 5.1058 5.3152 5.3160 5.3649 5.3718 5.8360 5.8360 7.3854 7.3865 7.6292 7.6320 7.6700 7.6707 7.8066 7.8121 7.9784 7.9827 8.1702 8.1702 8.7369 8.7496 8.8311 8.8537 9.0162 9.0353 9.0604 9.0722 9.2371 9.2462 9.3520 9.3580 11.1488 11.1529 11.3349 11.3403 11.3979 11.4024 11.5417 11.5453 15.6771 15.6782 15.8333 15.8339 k = 0.5000 0.2887 0.5241 ( 4824 PWs) bands (ev): -16.3525 -16.3525 -16.3146 -16.3146 -8.9625 -8.9621 -8.5893 -8.5888 -8.0877 -8.0870 -7.9684 -7.9684 -7.8002 -7.7993 -7.6686 -7.6686 -2.9348 -2.9234 -2.8947 -2.8833 -1.1361 -1.1165 -1.0921 -1.0703 -0.7924 -0.7918 -0.7617 -0.7587 4.1562 4.1619 4.5038 4.5083 4.5760 4.5763 4.7186 4.7424 4.8037 4.8305 4.8417 4.8502 4.9787 4.9848 5.0344 5.0393 5.0804 5.0920 5.3202 5.3308 5.3592 5.3604 5.9119 5.9122 7.3409 7.3421 7.6212 7.6238 7.6908 7.6910 7.7774 7.7832 7.9875 7.9918 8.1821 8.1822 8.7173 8.7287 8.8376 8.8606 9.0135 9.0289 9.0444 9.0495 9.2627 9.2730 9.3538 9.3622 11.1344 11.1390 11.3508 11.3573 11.4018 11.4081 11.5446 11.5493 15.6563 15.6575 15.8640 15.8641 k = 0.5000 0.2887 0.5066 ( 4820 PWs) bands (ev): -16.3533 -16.3533 -16.3144 -16.3144 -8.9845 -8.9840 -8.5654 -8.5647 -8.0863 -8.0854 -7.9695 -7.9695 -7.7989 -7.7978 -7.6684 -7.6684 -2.9367 -2.9235 -2.8944 -2.8811 -1.1400 -1.1206 -1.0861 -1.0639 -0.7932 -0.7922 -0.7624 -0.7586 4.1229 4.1290 4.5177 4.5280 4.5530 4.5583 4.7312 4.7484 4.8039 4.8069 4.8316 4.8595 4.9737 4.9839 5.0316 5.0446 5.0587 5.0594 5.3165 5.3271 5.3915 5.3936 5.9901 5.9907 7.2932 7.2944 7.6077 7.6101 7.7102 7.7102 7.7446 7.7504 7.9991 8.0030 8.1944 8.1946 8.6966 8.7068 8.8418 8.8640 8.9962 8.9974 9.0435 9.0543 9.2869 9.2988 9.3566 9.3678 11.1205 11.1254 11.3668 11.3747 11.4069 11.4153 11.5484 11.5543 15.6364 15.6375 15.8939 15.8947 k = 0.5000 0.2887 0.4891 ( 4816 PWs) bands (ev): -16.3542 -16.3542 -16.3141 -16.3141 -9.0080 -9.0076 -8.5394 -8.5388 -8.0846 -8.0835 -7.9708 -7.9707 -7.7973 -7.7959 -7.6681 -7.6681 -2.9387 -2.9240 -2.8937 -2.8789 -1.1435 -1.1245 -1.0797 -1.0574 -0.7940 -0.7927 -0.7633 -0.7586 4.0886 4.0950 4.5049 4.5160 4.5563 4.5621 4.7483 4.7554 4.7802 4.7856 4.8419 4.8693 4.9610 4.9829 5.0052 5.0114 5.0519 5.0572 5.3305 5.3384 5.4317 5.4335 6.0694 6.0702 7.2434 7.2446 7.5887 7.5907 7.7097 7.7137 7.7276 7.7287 8.0125 8.0160 8.2064 8.2067 8.6750 8.6840 8.8433 8.8634 8.9655 8.9689 9.0498 9.0655 9.3091 9.3232 9.3608 9.3751 11.1081 11.1132 11.3822 11.3915 11.4129 11.4237 11.5534 11.5604 15.6170 15.6181 15.9193 15.9218 k = 0.5000 0.2887 0.4717 ( 4820 PWs) bands (ev): -16.3552 -16.3552 -16.3138 -16.3138 -9.0324 -9.0320 -8.5123 -8.5115 -8.0825 -8.0813 -7.9722 -7.9722 -7.7954 -7.7938 -7.6678 -7.6678 -2.9406 -2.9248 -2.8926 -2.8768 -1.1468 -1.1282 -1.0730 -1.0508 -0.7950 -0.7933 -0.7643 -0.7587 4.0539 4.0604 4.4768 4.4855 4.5728 4.5764 4.7479 4.7521 4.7691 4.7770 4.8576 4.8727 4.9315 4.9592 4.9832 4.9885 5.0597 5.0645 5.3567 5.3622 5.4750 5.4766 6.1493 6.1501 7.1920 7.1931 7.5623 7.5636 7.6786 7.6823 7.7396 7.7399 8.0275 8.0306 8.2176 8.2180 8.6526 8.6606 8.8419 8.8585 8.9333 8.9398 9.0604 9.0776 9.3284 9.3444 9.3680 9.3851 11.0978 11.1031 11.3960 11.4071 11.4197 11.4330 11.5595 11.5674 15.5980 15.5991 15.9359 15.9390 k = 0.5000 0.2887 0.4542 ( 4816 PWs) bands (ev): -16.3563 -16.3563 -16.3135 -16.3135 -9.0573 -9.0568 -8.4843 -8.4836 -8.0801 -8.0788 -7.9739 -7.9739 -7.7932 -7.7914 -7.6675 -7.6675 -2.9424 -2.9259 -2.8912 -2.8746 -1.1497 -1.1317 -1.0660 -1.0440 -0.7962 -0.7940 -0.7654 -0.7589 4.0192 4.0258 4.4451 4.4525 4.5861 4.5889 4.7238 4.7241 4.7777 4.7891 4.8495 4.8732 4.9182 4.9193 4.9829 4.9833 5.0687 5.0738 5.3900 5.3938 5.5205 5.5219 6.2293 6.2302 7.1395 7.1407 7.5270 7.5272 7.6519 7.6544 7.7476 7.7479 8.0437 8.0465 8.2277 8.2281 8.6297 8.6367 8.8371 8.8487 8.9016 8.9115 9.0731 9.0905 9.3442 9.3582 9.3825 9.3983 11.0901 11.0955 11.4083 11.4209 11.4274 11.4427 11.5668 11.5756 15.5792 15.5803 15.9455 15.9479 k = 0.5000 0.2887 0.4367 ( 4808 PWs) bands (ev): -16.3575 -16.3575 -16.3132 -16.3131 -9.0822 -9.0817 -8.4559 -8.4552 -8.0774 -8.0760 -7.9757 -7.9757 -7.7908 -7.7888 -7.6671 -7.6671 -2.9442 -2.9272 -2.8895 -2.8725 -1.1523 -1.1350 -1.0589 -1.0372 -0.7975 -0.7947 -0.7666 -0.7591 3.9848 3.9914 4.4122 4.4187 4.5930 4.5955 4.6963 4.6974 4.7625 4.7802 4.8368 4.8810 4.9101 4.9293 4.9816 4.9836 5.0789 5.0844 5.4277 5.4303 5.5676 5.5689 6.3092 6.3102 7.0864 7.0875 7.4820 7.4827 7.6303 7.6316 7.7512 7.7514 8.0608 8.0633 8.2366 8.2370 8.6061 8.6123 8.8275 8.8326 8.8716 8.8862 9.0869 9.1039 9.3567 9.3663 9.4026 9.4144 11.0853 11.0909 11.4188 11.4312 11.4368 11.4523 11.5758 11.5852 15.5604 15.5615 15.9530 15.9548 k = 0.5000 0.2887 0.4193 ( 4808 PWs) bands (ev): -16.3588 -16.3588 -16.3128 -16.3128 -9.1070 -9.1065 -8.4275 -8.4267 -8.0745 -8.0729 -7.9777 -7.9776 -7.7881 -7.7860 -7.6667 -7.6667 -2.9459 -2.9287 -2.8877 -2.8705 -1.1545 -1.1379 -1.0517 -1.0303 -0.7990 -0.7955 -0.7679 -0.7594 3.9511 3.9576 4.3790 4.3846 4.5877 4.5897 4.6691 4.6711 4.7347 4.7430 4.8594 4.8901 4.9271 4.9445 4.9820 4.9857 5.0902 5.0961 5.4680 5.4699 5.6160 5.6171 6.3888 6.3898 7.0328 7.0339 7.4300 7.4314 7.6123 7.6128 7.7502 7.7504 8.0787 8.0809 8.2442 8.2446 8.5820 8.5874 8.8093 8.8097 8.8470 8.8652 9.1013 9.1176 9.3669 9.3730 9.4237 9.4323 11.0837 11.0893 11.4276 11.4384 11.4468 11.4609 11.5865 11.5963 15.5413 15.5425 15.9605 15.9620 k = 0.5000 0.2887 0.4018 ( 4804 PWs) bands (ev): -16.3602 -16.3602 -16.3125 -16.3125 -9.1314 -9.1310 -8.3991 -8.3983 -8.0712 -8.0695 -7.9798 -7.9797 -7.7852 -7.7830 -7.6663 -7.6663 -2.9474 -2.9302 -2.8859 -2.8685 -1.1565 -1.1406 -1.0443 -1.0233 -0.8006 -0.7963 -0.7694 -0.7598 3.9180 3.9244 4.3457 4.3506 4.5623 4.5632 4.6423 4.6442 4.7166 4.7205 4.8871 4.9066 4.9480 4.9600 4.9862 4.9908 5.1026 5.1090 5.5102 5.5115 5.6653 5.6663 6.4679 6.4689 6.9792 6.9803 7.3732 7.3750 7.5965 7.5966 7.7448 7.7450 8.0970 8.0990 8.2507 8.2511 8.5573 8.5620 8.7804 8.7825 8.8290 8.8470 9.1160 9.1313 9.3758 9.3795 9.4445 9.4509 11.0854 11.0911 11.4348 11.4442 11.4555 11.4681 11.5994 11.6091 15.5220 15.5231 15.9690 15.9706 k = 0.5000 0.2887 0.3843 ( 4816 PWs) bands (ev): -16.3616 -16.3616 -16.3122 -16.3122 -9.1554 -9.1549 -8.3711 -8.3702 -8.0677 -8.0659 -7.9820 -7.9820 -7.7822 -7.7798 -7.6659 -7.6659 -2.9489 -2.9317 -2.8839 -2.8666 -1.1581 -1.1430 -1.0368 -1.0164 -0.8023 -0.7972 -0.7709 -0.7602 3.8857 3.8920 4.3128 4.3168 4.5173 4.5180 4.6158 4.6173 4.7148 4.7173 4.9145 4.9251 4.9670 4.9711 4.9986 5.0024 5.1163 5.1231 5.5535 5.5545 5.7152 5.7162 6.5464 6.5474 6.9258 6.9268 7.3129 7.3149 7.5818 7.5823 7.7351 7.7353 8.1158 8.1176 8.2561 8.2564 8.5320 8.5361 8.7481 8.7501 8.8135 8.8295 9.1307 9.1449 9.3841 9.3862 9.4646 9.4695 11.0903 11.0961 11.4401 11.4487 11.4622 11.4734 11.6144 11.6238 15.5023 15.5033 15.9786 15.9808 k = 0.5000 0.2887 0.3669 ( 4806 PWs) bands (ev): -16.3631 -16.3631 -16.3119 -16.3119 -9.1787 -9.1783 -8.3435 -8.3426 -8.0639 -8.0621 -7.9843 -7.9843 -7.7789 -7.7764 -7.6655 -7.6654 -2.9503 -2.9333 -2.8820 -2.8649 -1.1594 -1.1451 -1.0292 -1.0095 -0.8043 -0.7981 -0.7725 -0.7607 3.8544 3.8605 4.2803 4.2837 4.4615 4.4636 4.5905 4.5916 4.7228 4.7249 4.9381 4.9413 4.9803 4.9828 5.0189 5.0230 5.1313 5.1384 5.5975 5.5983 5.7657 5.7665 6.6241 6.6250 6.8729 6.8738 7.2499 7.2520 7.5683 7.5691 7.7214 7.7217 8.1347 8.1364 8.2606 8.2608 8.5062 8.5098 8.7141 8.7157 8.7974 8.8113 9.1453 9.1584 9.3921 9.3933 9.4838 9.4877 11.0985 11.1044 11.4437 11.4518 11.4669 11.4768 11.6316 11.6404 15.4819 15.4830 15.9890 15.9928 k = 0.5000 0.2887 0.3494 ( 4806 PWs) bands (ev): -16.3645 -16.3645 -16.3117 -16.3117 -9.2014 -9.2010 -8.3165 -8.3157 -8.0598 -8.0580 -7.9866 -7.9866 -7.7756 -7.7730 -7.6651 -7.6650 -2.9516 -2.9348 -2.8801 -2.8632 -1.1605 -1.1469 -1.0216 -1.0026 -0.8063 -0.7991 -0.7742 -0.7613 3.8242 3.8299 4.2486 4.2511 4.4024 4.4053 4.5663 4.5673 4.7354 4.7375 4.9520 4.9529 4.9959 5.0007 5.0429 5.0488 5.1476 5.1549 5.6418 5.6425 5.8163 5.8171 6.7005 6.7015 6.8209 6.8218 7.1848 7.1870 7.5558 7.5567 7.7040 7.7043 8.1537 8.1552 8.2643 8.2644 8.4799 8.4830 8.6789 8.6801 8.7799 8.7919 9.1595 9.1716 9.4000 9.4006 9.5022 9.5053 11.1097 11.1158 11.4455 11.4534 11.4695 11.4782 11.6509 11.6589 15.4610 15.4620 15.9977 16.0064 k = 0.5000 0.2887 0.3319 ( 4802 PWs) bands (ev): -16.3660 -16.3660 -16.3114 -16.3114 -9.2234 -9.2230 -8.2904 -8.2895 -8.0555 -8.0536 -7.9890 -7.9890 -7.7721 -7.7694 -7.6646 -7.6646 -2.9527 -2.9363 -2.8782 -2.8617 -1.1612 -1.1485 -1.0140 -0.9959 -0.8086 -0.8001 -0.7759 -0.7619 3.7950 3.8005 4.2177 4.2193 4.3427 4.3464 4.5433 4.5442 4.7506 4.7529 4.9579 4.9592 5.0190 5.0225 5.0688 5.0767 5.1653 5.1728 5.6862 5.6868 5.8669 5.8677 6.7598 6.7600 6.7867 6.7867 7.1182 7.1204 7.5440 7.5451 7.6833 7.6837 8.1727 8.1741 8.2672 8.2673 8.4533 8.4559 8.6429 8.6438 8.7606 8.7709 9.1732 9.1844 9.4080 9.4082 9.5195 9.5221 11.1238 11.1300 11.4455 11.4534 11.4701 11.4778 11.6720 11.6792 15.4395 15.4405 16.0024 16.0213 k = 0.5000 0.2887 0.3144 ( 4822 PWs) bands (ev): -16.3675 -16.3675 -16.3112 -16.3112 -9.2445 -9.2441 -8.2651 -8.2643 -8.0508 -8.0490 -7.9915 -7.9915 -7.7685 -7.7658 -7.6642 -7.6642 -2.9538 -2.9377 -2.8764 -2.8603 -1.1617 -1.1498 -1.0064 -0.9892 -0.8109 -0.8013 -0.7777 -0.7625 3.7670 3.7722 4.1877 4.1882 4.2838 4.2882 4.5214 4.5223 4.7675 4.7700 4.9611 4.9619 5.0450 5.0468 5.0957 5.1051 5.1843 5.1919 5.7303 5.7308 5.9173 5.9180 6.7157 6.7162 6.8545 6.8552 7.0504 7.0525 7.5330 7.5343 7.6598 7.6602 8.1913 8.1927 8.2695 8.2696 8.4262 8.4284 8.6063 8.6069 8.7393 8.7483 9.1865 9.1967 9.4158 9.4159 9.5360 9.5381 11.1403 11.1467 11.4438 11.4519 11.4686 11.4755 11.6946 11.7010 15.4173 15.4182 16.0019 16.0065 k = 0.5000 0.2887 0.2970 ( 4826 PWs) bands (ev): -16.3690 -16.3690 -16.3110 -16.3110 -9.2647 -9.2644 -8.2410 -8.2401 -8.0459 -8.0441 -7.9939 -7.9939 -7.7649 -7.7622 -7.6638 -7.6638 -2.9547 -2.9392 -2.8746 -2.8590 -1.1619 -1.1509 -0.9988 -0.9826 -0.8134 -0.8025 -0.7794 -0.7632 3.7402 3.7451 4.1578 4.1587 4.2264 4.2320 4.5008 4.5016 4.7857 4.7885 4.9631 4.9634 5.0720 5.0727 5.1231 5.1334 5.2047 5.2123 5.7739 5.7744 5.9672 5.9679 6.6663 6.6666 6.9282 6.9288 6.9818 6.9839 7.5227 7.5242 7.6338 7.6344 8.2096 8.2110 8.2713 8.2716 8.3989 8.4008 8.5692 8.5697 8.7162 8.7240 9.1991 9.2084 9.4237 9.4237 9.5514 9.5532 11.1590 11.1657 11.4405 11.4492 11.4655 11.4718 11.7185 11.7242 15.3945 15.3954 16.0002 16.0037 k = 0.5000 0.2887 0.2795 ( 4824 PWs) bands (ev): -16.3704 -16.3704 -16.3109 -16.3109 -9.2840 -9.2837 -8.2181 -8.2172 -8.0407 -8.0389 -7.9964 -7.9963 -7.7613 -7.7586 -7.6635 -7.6634 -2.9555 -2.9405 -2.8729 -2.8579 -1.1620 -1.1517 -0.9912 -0.9762 -0.8160 -0.8039 -0.7810 -0.7639 3.7147 3.7192 4.1274 4.1309 4.1711 4.1789 4.4815 4.4822 4.8048 4.8080 4.9644 4.9646 5.0993 5.0994 5.1504 5.1611 5.2264 5.2338 5.8169 5.8173 6.0165 6.0172 6.6177 6.6179 6.9125 6.9145 7.0013 7.0019 7.5133 7.5150 7.6059 7.6068 8.2273 8.2288 8.2728 8.2734 8.3715 8.3732 8.5318 8.5321 8.6913 8.6981 9.2112 9.2197 9.4315 9.4315 9.5659 9.5674 11.1795 11.1865 11.4358 11.4453 11.4608 11.4668 11.7434 11.7485 15.3712 15.3721 15.9974 16.0004 k = 0.5000 0.2887 0.2620 ( 4826 PWs) bands (ev): -16.3718 -16.3718 -16.3107 -16.3107 -9.3023 -9.3020 -8.1966 -8.1957 -8.0350 -8.0334 -7.9988 -7.9986 -7.7577 -7.7550 -7.6631 -7.6630 -2.9562 -2.9418 -2.8712 -2.8568 -1.1618 -1.1523 -0.9838 -0.9701 -0.8187 -0.8053 -0.7826 -0.7647 3.6906 3.6947 4.0950 4.1036 4.1189 4.1313 4.4634 4.4640 4.8247 4.8282 4.9653 4.9659 5.1267 5.1268 5.1774 5.1881 5.2494 5.2566 5.8589 5.8592 6.0648 6.0656 6.5703 6.5703 6.8431 6.8449 7.0732 7.0736 7.5045 7.5067 7.5767 7.5780 8.2440 8.2458 8.2741 8.2753 8.3441 8.3456 8.4942 8.4945 8.6645 8.6704 9.2226 9.2303 9.4392 9.4393 9.5794 9.5807 11.2013 11.2088 11.4299 11.4403 11.4548 11.4607 11.7689 11.7734 15.3476 15.3484 15.9941 15.9967 k = 0.5000 0.2887 0.2446 ( 4828 PWs) bands (ev): -16.3732 -16.3732 -16.3106 -16.3106 -9.3196 -9.3194 -8.1766 -8.1757 -8.0290 -8.0276 -8.0011 -8.0008 -7.7541 -7.7514 -7.6627 -7.6627 -2.9567 -2.9430 -2.8697 -2.8560 -1.1614 -1.1527 -0.9765 -0.9641 -0.8215 -0.8069 -0.7841 -0.7655 3.6678 3.6715 4.0566 4.0655 4.0812 4.0935 4.4465 4.4471 4.8450 4.8490 4.9661 4.9670 5.1543 5.1544 5.2037 5.2141 5.2736 5.2805 5.8997 5.8999 6.1119 6.1127 6.5240 6.5243 6.7737 6.7754 7.1439 7.1442 7.4961 7.4991 7.5468 7.5491 8.2586 