Program PWSCF v.5.1.1 starts on 7Dec2015 at 6:20:48 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: ./BNCl2.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S 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 72 41 11 3230 1360 208 Max 73 42 12 3236 1385 212 Sum 3497 1975 569 155257 66023 10107 bravais-lattice index = 14 lattice parameter (alat) = 11.6240 a.u. unit-cell volume = 1568.2092 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.623985 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.031503 celldm(5)= -0.031503 celldm(6)= -0.031503 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.031503 0.999504 0.000000 ) a(3) = ( -0.031503 -0.032512 0.998975 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.031519 0.032562 ) b(2) = ( 0.000000 1.000497 0.032562 ) b(3) = ( 0.000000 0.000000 1.001026 ) PseudoPot. # 1 for Cl read from file: /home/autes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for B read from file: /home/autes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cl 7.00 35.45300 Cl( 1.00) B 3.00 10.81100 B( 1.00) N 5.00 14.00670 N( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 282 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0110166 -0.0113693 0.0110053), wk = 0.0035461 k( 3) = ( 0.0220332 -0.0227386 0.0220106), wk = 0.0035461 k( 4) = ( 0.0330497 -0.0341078 0.0330158), wk = 0.0035461 k( 5) = ( 0.0440663 -0.0454771 0.0440211), wk = 0.0035461 k( 6) = ( 0.0550829 -0.0568464 0.0550264), wk = 0.0035461 k( 7) = ( 0.0660995 -0.0682157 0.0660317), wk = 0.0035461 k( 8) = ( 0.0771160 -0.0795850 0.0770370), wk = 0.0035461 k( 9) = ( 0.0881326 -0.0909542 0.0880422), wk = 0.0035461 k( 10) = ( 0.0991492 -0.1023235 0.0990475), wk = 0.0035461 k( 11) = ( 0.1101658 -0.1136928 0.1100528), wk = 0.0035461 k( 12) = ( 0.1211823 -0.1250621 0.1210581), wk = 0.0035461 k( 13) = ( 0.1321989 -0.1364314 0.1320634), wk = 0.0035461 k( 14) = ( 0.1432155 -0.1478006 0.1430687), wk = 0.0035461 k( 15) = ( 0.1542321 -0.1591699 0.1540739), wk = 0.0035461 k( 16) = ( 0.1652486 -0.1705392 0.1650792), wk = 0.0035461 k( 17) = ( 0.1762652 -0.1819085 0.1760845), wk = 0.0035461 k( 18) = ( 0.1872818 -0.1932778 0.1870898), wk = 0.0035461 k( 19) = ( 0.1982984 -0.2046470 0.1980951), wk = 0.0035461 k( 20) = ( 0.2093149 -0.2160163 0.2091003), wk = 0.0035461 k( 21) = ( 0.2203315 -0.2273856 0.2201056), wk = 0.0035461 k( 22) = ( 0.2313481 -0.2387549 0.2311109), wk = 0.0035461 k( 23) = ( 0.2423647 -0.2501242 0.2421162), wk = 0.0035461 k( 24) = ( 0.2533813 -0.2614934 0.2531215), wk = 0.0035461 k( 25) = ( 0.2643978 -0.2728627 0.2641267), wk = 0.0035461 k( 26) = ( 0.2754144 -0.2842320 0.2751320), wk = 0.0035461 k( 27) = ( 0.2864310 -0.2956013 0.2861373), wk = 0.0035461 k( 28) = ( 0.2974476 -0.3069705 0.2971426), wk = 0.0035461 k( 29) = ( 0.3084641 -0.3183398 0.3081479), wk = 0.0035461 k( 30) = ( 0.3194807 -0.3297091 0.3191531), wk = 0.0035461 k( 31) = ( 0.3304973 -0.3410784 0.3301584), wk = 0.0035461 k( 32) = ( 0.3415139 -0.3524477 0.3411637), wk = 0.0035461 k( 33) = ( 0.3525304 -0.3638169 0.3521690), wk = 0.0035461 k( 34) = ( 0.3635470 -0.3751862 0.3631743), wk = 0.0035461 k( 35) = ( 0.3745636 -0.3865555 0.3741795), wk = 0.0035461 k( 36) = ( 0.3855802 -0.3979248 0.3851848), wk = 0.0035461 k( 37) = ( 0.3965967 -0.4092941 0.3961901), wk = 0.0035461 k( 38) = ( 0.4076133 -0.4206633 0.4071954), wk = 0.0035461 k( 39) = ( 0.4186299 -0.4320326 0.4182007), wk = 0.0035461 k( 40) = ( 0.4296465 -0.4434019 0.4292060), wk = 0.0035461 k( 41) = ( 