8.2614 8.2757 8.2781 8.3171 8.3186 8.4567 8.4569 8.6359 8.6412 9.2332 9.2402 9.4467 9.4469 9.5920 9.5931 11.2239 11.2320 11.4227 11.4344 11.4479 11.4539 11.7949 11.7988 15.3237 15.3245 15.9903 15.9928 k = 0.5000 0.2887 0.2271 ( 4818 PWs) bands (ev): -16.3745 -16.3745 -16.3105 -16.3105 -9.3359 -9.3356 -8.1583 -8.1574 -8.0226 -8.0215 -8.0034 -8.0028 -7.7506 -7.7480 -7.6624 -7.6623 -2.9572 -2.9442 -2.8682 -2.8552 -1.1608 -1.1530 -0.9694 -0.9584 -0.8242 -0.8085 -0.7854 -0.7664 3.6464 3.6498 4.0137 4.0185 4.0567 4.0646 4.4309 4.4315 4.8658 4.8701 4.9670 4.9682 5.1819 5.1819 5.2290 5.2390 5.2991 5.3056 5.9391 5.9392 6.1576 6.1585 6.4793 6.4799 6.7046 6.7061 7.2132 7.2135 7.4864 7.4913 7.5180 7.5221 8.2678 8.2713 8.2801 8.2837 8.2918 8.2935 8.4195 8.4197 8.6056 8.6103 9.2432 9.2496 9.4541 9.4543 9.6037 9.6046 11.2468 11.2559 11.4146 11.4278 11.4405 11.4466 11.8209 11.8243 15.2998 15.3005 15.9864 15.9887 k = 0.5000 0.2887 0.2096 ( 4820 PWs) bands (ev): -16.3757 -16.3757 -16.3104 -16.3104 -9.3511 -9.3508 -8.1419 -8.1408 -8.0158 -8.0155 -8.0055 -8.0044 -7.7471 -7.7446 -7.6621 -7.6620 -2.9575 -2.9453 -2.8668 -2.8546 -1.1602 -1.1531 -0.9626 -0.9530 -0.8270 -0.8103 -0.7866 -0.7673 3.6264 3.6294 3.9707 3.9737 4.0344 4.0400 4.4164 4.4170 4.8865 4.8912 4.9680 4.9696 5.2092 5.2094 5.2532 5.2625 5.3261 5.3320 5.9768 5.9770 6.2014 6.2025 6.4363 6.4372 6.6360 6.6373 7.2811 7.2813 7.4703 7.4758 7.4981 7.5031 8.2615 8.2624 8.2741 8.2761 8.2945 8.2960 8.3834 8.3838 8.5738 8.5779 9.2525 9.2582 9.4610 9.4613 9.6144 9.6152 11.2694 11.2798 11.4057 11.4208 11.4329 11.4391 11.8466 11.8496 15.2760 15.2767 15.9824 15.9846 k = 0.5000 0.2887 0.1922 ( 4822 PWs) bands (ev): -16.3769 -16.3769 -16.3104 -16.3104 -9.3651 -9.3649 -8.1272 -8.1262 -8.0112 -8.0089 -8.0072 -8.0036 -7.7439 -7.7415 -7.6618 -7.6617 -2.9578 -2.9464 -2.8655 -2.8541 -1.1594 -1.1530 -0.9560 -0.9479 -0.8296 -0.8122 -0.7876 -0.7683 3.6080 3.6106 3.9297 3.9319 4.0136 4.0180 4.4032 4.4037 4.9068 4.9120 4.9692 4.9712 5.2361 5.2365 5.2758 5.2844 5.3546 5.3599 6.0125 6.0130 6.2430 6.2444 6.3950 6.3963 6.5684 6.5692 7.3471 7.3475 7.4457 7.4490 7.4917 7.4948 8.2374 8.2383 8.2745 8.2763 8.3025 8.3042 8.3514 8.3522 8.5404 8.5440 9.2610 9.2661 9.4677 9.4681 9.6241 9.6249 11.2910 11.3035 11.3962 11.4138 11.4254 11.4317 11.8717 11.8743 15.2526 15.2532 15.9785 15.9807 k = 0.5000 0.2887 0.1747 ( 4816 PWs) bands (ev): -16.3780 -16.3780 -16.3103 -16.3103 -9.3780 -9.3778 -8.1145 -8.1134 -8.0111 -8.0096 -8.0008 -7.9983 -7.7407 -7.7385 -7.6615 -7.6615 -2.9579 -2.9474 -2.8643 -2.8537 -1.1585 -1.1529 -0.9497 -0.9432 -0.8321 -0.8141 -0.7884 -0.7694 3.5910 3.5932 3.8915 3.8932 3.9946 3.9981 4.3912 4.3917 4.9261 4.9318 4.9712 4.9736 5.2623 5.2628 5.2967 5.3046 5.3848 5.3895 6.0460 6.0470 6.2819 6.2839 6.3557 6.3575 6.5021 6.5022 7.4061 7.4097 7.4221 7.4231 7.4901 7.4923 8.2133 8.2143 8.2747 8.2767 8.2925 8.2947 8.3381 8.3389 8.5056 8.5089 9.2688 9.2733 9.4740 9.4745 9.6330 9.6337 11.3103 11.3262 11.3864 11.4077 11.4183 11.4247 11.8960 11.8983 15.2300 15.2305 15.9750 15.9771 k = 0.5000 0.2887 0.1572 ( 4828 PWs) bands (ev): -16.3790 -16.3790 -16.3103 -16.3103 -9.3898 -9.3896 -8.1036 -8.1025 -8.0123 -8.0114 -7.9931 -7.9912 -7.7378 -7.7357 -7.6613 -7.6612 -2.9580 -2.9484 -2.8631 -2.8535 -1.1576 -1.1527 -0.9439 -0.9388 -0.8343 -0.8161 -0.7890 -0.7706 3.5756 3.5774 3.8565 3.8579 3.9772 3.9801 4.3804 4.3808 4.9430 4.9490 4.9751 4.9779 5.2873 5.2878 5.3158 5.3231 5.4166 5.4208 6.0771 6.0786 6.3166 6.3167 6.3214 6.3227 6.4365 6.4382 7.3888 7.3913 7.4701 7.4704 7.4952 7.4973 8.1903 8.1913 8.2626 8.2635 8.2772 8.2779 8.3442 8.3445 8.4696 8.4725 9.2758 9.2798 9.4799 9.4804 9.6410 9.6415 11.3258 11.3470 11.3767 11.4035 11.4122 11.4185 11.9191 11.9211 15.2082 15.2087 15.9718 15.9738 k = 0.5000 0.2887 0.1398 ( 4820 PWs) bands (ev): -16.3799 -16.3799 -16.3102 -16.3102 -9.4003 -9.4002 -8.0943 -8.0933 -8.0138 -8.0131 -7.9853 -7.9839 -7.7350 -7.7331 -7.6611 -7.6610 -2.9580 -2.9493 -2.8620 -2.8533 -1.1567 -1.1524 -0.9385 -0.9349 -0.8363 -0.8182 -0.7894 -0.7718 3.5617 3.5632 3.8247 3.8260 3.9615 3.9640 4.3708 4.3712 4.9551 4.9598 4.9845 4.9861 5.3104 5.3108 5.3337 5.3404 5.4500 5.4538 6.1053 6.1077 6.2836 6.2870 6.3400 6.3546 6.3728 6.3853 7.3629 7.3647 7.4870 7.4878 7.5410 7.5422 8.1687 8.1699 8.2313 8.2315 8.2772 8.2774 8.3536 8.3537 8.4327 8.4353 9.2821 9.2856 9.4853 9.4858 9.6482 9.6487 11.3353 11.3618 11.3706 11.4004 11.4103 11.4141 11.9408 11.9425 15.1878 15.1882 15.9692 15.9711 k = 0.5000 0.2887 0.1223 ( 4820 PWs) bands (ev): -16.3808 -16.3808 -16.3102 -16.3102 -9.4097 -9.4095 -8.0867 -8.0857 -8.0151 -8.0146 -7.9778 -7.9766 -7.7325 -7.7308 -7.6609 -7.6608 -2.9579 -2.9502 -2.8610 -2.8533 -1.1558 -1.1521 -0.9336 -0.9313 -0.8379 -0.8203 -0.7895 -0.7732 3.5494 3.5505 3.7965 3.7976 3.9476 3.9496 4.3623 4.3626 4.9615 4.9643 4.9988 4.9991 5.3302 5.3307 5.3512 5.3573 5.4848 5.4881 6.1302 6.1339 6.2515 6.2561 6.3032 6.3102 6.3858 6.3910 7.3387 7.3401 7.4912 7.4919 7.5990 7.6001 8.1488 8.1501 8.2002 8.2003 8.2770 8.2773 8.3619 8.3625 8.3960 8.3979 9.2876 9.2907 9.4902 9.4907 9.6545 9.6549 11.3383 11.3559 11.3801 11.3957 11.4141 11.4159 11.9607 11.9621 15.1689 15.1693 15.9672 15.9690 k = 0.5000 0.2887 0.1048 ( 4812 PWs) bands (ev): -16.3815 -16.3815 -16.3102 -16.3102 -9.4178 -9.4177 -8.0804 -8.0795 -8.0163 -8.0159 -7.9708 -7.9699 -7.7303 -7.7288 -7.6608 -7.6607 -2.9577 -2.9510 -2.8600 -2.8534 -1.1549 -1.1518 -0.9294 -0.9281 -0.8391 -0.8225 -0.7893 -0.7746 3.5386 3.5395 3.7718 3.7729 3.9355 3.9372 4.3550 4.3553 4.9647 4.9663 5.0134 5.0146 5.3457 5.3464 5.3693 5.3744 5.5205 5.5235 6.1505 6.1567 6.2224 6.2280 6.2484 6.2510 6.4129 6.4154 7.3168 7.3179 7.4956 7.4962 7.6555 7.6566 8.1307 8.1321 8.1713 8.1717 8.2764 8.2765 8.3531 8.3564 8.3746 8.3754 9.2925 9.2951 9.4945 9.4950 9.6599 9.6602 11.3366 11.3475 11.3843 11.3906 11.4214 11.4259 11.9785 11.9797 15.1518 15.1521 15.9657 15.9674 k = 0.5000 0.2887 0.0873 ( 4816 PWs) bands (ev): -16.3821 -16.3821 -16.3102 -16.3102 -9.4247 -9.4246 -8.0754 -8.0745 -8.0174 -8.0170 -7.9645 -7.9637 -7.7283 -7.7270 -7.6606 -7.6606 -2.9574 -2.9518 -2.8591 -2.8535 -1.1541 -1.1516 -0.9258 -0.9254 -0.8398 -0.8248 -0.7889 -0.7760 3.5295 3.5302 3.7508 3.7518 3.9252 3.9266 4.3488 4.3490 4.9664 4.9674 5.0274 5.0290 5.3571 5.3581 5.3871 5.3913 5.5567 5.5594 6.1631 6.1727 6.1872 6.1946 6.2007 6.2154 6.4363 6.4378 7.2976 7.2985 7.5006 7.5012 7.7092 7.7103 8.1144 8.1157 8.1459 8.1467 8.2735 8.2736 8.3193 8.3218 8.3803 8.3807 9.2966 9.2987 9.4982 9.4986 9.6644 9.6647 11.3328 11.3398 11.3831 11.3859 11.4327 11.4369 11.9941 11.9951 15.1368 15.1371 15.9649 15.9664 k = 0.5000 0.2887 0.0699 ( 4816 PWs) bands (ev): -16.3826 -16.3826 -16.3102 -16.3102 -9.4304 -9.4303 -8.0714 -8.0707 -8.0183 -8.0180 -7.9591 -7.9585 -7.7266 -7.7256 -7.6605 -7.6605 -2.9571 -2.9526 -2.8583 -2.8538 -1.1533 -1.1514 -0.9231 -0.9229 -0.8400 -0.8271 -0.7883 -0.7776 3.5220 3.5225 3.7336 3.7344 3.9168 3.9178 4.3438 4.3440 4.9675 4.9682 5.0399 5.0415 5.3656 5.3666 5.4034 5.4067 5.5924 5.5949 6.1364 6.1386 6.1617 6.1734 6.1983 6.2104 6.4557 6.4567 7.2815 7.2822 7.5058 7.5063 7.7591 7.7603 8.0995 8.1005 8.1254 8.1271 8.2600 8.2614 8.2945 8.2957 8.3863 8.3866 9.2999 9.3017 9.5013 9.5016 9.6682 9.6684 11.3285 11.3331 11.3805 11.3819 11.4440 11.4472 12.0073 12.0080 15.1242 15.1244 15.9646 15.9659 k = 0.5000 0.2887 0.0524 ( 4816 PWs) bands (ev): -16.3830 -16.3830 -16.3102 -16.3102 -9.4348 -9.4348 -8.0684 -8.0678 -8.0190 -8.0187 -7.9547 -7.9543 -7.7253 -7.7245 -7.6604 -7.6604 -2.9567 -2.9533 -2.8575 -2.8541 -1.1527 -1.1512 -0.9212 -0.9207 -0.8396 -0.8294 -0.7874 -0.7791 3.5162 3.5165 3.7202 3.7208 3.9102 3.9110 4.3399 4.3400 4.9683 4.9687 5.0502 5.0516 5.3719 5.3727 5.4171 5.4196 5.6262 5.6283 6.0902 6.0925 6.1508 6.1561 6.2104 6.2164 6.4710 6.4717 7.2687 7.2693 7.5108 7.5112 7.8037 7.8049 8.0861 8.0865 8.1114 8.1140 8.2303 8.2328 8.2871 8.2873 8.3911 8.3913 9.3026 9.3039 9.5037 9.5040 9.6711 9.6712 11.3247 11.3277 11.3780 11.3787 11.4534 11.4557 12.0177 12.0183 15.1141 15.1143 15.9647 15.9658 k = 0.5000 0.2887 0.0349 ( 4824 PWs) bands (ev): -16.3833 -16.3833 -16.3102 -16.3102 -9.4380 -9.4379 -8.0663 -8.0659 -8.0194 -8.0193 -7.9515 -7.9512 -7.7243 -7.7238 -7.6603 -7.6603 -2.9562 -2.9540 -2.8568 -2.8545 -1.1521 -1.1512 -0.9198 -0.9193 -0.8387 -0.8316 -0.7863 -0.7807 3.5120 3.5122 3.7106 3.7110 3.9055 3.9060 4.3371 4.3372 4.9687 4.9690 5.0580 5.0589 5.3761 5.3768 5.4276 5.4293 5.6555 5.6571 6.0521 6.0539 6.1404 6.1429 6.2199 6.2231 6.4820 6.4824 7.2595 7.2598 7.5150 7.5152 7.8405 7.8415 8.0751 8.0752 8.1041 8.1074 8.1986 8.2013 8.2853 8.2853 8.3946 8.3947 9.3045 9.3054 9.5054 9.5056 9.6731 9.6732 11.3218 11.3236 11.3759 11.3763 11.4605 11.4620 12.0253 12.0257 15.1068 15.1069 15.9650 15.9658 k = 0.5000 0.2887 0.0175 ( 4824 PWs) bands (ev): -16.3835 -16.3835 -16.3102 -16.3102 -9.4399 -9.4398 -8.0650 -8.0648 -8.0197 -8.0196 -7.9495 -7.9493 -7.7236 -7.7234 -7.6603 -7.6603 -2.9557 -2.9546 -2.8561 -2.8550 -1.1517 -1.1512 -0.9188 -0.9185 -0.8374 -0.8338 -0.7851 -0.7822 3.5095 3.5096 3.7049 3.7051 3.9028 3.9030 4.3355 4.3355 4.9691 4.9692 5.0629 5.0634 5.3787 5.3790 5.4343 5.4351 5.6765 5.6773 6.0263 6.0273 6.1336 6.1347 6.2260 6.2274 6.4887 6.4889 7.2539 7.2541 7.5178 7.5179 7.8657 7.8663 8.0679 8.0681 8.1032 8.1058 8.1737 8.1758 8.2847 8.2847 8.3968 8.3968 9.3058 9.3062 9.5065 9.5066 9.6744 9.6744 11.3201 11.3210 11.3747 11.3748 11.4650 11.4657 12.0300 12.0302 15.1024 15.1024 15.9654 15.9658 k = 0.5000 0.2887-0.0000 ( 4816 PWs) bands (ev): -16.3836 -16.3836 -16.3102 -16.3102 -9.4405 -9.4405 -8.0645 -8.0645 -8.0198 -8.0198 -7.9487 -7.9487 -7.7233 -7.7233 -7.6603 -7.6603 -2.9552 -2.9552 -2.8555 -2.8555 -1.1514 -1.1514 -0.9184 -0.9184 -0.8357 -0.8357 -0.7837 -0.7837 3.5087 3.5087 3.7030 3.7030 3.9020 3.9020 4.3350 4.3350 4.9692 4.9692 5.0648 5.0648 5.3797 5.3797 5.4368 5.4368 5.6845 5.6845 6.0173 6.0173 6.1316 6.1316 6.2285 6.2285 6.4910 6.4910 7.2521 7.2521 7.5188 7.5188 7.8750 7.8750 8.0656 8.0656 8.1054 8.1054 8.1643 8.1643 8.2845 8.2845 8.3975 8.3975 9.3064 9.3064 9.5068 9.5068 9.6748 9.6748 11.3199 11.3199 11.3743 11.3743 11.4668 11.4668 12.0316 12.0316 15.1009 15.1009 15.9657 15.9657 k = 0.3333 0.5774-0.0000 ( 4806 PWs) bands (ev): -16.3631 -16.3631 -16.3276 -16.3276 -9.4626 -9.4608 -8.1155 -8.1054 -7.9614 -7.9587 -7.9561 -7.9544 -7.7902 -7.7821 -7.6224 -7.6210 -2.9130 -2.8890 -2.8780 -2.8513 -1.0509 -1.0479 -0.9818 -0.9566 -0.8358 -0.7753 -0.7513 -0.7180 3.6246 3.6247 3.6254 3.6270 3.9364 3.9392 4.0191 4.0191 4.9851 5.0083 5.0216 5.0461 5.5332 5.5591 5.5609 5.5993 5.6732 5.6739 5.9171 5.9405 5.9511 5.9744 6.3836 6.3892 6.4532 6.4626 7.2049 7.2088 7.6626 7.6647 7.6930 7.7038 7.9881 7.9901 8.0663 8.0716 8.1204 8.1258 8.1626 8.1630 8.3843 8.3867 9.4134 9.4265 9.4621 9.4686 9.5330 9.5403 11.4246 11.4255 11.4582 11.4593 11.6118 11.6389 11.6414 11.6699 15.0367 15.0369 16.3973 16.4300 k = 0.3333 0.5774 0.0175 ( 4800 PWs) bands (ev): -16.3631 -16.3631 -16.3276 -16.3276 -9.4619 -9.4602 -8.1156 -8.1056 -7.9623 -7.9596 -7.9560 -7.9544 -7.7904 -7.7823 -7.6224 -7.6209 -2.9129 -2.8891 -2.8779 -2.8514 -1.0508 -1.0479 -0.9818 -0.9566 -0.8360 -0.7755 -0.7514 -0.7180 3.6250 3.6267 3.6280 3.6280 3.9373 3.9401 4.0200 4.0200 4.9847 5.0081 5.0210 5.0457 5.5294 5.5548 5.5566 5.5941 5.6717 5.6724 5.9218 5.9445 5.9532 5.9760 6.3844 6.3900 6.4523 6.4617 7.2045 7.2084 7.6638 7.6659 7.6941 7.7048 7.9776 7.9793 8.0682 8.0734 8.1125 8.1173 8.1829 8.1834 8.3835 8.3858 9.4131 9.4262 9.4618 9.4683 9.5326 9.5400 11.4221 11.4238 11.4553 11.4572 11.6131 11.6399 11.6435 11.6715 15.0379 15.0381 16.3896 16.4206 k = 0.3333 0.5774 0.0349 ( 4809 PWs) bands (ev): -16.3630 -16.3630 -16.3275 -16.3275 -9.4599 -9.4582 -8.1161 -8.1061 -7.9651 -7.9623 -7.9559 -7.9542 -7.7910 -7.7829 -7.6223 -7.6208 -2.9127 -2.8892 -2.8777 -2.8515 -1.0505 -1.0478 -0.9818 -0.9566 -0.8366 -0.7762 -0.7517 -0.7183 3.6272 3.6299 3.6339 3.6349 3.9400 3.9428 4.0228 4.0228 4.9835 5.0074 5.0192 5.0443 5.5180 5.5422 5.5440 5.5793 5.6673 5.6680 5.9349 5.9557 5.9590 5.9805 6.3869 6.3924 6.4497 6.4590 7.2033 7.2071 7.6675 7.6696 7.6973 7.7079 7.9493 7.9504 8.0737 8.0786 8.1074 8.1122 8.2204 8.2215 8.3812 8.3834 9.4120 9.4251 9.4608 9.4673 9.5315 9.5389 11.4152 11.4188 11.4469 11.4512 11.6168 11.6426 11.6493 11.6759 15.0416 15.0418 16.3719 16.4028 k = 0.3333 0.5774 0.0524 ( 4818 PWs) bands (ev): -16.3628 -16.3628 -16.3274 -16.3274 -9.4566 -9.4548 -8.1169 -8.1069 -7.9696 -7.9669 -7.9556 -7.9540 -7.7920 -7.7839 -7.6222 -7.6207 -2.9123 -2.8894 -2.8774 -2.8517 -1.0501 -1.0476 -0.9818 -0.9567 -0.8376 -0.7772 -0.7521 -0.7188 3.6312 3.6341 3.6449 3.6460 3.9445 3.9473 4.0273 4.0274 4.9815 5.0062 5.0163 5.0421 5.5001 5.5229 5.5244 5.5572 5.6599 5.6606 5.9541 5.9669 5.9724 5.9865 6.3914 6.3968 6.4459 6.4550 7.2010 7.2048 7.6735 7.6756 7.7026 7.7129 7.9105 7.9110 8.0827 8.0872 8.1110 8.1158 8.2624 8.2641 8.3774 8.3793 9.4102 9.4234 9.4593 9.4658 9.5298 9.5372 11.4044 11.4109 11.4342 11.4419 11.6220 11.6465 11.6577 11.6825 15.0478 15.0480 16.3509 16.3821 k = 0.3333 0.5774 0.0699 ( 4818 PWs) bands (ev): -16.3626 -16.3626 -16.3272 -16.3272 -9.4519 -9.4501 -8.1180 -8.1080 -7.9759 -7.9732 -7.9552 -7.9536 -7.7934 -7.7853 -7.6220 -7.6204 -2.9118 -2.8896 -2.8770 -2.8519 -1.0495 -1.0474 -0.9817 -0.9568 -0.8390 -0.7787 -0.7528 -0.7194 3.6369 3.6397 3.6603 3.6615 3.9509 3.9536 4.0337 4.0338 4.9788 5.0045 5.0123 5.0390 5.4767 5.4984 5.4992 5.5299 5.6496 5.6503 5.9750 5.9765 5.9921 5.9929 6.3988 6.4039 6.4416 6.4504 7.1977 7.2013 7.6818 7.6838 7.7097 7.7197 7.8667 7.8668 8.0952 8.0991 8.1212 8.1257 8.3053 8.3081 8.3726 8.3736 9.4077 9.4210 9.4571 9.4637 9.5275 9.5349 11.3907 11.4009 11.4186 11.4304 11.6280 11.6512 11.6673 11.6905 15.0563 15.0565 16.3287 16.3631 k = 0.3333 0.5774 0.0873 ( 4824 PWs) bands (ev): -16.3624 -16.3624 -16.3269 -16.3269 -9.4459 -9.4441 -8.1194 -8.1094 -7.9840 -7.9813 -7.9547 -7.9531 -7.7952 -7.7872 -7.6218 -7.6201 -2.9111 -2.8900 -2.8764 -2.8522 -1.0488 -1.0471 -0.9817 -0.9570 -0.8407 -0.7805 -0.7536 -0.7202 3.6441 3.6470 3.6801 3.6812 3.9591 3.9616 4.0418 4.0421 4.9753 5.0024 5.0072 5.0350 5.4490 5.4696 5.4704 5.4993 5.6365 5.6372 5.9816 5.9970 5.9996 6.0132 6.4097 6.4144 6.4379 6.4463 7.1928 7.1963 7.6922 7.6941 7.7184 7.7280 7.8212 7.8212 8.1108 8.1140 8.1361 8.1401 8.3438 8.3522 8.3664 8.3708 9.4044 9.4178 9.4543 9.4611 9.5245 9.5319 11.3749 11.3893 11.4011 11.4175 11.6338 11.6560 11.6771 11.6989 15.0671 15.0673 16.3066 16.3406 k = 0.3333 0.5774 0.1048 ( 4821 PWs) bands (ev): -16.3621 -16.3621 -16.3266 -16.3266 -9.4386 -9.4368 -8.1211 -8.1111 -7.9939 -7.9911 -7.9541 -7.9526 -7.7974 -7.7893 -7.6215 -7.6198 -2.9104 -2.8904 -2.8757 -2.8526 -1.0480 -1.0468 -0.9816 -0.9571 -0.8427 -0.7826 -0.7546 -0.7211 3.6530 3.6558 3.7042 3.7052 3.9690 3.9714 4.0518 4.0522 4.9710 4.9998 5.0011 5.0302 5.4181 5.4370 5.4398 5.4667 5.6206 5.6213 5.9850 5.9983 6.0208 6.0326 6.4247 6.4291 6.4366 6.4443 7.1861 7.1894 7.7045 7.7062 7.7276 7.7359 7.7767 7.7775 8.1294 8.1318 8.1548 8.1582 8.3506 8.3576 8.3958 8.3985 9.4004 9.4140 9.4509 9.4578 9.5209 9.5283 11.3579 11.3768 11.3826 11.4039 11.6389 11.6603 11.6864 11.7070 15.0801 15.0802 16.2851 16.3224 k = 0.3333 0.5774 0.1223 ( 4803 PWs) bands (ev): -16.3617 -16.3617 -16.3262 -16.3262 -9.4300 -9.4281 -8.1230 -8.1130 -8.0054 -8.0026 -7.9534 -7.9519 -7.7998 -7.7919 -7.6212 -7.6194 -2.9095 -2.8909 -2.8749 -2.8530 -1.0470 -1.0466 -0.9815 -0.9573 -0.8449 -0.7850 -0.7557 -0.7222 3.6635 3.6663 3.7324 3.7333 3.9807 3.9829 4.0634 4.0640 4.9661 4.9941 4.9968 5.0246 5.3850 5.4023 5.4077 5.4329 5.6019 5.6027 5.9839 5.9953 6.0379 6.0479 6.4387 6.4454 6.4463 6.4485 7.1769 7.1800 7.7184 7.7201 7.7216 7.7221 7.7493 7.7586 8.1506 8.1522 8.1767 8.1795 8.3420 8.3473 8.4384 8.4393 9.3956 9.4095 9.4468 9.4540 9.5167 9.5241 11.3403 11.3638 11.3638 11.3900 11.6428 11.6637 11.6944 11.7142 15.0952 15.0953 16.2645 16.2919 k = 0.3333 0.5774 0.1398 ( 4809 PWs) bands (ev): -16.3613 -16.3613 -16.3258 -16.3258 -9.4201 -9.4182 -8.1252 -8.1152 -8.0187 -8.0158 -7.9526 -7.9512 -7.8027 -7.7947 -7.6208 -7.6189 -2.9084 -2.8915 -2.8740 -2.8535 -1.0463 -1.0460 -0.9813 -0.9575 -0.8473 -0.7876 -0.7571 -0.7235 3.6756 3.6783 3.7646 3.7654 3.9940 3.9960 4.0768 4.0775 4.9604 4.9861 4.9932 5.0179 5.3505 5.3662 5.3746 5.3987 5.5807 5.5815 5.9779 5.9876 6.0486 6.0571 6.4477 6.4540 6.4700 6.4728 7.1646 7.1673 7.6817 7.6840 7.7336 7.7355 7.7579 7.7686 8.1739 8.1748 8.2012 8.2033 8.3307 8.3356 8.4799 8.4801 9.3901 9.4042 9.4422 9.4496 9.5118 9.5192 11.3226 11.3451 11.3508 11.3763 11.6450 11.6657 11.7007 11.7199 15.1122 15.1122 16.2451 16.2794 k = 0.3333 0.5774 0.1572 ( 4809 PWs) bands (ev): -16.3609 -16.3609 -16.3253 -16.3253 -9.4090 -9.4070 -8.1276 -8.1177 -8.0335 -8.0305 -7.9517 -7.9504 -7.8058 -7.7979 -7.6204 -7.6183 -2.9073 -2.8921 -2.8730 -2.8540 -1.0461 -1.0449 -0.9812 -0.9577 -0.8499 -0.7903 -0.7585 -0.7250 3.6892 3.6918 3.8008 3.8014 4.0091 4.0108 4.0918 4.0928 4.9539 4.9772 4.9889 5.0103 5.3152 5.3296 5.3412 5.3646 5.5570 5.5578 5.9668 5.9750 6.0515 6.0586 6.4640 6.4691 6.4996 6.5018 7.1482 7.1506 7.6422 7.6453 7.7496 7.7523 7.7713 7.7825 8.1989 8.1996 8.2279 8.2294 8.3177 8.3225 8.5198 8.5200 9.3839 9.3982 9.4368 9.4445 9.5063 9.5137 11.3052 11.3270 11.3382 11.3631 11.6455 11.6662 11.7051 11.7240 15.1309 15.1309 16.2270 16.2499 k = 0.3333 0.5774 0.1747 ( 4824 PWs) bands (ev): -16.3604 -16.3604 -16.3248 -16.3248 -9.3966 -9.3946 -8.1303 -8.1204 -8.0499 -8.0469 -7.9507 -7.9495 -7.8092 -7.8014 -7.6200 -7.6177 -2.9060 -2.8928 -2.8720 -2.8546 -1.0460 -1.0438 -0.9810 -0.9579 -0.8525 -0.7932 -0.7601 -0.7266 3.7044 3.7069 3.8408 3.8412 4.0258 4.0272 4.1085 4.1098 4.9466 4.9673 4.9838 5.0017 5.2797 5.2931 5.3079 5.3312 5.5309 5.5318 5.9507 5.9577 6.0459 6.0518 6.4881 6.4920 6.5336 6.5352 7.1270 7.1290 7.6065 7.6102 7.7663 7.7700 7.7857 7.7975 8.2252 8.2263 8.2564 8.2572 8.3033 8.3081 8.5581 8.5585 9.3768 9.3914 9.4309 9.4389 9.5002 9.5076 11.2885 11.3097 11.3261 11.3507 11.6440 11.6648 11.7072 11.7261 15.1511 15.1512 16.2106 16.2361 k = 0.3333 0.5774 0.1922 ( 4824 PWs) bands (ev): -16.3599 -16.3599 -16.3243 -16.3243 -9.3830 -9.3809 -8.1331 -8.1232 -8.0678 -8.0647 -7.9497 -7.9485 -7.8129 -7.8052 -7.6195 -7.6171 -2.9047 -2.8936 -2.8708 -2.8553 -1.0460 -1.0427 -0.9807 -0.9581 -0.8551 -0.7960 -0.7618 -0.7284 3.7211 3.7236 3.8845 3.8846 4.0442 4.0451 4.1268 4.1284 4.9384 4.9566 4.9777 4.9919 5.2446 5.2572 5.2752 5.2989 5.5026 5.5034 5.9302 5.9363 6.0324 6.0375 6.5195 6.5223 6.5715 6.5726 7.1002 7.1018 7.5757 7.5802 7.7834 7.7884 7.8006 7.8133 8.2528 8.2545 8.2860 8.2861 8.2881 8.2930 8.5948 8.5955 9.3690 9.3838 9.4243 9.4327 9.4936 9.5010 11.2729 11.2936 11.3150 11.3393 11.6403 11.6616 11.7071 11.7261 15.1728 15.1729 16.1956 16.2152 k = 0.3333 0.5774 0.2096 ( 4824 PWs) bands (ev): -16.3593 -16.3593 -16.3237 -16.3237 -9.3682 -9.3660 -8.1362 -8.1263 -8.0872 -8.0840 -7.9485 -7.9474 -7.8168 -7.8091 -7.6190 -7.6164 -2.9033 -2.8944 -2.8696 -2.8560 -1.0462 -1.0416 -0.9805 -0.9583 -0.8576 -0.7989 -0.7637 -0.7302 3.7394 3.7417 3.9314 3.9317 4.0642 4.0645 4.1466 4.1486 4.9291 4.9450 4.9704 4.9807 5.2103 5.2228 5.2435 5.2682 5.4721 5.4729 5.9056 5.9111 6.0122 6.0167 6.5571 6.5589 6.6127 6.6133 7.0674 7.0685 7.5503 7.5557 7.8006 7.8070 7.8156 7.8292 8.2705 8.2755 8.2814 8.2836 8.3177 8.3179 8.6299 8.6307 9.3604 9.3755 9.4170 9.4258 9.4866 9.4938 11.2586 11.2789 11.3049 11.3290 11.6346 11.6563 11.7045 11.7237 15.1956 15.1959 16.1823 16.2006 k = 0.3333 0.5774 0.2271 ( 4824 PWs) bands (ev): -16.3588 -16.3588 -16.3232 -16.3231 -9.3522 -9.3499 -8.1393 -8.1295 -8.1080 -8.1047 -7.9473 -7.9462 -7.8209 -7.8133 -7.6184 -7.6157 -2.9018 -2.8952 -2.8683 -2.8567 -1.0465 -1.0406 -0.9802 -0.9585 -0.8600 -0.8016 -0.7656 -0.7323 3.7592 3.7614 3.9814 3.9822 4.0853 4.0858 4.1678 4.1703 4.9186 4.9323 4.9615 4.9680 5.1776 5.1904 5.2131 5.2394 5.4396 5.4405 5.8776 5.8827 5.9864 5.9907 6.5998 6.6008 6.6569 6.6570 7.0285 7.0292 7.5306 7.5368 7.8177 7.8255 7.8303 7.8451 8.2524 8.2577 8.3109 8.3134 8.3494 8.3500 8.6633 8.6642 9.3510 9.3664 9.4090 9.4184 9.4791 9.4861 11.2458 11.2657 11.2961 11.3199 11.6268 11.6491 11.6995 11.7191 15.2195 15.2199 16.1706 16.1872 k = 0.3333 0.5774 0.2446 ( 4836 PWs) bands (ev): -16.3582 -16.3582 -16.3225 -16.3225 -9.3351 -9.3327 -8.1426 -8.1333 -8.1295 -8.1267 -7.9460 -7.9450 -7.8252 -7.8177 -7.6178 -7.6149 -2.9003 -2.8961 -2.8670 -2.8575 -1.0470 -1.0397 -0.9799 -0.9586 -0.8622 -0.8042 -0.7676 -0.7344 3.7804 3.7825 4.0340 4.0358 4.1075 4.1095 4.1904 4.1936 4.9066 4.9186 4.9504 4.9537 5.1468 5.1608 5.1844 5.2130 5.4053 5.4062 5.8465 5.8514 5.9563 5.9605 6.6465 6.6467 6.7032 6.7035 6.9838 6.9843 7.5163 7.5232 7.8343 7.8436 7.8444 7.8605 8.2333 8.2388 8.3409 8.3436 8.3818 8.3827 8.6949 8.6959 9.3407 9.3564 9.4003 9.4102 9.4712 9.4780 11.2346 11.2541 11.2885 11.3121 11.6170 11.6400 11.6921 11.7121 15.2443 15.2447 16.1604 16.1756 k = 0.3333 0.5774 0.2620 ( 4833 PWs) bands (ev): -16.3576 -16.3575 -16.3219 -16.3219 -9.3168 -9.3143 -8.1536 -8.1499 -8.1460 -8.1360 -7.9447 -7.9437 -7.8296 -7.8222 -7.6172 -7.6142 -2.8987 -2.8971 -2.8656 -2.8583 -1.0478 -1.0389 -0.9795 -0.9588 -0.8641 -0.8066 -0.7697 -0.7366 3.8031 3.8051 4.0878 4.0923 4.1308 4.1361 4.2143 4.2185 4.8931 4.9037 4.9369 4.9378 5.1187 5.1348 5.1576 5.1893 5.3694 5.3702 5.8129 5.8178 5.9229 5.9273 6.6958 6.6963 6.7514 6.7522 6.9340 6.9344 7.5067 7.5143 7.8502 7.8578 7.8609 7.8751 8.2133 8.2191 8.3714 8.3740 8.4148 8.4158 8.7246 8.7257 9.3296 9.3457 9.3909 9.4013 9.4631 9.4696 11.2252 11.2444 11.2823 11.3056 11.6055 11.6291 11.6823 11.7028 15.2697 15.2702 16.1517 16.1653 k = 0.3333 0.5774 0.2795 ( 4830 PWs) bands (ev): -16.3569 -16.3569 -16.3213 -16.3213 -9.2975 -9.2949 -8.1780 -8.1742 -8.1494 -8.1395 -7.9432 -7.9423 -7.8341 -7.8269 -7.6166 -7.6134 -2.8981 -2.8971 -2.8642 -2.8591 -1.0488 -1.0383 -0.9791 -0.9589 -0.8658 -0.8088 -0.7719 -0.7389 3.8272 3.8290 4.1373 4.1513 4.1554 4.1712 4.2395 4.2449 4.8781 4.8875 4.9201 4.9205 5.0934 5.1128 5.1331 5.1683 5.3319 5.3327 5.7770 5.7820 5.8868 5.8915 6.7472 6.7486 6.8013 6.8027 6.8799 6.8803 7.5012 7.5095 7.8650 7.8701 7.8772 7.8887 8.1924 8.1986 8.4020 8.4044 8.4480 8.4490 8.7525 8.7537 9.3178 9.3342 9.3806 9.3917 9.4547 9.4609 11.2177 11.2365 11.2773 11.3003 11.5924 11.6166 11.6704 11.6914 15.2956 15.2962 16.1443 16.1564 k = 0.3333 0.5774 0.2970 ( 4830 PWs) bands (ev): -16.3563 -16.3563 -16.3206 -16.3206 -9.2772 -9.2744 -8.2035 -8.1996 -8.1529 -8.1430 -7.9418 -7.9409 -7.8387 -7.8316 -7.6160 -7.6125 -2.8991 -2.8955 -2.8628 -2.8600 -1.0500 -1.0378 -0.9787 -0.9590 -0.8671 -0.8106 -0.7741 -0.7413 3.8528 3.8544 4.1735 4.1810 4.2119 4.2234 4.2657 4.2736 4.8617 4.8700 4.9010 4.9016 5.0715 5.0950 5.1109 5.1502 5.2930 5.2939 5.7391 5.7445 5.8488 5.8539 6.7975 6.8027 6.8207 6.8255 6.8539 6.8546 7.4991 7.5081 7.8786 7.8810 7.8921 7.9010 8.1708 8.1774 8.4326 8.4346 8.4814 8.4822 8.7785 8.7798 9.3051 9.3218 9.3696 9.3813 9.4462 9.4520 11.2121 11.2305 11.2736 11.2962 11.5779 11.6028 11.6564 11.6780 15.3218 15.3226 16.1381 16.1487 k = 0.3333 0.5774 0.3144 ( 4812 PWs) bands (ev): -16.3557 -16.3557 -16.3200 -16.3200 -9.2559 -9.2529 -8.2301 -8.2260 -8.1563 -8.1465 -7.9402 -7.9394 -7.8433 -7.8364 -7.6154 -7.6117 -2.9001 -2.8939 -2.8614 -2.8608 -1.0515 -1.0375 -0.9783 -0.9591 -0.8681 -0.8122 -0.7763 -0.7437 3.8796 3.8811 4.2035 4.2076 4.2709 4.2851 4.2929 4.3074 4.8442 4.8514 4.8807 4.8808 5.0528 5.0811 5.0911 5.1347 5.2530 5.2539 5.6997 5.7055 5.8092 5.8150 6.7592 6.7600 6.8578 6.8584 6.9059 6.9076 7.4999 7.5096 7.8904 7.8906 7.9054 7.9116 8.1486 8.1557 8.4630 8.4646 8.5147 8.5152 8.8028 8.8041 9.2915 9.3085 9.3576 9.3700 9.4376 9.4431 11.2084 11.2264 11.2711 11.2929 11.5627 11.5880 11.6406 11.6628 15.3483 15.3492 16.1329 16.1420 k = 0.3333 0.5774 0.3319 ( 4803 PWs) bands (ev): -16.3551 -16.3550 -16.3193 -16.3193 -9.2337 -9.2305 -8.2575 -8.2532 -8.1598 -8.1499 -7.9386 -7.9378 -7.8480 -7.8412 -7.6147 -7.6109 -2.9011 -2.8923 -2.8617 -2.8600 -1.0531 -1.0374 -0.9778 -0.9592 -0.8687 -0.8133 -0.7785 -0.7462 3.9078 3.9090 4.2327 4.2349 4.3167 4.3208 4.3509 4.3576 4.8258 4.8320 4.8586 4.8598 5.0372 5.0703 5.0736 5.1215 5.2119 5.2130 5.6588 5.6652 5.7686 5.7750 6.6958 6.6961 6.9135 6.9151 6.9592 6.9615 7.5030 7.5134 7.8980 7.9008 7.9168 7.9205 8.1259 8.1335 8.4930 8.4943 8.5478 8.5478 8.8252 8.8265 9.2772 9.2945 9.3448 9.3578 9.4291 9.4342 11.2066 11.2241 11.2695 11.2904 11.5470 11.5724 11.6231 11.6459 15.3748 15.3758 16.1285 16.1363 k = 0.3333 0.5774 0.3494 ( 4800 PWs) bands (ev): -16.3545 -16.3544 -16.3187 -16.3187 -9.2106 -9.2072 -8.2857 -8.2812 -8.1632 -8.1533 -7.9370 -7.9362 -7.8526 -7.8460 -7.6141 -7.6101 -2.9021 -2.8907 -2.8625 -2.8586 -1.0550 -1.0374 -0.9774 -0.9592 -0.8690 -0.8142 -0.7808 -0.7487 3.9372 3.9382 4.2619 4.2629 4.3491 4.3506 4.4192 4.4224 4.8071 4.8123 4.8362 4.8386 5.0243 5.0582 5.0621 5.1101 5.1701 5.1716 5.6168 5.6239 5.7273 5.7344 6.6298 6.6298 6.9703 6.9725 7.0132 7.0160 7.5081 7.5193 7.9036 7.9090 7.9260 7.9272 8.1028 8.1110 8.5224 8.5237 8.5798 8.5805 8.8458 8.8471 9.2620 9.2795 9.3310 9.3445 9.4209 9.4256 11.2067 11.2235 11.2687 11.2881 11.5313 11.5565 11.6043 11.6276 15.4013 15.4025 16.1248 16.1313 k = 0.3333 0.5774 0.3669 ( 4800 PWs) bands (ev): -16.3539 -16.3538 -16.3181 -16.3181 -9.1867 -9.1831 -8.3146 -8.3098 -8.1664 -8.1567 -7.9353 -7.9345 -7.8573 -7.8508 -7.6135 -7.6093 -2.9031 -2.8891 -2.8633 -2.8572 -1.0570 -1.0377 -0.9769 -0.9592 -0.8690 -0.8146 -0.7830 -0.7513 3.9679 3.9686 4.2913 4.2915 4.3777 4.3818 4.4894 4.4918 4.7885 4.7930 4.8147 4.8176 5.0138 5.0449 5.0556 5.0990 5.1278 5.1311 5.5738 5.5817 5.6856 5.6934 6.5614 6.5617 7.0276 7.0302 7.0675 7.0708 7.5148 7.5268 7.9070 7.9149 7.9318 7.9327 8.0795 8.0883 8.5509 8.5530 8.6113 8.6128 8.8647 8.8659 9.2459 9.2637 9.3163 9.3302 9.4128 9.4172 11.2085 11.2246 11.2682 11.2858 11.5161 11.5407 11.5845 11.6082 15.4278 15.4291 16.1216 16.1270 k = 0.3333 0.5774 0.3843 ( 4812 PWs) bands (ev): -16.3533 -16.3533 -16.3175 -16.3175 -9.1622 -9.1583 -8.3441 -8.3390 -8.1696 -8.1599 -7.9336 -7.9328 -7.8618 -7.8556 -7.6129 -7.6085 -2.9041 -2.8877 -2.8642 -2.8559 -1.0591 -1.0381 -0.9764 -0.9592 -0.8687 -0.8147 -0.7852 -0.7538 3.9996 4.0000 4.3200 4.3213 4.4059 4.4122 4.5608 4.5633 4.7705 4.7750 4.7952 4.7975 5.0052 5.0333 5.0501 5.0777 5.0859 5.1019 5.5300 5.5389 5.6439 5.6525 6.4913 6.4917 7.0849 7.0881 7.1217 7.1257 7.5228 7.5359 7.9079 7.9183 7.9339 7.9369 8.0560 8.0656 8.5787 8.5819 8.6422 8.6445 8.8819 8.8830 9.2291 9.2471 9.3006 9.3149 9.4050 9.4091 11.2120 11.2273 11.2680 11.2830 11.5021 11.5254 11.5638 11.5878 15.4541 15.4556 16.1188 16.1233 k = 0.3333 0.5774 0.4018 ( 4806 PWs) bands (ev): -16.3527 -16.3527 -16.3169 -16.3169 -9.1370 -9.1328 -8.3740 -8.3686 -8.1727 -8.1629 -7.9318 -7.9310 -7.8663 -7.8602 -7.6123 -7.6077 -2.9051 -2.8862 -2.8650 -2.8547 -1.0613 -1.0386 -0.9759 -0.9592 -0.8681 -0.8145 -0.7874 -0.7564 4.0324 4.0325 4.3486 4.3511 4.4333 4.4417 4.6324 4.6353 4.7532 4.7596 4.7791 4.7794 4.9982 5.0233 5.0363 5.0390 5.0533 5.0917 5.4856 5.4956 5.6024 5.6118 6.4196 6.4203 7.1420 7.1458 7.1757 7.1803 7.5320 7.5462 7.9064 7.9191 7.9335 7.9384 8.0325 8.0430 8.6059 8.6104 8.6723 8.6757 8.8975 8.8984 9.2115 9.2298 9.2840 9.2986 9.3977 9.4016 11.2170 11.2314 11.2676 11.2794 11.4898 11.5112 11.5426 11.5670 15.4802 15.4819 16.1162 16.1200 k = 0.3333 0.5774 0.4193 ( 4812 PWs) bands (ev): -16.3522 -16.3522 -16.3164 -16.3164 -9.1114 -9.1067 -8.4042 -8.3984 -8.1756 -8.1658 -7.9300 -7.9291 -7.8707 -7.8648 -7.6118 -7.6070 -2.9060 -2.8849 -2.8657 -2.8535 -1.0635 -1.0392 -0.9755 -0.9591 -0.8673 -0.8139 -0.7895 -0.7590 4.0659 4.0662 4.3768 4.3806 4.4588 4.4695 4.6991 4.7039 4.7366 4.7481 4.7675 4.7707 4.9925 4.9980 4.9981 5.0147 5.0469 5.0857 5.4408 5.4520 5.5616 5.5718 6.3465 6.3476 7.1986 7.2029 7.2291 7.2344 7.5422 7.5576 7.9021 7.9170 7.9304 7.9369 8.0092 8.0207 8.6324 8.6384 8.7017 8.7062 8.9115 8.9122 9.1932 9.2119 9.2666 9.2814 9.3907 9.3944 11.2234 11.2368 11.2668 11.2747 11.4796 11.4984 11.5213 11.5458 15.5061 15.5081 16.1138 16.1171 k = 0.3333 0.5774 0.4367 ( 4800 PWs) bands (ev): -16.3517 -16.3517 -16.3159 -16.3159 -9.0854 -9.0802 -8.4346 -8.4282 -8.1782 -8.1685 -7.9281 -7.9271 -7.8749 -7.8692 -7.6112 -7.6064 -2.9068 -2.8836 -2.8664 -2.8524 -1.0656 -1.0400 -0.9750 -0.9591 -0.8663 -0.8130 -0.7915 -0.7616 4.1001 4.1008 4.4043 4.4095 4.4814 4.4944 4.7215 4.7274 4.7409 4.7419 4.7934 4.7971 4.9600 4.9601 4.9879 5.0074 5.0443 5.0813 5.3957 5.4084 5.5217 5.5328 6.2722 6.2736 7.2543 7.2592 7.2815 7.2878 7.5531 7.5699 7.8950 7.9119 7.9246 7.9325 7.9862 7.9988 8.6582 8.6658 8.7303 8.7360 8.9240 8.9244 9.1744 9.1934 9.2485 9.2633 9.3842 9.3879 11.2309 11.2433 11.2654 11.2687 11.4719 11.4873 11.5001 11.5247 15.5318 15.5342 16.0937 16.0945 k = 0.3333 0.5774 0.4542 ( 4800 PWs) bands (ev): -16.3513 -16.3513 -16.3154 -16.3154 -9.0593 -9.0536 -8.4648 -8.4579 -8.1807 -8.1710 -7.9262 -7.9251 -7.8791 -7.8735 -7.6107 -7.6057 -2.9076 -2.8825 -2.8671 -2.8514 -1.0677 -1.0407 -0.9746 -0.9590 -0.8652 -0.8119 -0.7935 -0.7641 4.1349 4.1360 4.4306 4.4373 4.4997 4.5151 4.7081 4.7189 4.7419 4.7458 4.8413 4.8469 4.9381 4.9394 4.9843 5.0010 5.0427 5.0779 5.3506 5.3650 5.4833 5.4953 6.1968 6.1987 7.3089 7.3143 7.3327 7.3399 7.5646 7.5831 7.8851 7.9039 7.9161 7.9251 7.9636 7.9775 8.6832 8.6925 8.7579 8.7651 8.9349 8.9351 9.1550 9.1746 9.2297 9.2447 9.3783 9.3819 11.2393 11.2508 11.2616 11.2635 11.4665 11.4778 11.4792 11.5040 15.5574 15.5601 16.0563 16.0564 k = 0.3333 0.5774 0.4717 ( 4794 PWs) bands (ev): -16.3509 -16.3508 -16.3150 -16.3150 -9.0333 -9.0269 -8.4947 -8.4871 -8.1829 -8.1732 -7.9242 -7.9231 -7.8830 -7.8777 -7.6103 -7.6052 -2.9083 -2.8814 -2.8677 -2.8505 -1.0696 -1.0415 -0.9742 -0.9589 -0.8641 -0.8106 -0.7953 -0.7666 4.1701 4.1717 4.4550 4.4635 4.5129 4.5303 4.6969 4.7075 4.7493 4.7529 4.8389 4.8447 4.9747 4.9753 4.9814 4.9956 5.0421 5.0756 5.3056 5.3220 5.4467 5.4596 6.1206 6.1230 7.3619 7.3680 7.3823 7.3906 7.5764 7.5969 7.8723 7.8927 7.9052 7.9147 7.9415 7.9570 8.7073 8.7185 8.7844 8.7933 8.9440 8.9448 9.1354 9.1556 9.2106 9.2256 9.3730 9.3765 11.2474 11.2537 11.2592 11.2621 11.4588 11.4631 11.4693 11.4847 15.5829 15.5860 16.0176 16.0184 k = 0.3333 0.5774 0.4891 ( 4788 PWs) bands (ev): -16.3505 -16.3505 -16.3146 -16.3146 -9.0077 -9.0005 -8.5239 -8.5154 -8.1849 -8.1752 -7.9221 -7.9209 -7.8868 -7.8817 -7.6099 -7.6047 -2.9090 -2.8805 -2.8682 -2.8497 -1.0714 -1.0422 -0.9738 -0.9589 -0.8629 -0.8091 -0.7969 -0.7690 4.2052 4.2075 4.4770 4.4873 4.5209 4.5395 4.6882 4.6971 4.7639 4.7645 4.8065 4.8151 4.9791 4.9911 5.0303 5.0411 5.0554 5.0764 5.2612 5.2798 5.4125 5.4263 6.0436 6.0467 7.4130 7.4197 7.4298 7.4394 7.5882 7.6110 7.8570 7.8785 7.8920 7.9015 7.9200 7.9373 8.7304 8.7436 8.8097 8.8205 8.9515 8.9533 9.1156 9.1367 9.1912 9.2063 9.3683 9.3718 11.2454 11.2509 11.2654 11.2683 11.4391 11.4571 11.4615 11.4715 15.6084 15.6120 15.9798 15.9814 k = 0.3333 0.5774 0.5066 ( 4794 PWs) bands (ev): -16.3502 -16.3502 -16.3143 -16.3143 -8.9831 -8.9750 -8.5519 -8.5425 -8.1866 -8.1769 -7.9200 -7.9187 -7.8904 -7.8854 -7.6096 -7.6043 -2.9095 -2.8797 -2.8686 -2.8490 -1.0729 -1.0429 -0.9735 -0.9588 -0.8618 -0.8076 -0.7984 -0.7713 4.2398 4.2429 4.4958 4.5081 4.5247 4.5437 4.6822 4.6880 4.7596 4.7705 4.7845 4.8052 4.9773 4.9873 5.0353 5.0677 5.1233 5.1245 5.2181 5.2389 5.3815 5.3961 5.9663 5.9703 7.4618 7.4692 7.4747 7.4857 7.5997 7.6252 7.8392 7.8614 7.8771 7.8857 7.8992 7.9187 8.7520 8.7674 8.8333 8.8465 8.9574 8.9606 9.0962 9.1185 9.1720 9.1873 9.3642 9.3677 11.2374 11.2487 11.2748 11.2781 11.4203 11.4397 11.4611 11.4659 15.6337 15.6381 15.9433 15.9457 k = 0.3333 0.5774 0.5241 ( 4782 PWs) bands (ev): -16.3500 -16.3499 -16.3141 -16.3140 -8.9602 -8.9509 -8.5780 -8.5674 -8.1880 -8.1783 -7.9178 -7.9165 -7.8938 -7.8890 -7.6093 -7.6039 -2.9100 -2.8791 -2.8690 -2.8484 -1.0742 -1.0435 -0.9733 -0.9587 -0.8608 -0.8061 -0.7997 -0.7734 4.2732 4.2772 4.5109 4.5251 4.5257 4.5446 4.6788 4.6788 4.7285 4.7379 4.8091 4.8281 4.9757 4.9844 5.0337 5.0679 5.1703 5.1980 5.2001 5.2068 5.3543 5.3697 5.8892 5.8943 7.5078 7.5158 7.5161 7.5290 7.6105 7.6391 7.8196 7.8417 7.8610 7.8678 7.8796 7.9017 8.7716 8.7895 8.8547 8.8709 8.9617 8.9669 9.0776 9.1014 9.1536 9.1691 9.3608 9.3643 11.2301 11.2452 11.2862 11.2884 11.4026 11.4216 11.4614 11.4632 15.6590 15.6644 15.9083 15.9117 k = 0.3333 0.5774 0.5416 ( 4794 PWs) bands (ev): -16.3498 -16.3497 -16.3138 -16.3138 -8.9398 -8.9292 -8.6012 -8.5894 -8.1891 -8.1794 -7.9157 -7.9143 -7.8969 -7.8922 -7.6091 -7.6036 -2.9104 -2.8786 -2.8693 -2.8479 -1.0753 -1.0440 -0.9731 -0.9587 -0.8599 -0.8046 -0.8008 -0.7752 4.3038 4.3090 4.5221 4.5253 4.5379 4.5438 4.6651 4.6777 4.6961 4.7148 4.8354 4.8592 4.9737 4.9821 5.0298 5.0674 5.1337 5.1647 5.2724 5.2803 5.3320 5.3479 5.8132 5.8201 7.5500 7.5530 7.5585 7.5679 7.6198 7.6518 7.7986 7.8201 7.8445 7.8487 7.8618 7.8868 8.7886 8.8090 8.8732 8.8932 8.9640 8.9721 9.0606 9.0863 9.1367 9.1526 9.3581 9.3617 11.2240 11.2418 11.2981 11.2992 11.3860 11.4044 11.4617 11.4621 15.6840 15.6909 15.8749 15.8799 k = 0.3333 0.5774 0.5590 ( 4800 PWs) bands (ev): -16.3496 -16.3496 -16.3137 -16.3137 -8.9234 -8.9115 -8.6201 -8.6069 -8.1899 -8.1802 -7.9135 -7.9122 -7.8998 -7.8950 -7.6089 -7.6034 -2.9106 -2.8782 -2.8696 -2.8476 -1.0761 -1.0444 -0.9729 -0.9586 -0.8593 -0.8035 -0.8015 -0.7767 4.3298 4.3362 4.5241 4.5298 4.5424 4.5466 4.6458 4.6684 4.6780 4.7046 4.8606 4.8932 4.9711 4.9807 5.0212 5.0670 5.1010 5.1348 5.3142 5.3315 5.3436 5.3531 5.7406 5.7504 7.5835 7.5870 7.5956 7.6007 7.6270 7.6622 7.7775 7.7982 7.8292 7.8303 7.8471 7.8753 8.8020 8.8250 8.8876 8.9124 8.9643 8.9763 9.0465 9.0742 9.1227 9.1391 9.3562 9.3597 11.2193 11.2390 11.3100 11.3102 11.3707 11.3888 11.4610 11.4628 15.7078 15.7175 15.8433 15.8511 k = 0.3333 0.5774 0.5765 ( 4794 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9126 -8.8997 -8.6326 -8.6184 -8.1904 -8.1807 -7.9117 -7.9106 -7.9020 -7.8971 -7.6088 -7.6033 -2.9108 -2.8780 -2.8697 -2.8474 -1.0765 -1.0446 -0.9728 -0.9586 -0.8589 -0.8027 -0.8020 -0.7777 4.3478 4.3554 4.5233 4.5340 4.5412 4.5515 4.6289 4.6494 4.6787 4.7015 4.8803 4.9271 4.9679 4.9800 5.0038 5.0668 5.0803 5.1140 5.3041 5.3213 5.4011 5.4155 5.6786 5.6929 7.6049 7.6153 7.6231 7.6241 7.6311 7.6688 7.7597 7.7796 7.8158 7.8176 7.8372 7.8679 8.8106 8.8357 8.8969 8.9268 8.9628 8.9791 9.0369 9.0663 9.1133 9.1300 9.3550 9.3586 11.2164 11.2372 11.3201 11.3207 11.3578 11.3764 11.4607 11.4633 15.7282 15.7429 15.8149 15.8278 k = 0.3333 0.5774 0.5940 ( 4788 PWs) bands (ev): -16.3495 -16.3495 -16.3136 -16.3136 -8.9088 -8.8954 -8.6371 -8.6225 -8.1905 -8.1809 -7.9108 -7.9099 -7.9030 -7.8979 -7.6088 -7.6032 -2.9109 -2.8779 -2.8697 -2.8473 -1.0767 -1.0447 -0.9728 -0.9586 -0.8587 -0.8024 -0.8022 -0.7780 4.3544 4.3625 4.5230 4.5353 4.5407 4.5531 4.6223 4.6425 4.6791 4.7009 4.8883 4.9483 4.9663 4.9798 4.9876 5.0667 5.0740 5.1064 5.3005 5.3179 5.4264 5.4445 5.6499 5.6677 7.6130 7.6269 7.6322 7.6323 7.6346 7.6707 7.7521 7.7716 7.8100 7.8131 7.8336 7.8653 8.8136 8.8394 8.9001 8.9326 8.9614 8.9802 9.0335 9.0635 9.1099 9.1267 9.3547 9.3583 11.2155 11.2366 11.3247 11.3264 11.3512 11.3710 11.4606 11.4635 15.7375 15.7582 15.7987 15.8175 Writing output data file BaCoO3.save init_run : 3.89s CPU 13.93s WALL ( 1 calls) electrons : 2847.27s CPU 2877.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.46s CPU 1.55s WALL ( 1 calls) Called by electrons: c_bands : 2847.24s CPU 2877.46s WALL ( 1 calls) v_of_rho : 0.27s CPU 0.86s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.26s CPU 0.59s WALL ( 1 calls) newd : 0.49s CPU 0.68s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.15s WALL ( 291 calls) cegterg : 2764.21s CPU 2789.03s WALL ( 1442 calls) Called by sum_band: Called by *egterg: h_psi : 677.56s CPU 693.91s WALL ( 29012 calls) s_psi : 111.27s CPU 112.20s WALL ( 29012 calls) g_psi : 1.56s CPU 1.69s WALL ( 27279 calls) cdiaghg : 1593.89s CPU 1591.35s WALL ( 27570 calls) cegterg:over : 187.12s CPU 178.98s WALL ( 27279 calls) cegterg:upda : 64.25s CPU 69.80s WALL ( 27279 calls) cegterg:last : 37.36s CPU 38.01s WALL ( 2606 calls) Called by h_psi: h_psi:vloc : 458.48s CPU 471.43s WALL ( 29012 calls) h_psi:vnl : 218.24s CPU 220.74s WALL ( 29012 calls) add_vuspsi : 83.41s CPU 92.25s WALL ( 29012 calls) General routines calbec : 134.70s CPU 128.31s WALL ( 29012 calls) fft : 0.47s CPU 1.24s WALL ( 19 calls) ffts : 0.00s CPU 0.03s WALL ( 4 calls) fftw : 438.16s CPU 434.85s WALL ( 2696436 calls) interpolate : 0.06s CPU 0.14s WALL ( 4 calls) davcio : 0.05s CPU 4.83s WALL ( 582 calls) Parallel routines fft_scatter : 338.16s CPU 289.27s WALL ( 2696459 calls) PWSCF : 48m50.49s CPU 52m17.61s WALL This run was terminated on: 1: 9:19 2Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=