0.4406630 -0.4547712 0.4402112), wk = 0.0035461 k( 42) = ( 0.4516796 -0.4661405 0.4512165), wk = 0.0035461 k( 43) = ( 0.4626962 -0.4775097 0.4622218), wk = 0.0035461 k( 44) = ( 0.4737128 -0.4888790 0.4732271), wk = 0.0035461 k( 45) = ( 0.4847293 -0.5002483 0.4842324), wk = 0.0035461 k( 46) = ( 0.4847293 -0.5002483 0.4842324), wk = 0.0035461 k( 47) = ( 0.4923647 -0.4923685 0.4923728), wk = 0.0035461 k( 48) = ( 0.5000000 -0.4844887 0.5005132), wk = 0.0035461 k( 49) = ( 0.5000000 -0.4844887 0.5005132), wk = 0.0035461 k( 50) = ( 0.4993892 -0.4651092 0.5005132), wk = 0.0035461 k( 51) = ( 0.4987783 -0.4457296 0.5005132), wk = 0.0035461 k( 52) = ( 0.4981675 -0.4263501 0.5005132), wk = 0.0035461 k( 53) = ( 0.4975567 -0.4069705 0.5005132), wk = 0.0035461 k( 54) = ( 0.4969459 -0.3875910 0.5005132), wk = 0.0035461 k( 55) = ( 0.4963350 -0.3682114 0.5005132), wk = 0.0035461 k( 56) = ( 0.4957242 -0.3488319 0.5005132), wk = 0.0035461 k( 57) = ( 0.4951134 -0.3294523 0.5005132), wk = 0.0035461 k( 58) = ( 0.4945026 -0.3100728 0.5005132), wk = 0.0035461 k( 59) = ( 0.4938917 -0.2906932 0.5005132), wk = 0.0035461 k( 60) = ( 0.4932809 -0.2713137 0.5005132), wk = 0.0035461 k( 61) = ( 0.4926701 -0.2519341 0.5005132), wk = 0.0035461 k( 62) = ( 0.4920593 -0.2325546 0.5005132), wk = 0.0035461 k( 63) = ( 0.4914484 -0.2131750 0.5005132), wk = 0.0035461 k( 64) = ( 0.4908376 -0.1937955 0.5005132), wk = 0.0035461 k( 65) = ( 0.4902268 -0.1744159 0.5005132), wk = 0.0035461 k( 66) = ( 0.4896160 -0.1550364 0.5005132), wk = 0.0035461 k( 67) = ( 0.4890051 -0.1356569 0.5005132), wk = 0.0035461 k( 68) = ( 0.4883943 -0.1162773 0.5005132), wk = 0.0035461 k( 69) = ( 0.4877835 -0.0968977 0.5005132), wk = 0.0035461 k( 70) = ( 0.4871726 -0.0775182 0.5005132), wk = 0.0035461 k( 71) = ( 0.4865618 -0.0581386 0.5005132), wk = 0.0035461 k( 72) = ( 0.4859510 -0.0387591 0.5005132), wk = 0.0035461 k( 73) = ( 0.4853402 -0.0193795 0.5005132), wk = 0.0035461 k( 74) = ( 0.4847293 0.0000000 0.5005132), wk = 0.0035461 k( 75) = ( 0.4841185 0.0193795 0.5005132), wk = 0.0035461 k( 76) = ( 0.4835077 0.0387591 0.5005132), wk = 0.0035461 k( 77) = ( 0.4828969 0.0581386 0.5005132), wk = 0.0035461 k( 78) = ( 0.4822860 0.0775182 0.5005132), wk = 0.0035461 k( 79) = ( 0.4816752 0.0968978 0.5005132), wk = 0.0035461 k( 80) = ( 0.4810644 0.1162773 0.5005132), wk = 0.0035461 k( 81) = ( 0.4804536 0.1356568 0.5005132), wk = 0.0035461 k( 82) = ( 0.4798427 0.1550364 0.5005132), wk = 0.0035461 k( 83) = ( 0.4792319 0.1744159 0.5005132), wk = 0.0035461 k( 84) = ( 0.4786211 0.1937955 0.5005132), wk = 0.0035461 k( 85) = ( 0.4780103 0.2131750 0.5005132), wk = 0.0035461 k( 86) = ( 0.4773994 0.2325546 0.5005132), wk = 0.0035461 k( 87) = ( 0.4767886 0.2519341 0.5005132), wk = 0.0035461 k( 88) = ( 0.4761778 0.2713137 0.5005132), wk = 0.0035461 k( 89) = ( 0.4755669 0.2906932 0.5005132), wk = 0.0035461 k( 90) = ( 0.4749561 0.3100728 0.5005132), wk = 0.0035461 k( 91) = ( 0.4743453 0.3294523 0.5005132), wk = 0.0035461 k( 92) = ( 0.4737345 0.3488319 0.5005132), wk = 0.0035461 k( 93) = ( 0.4731236 0.3682114 0.5005132), wk = 0.0035461 k( 94) = ( 0.4725128 0.3875910 0.5005132), wk = 0.0035461 k( 95) = ( 0.4719020 0.4069705 0.5005132), wk = 0.0035461 k( 96) = ( 0.4712912 0.4263501 0.5005132), wk = 0.0035461 k( 97) = ( 0.4706803 0.4457296 0.5005132), wk = 0.0035461 k( 98) = ( 0.4700695 0.4651092 0.5005132), wk = 0.0035461 k( 99) = ( 0.4694587 0.4844887 0.5005132), wk = 0.0035461 k( 100) = ( 0.4694587 0.4844887 0.5005132), wk = 0.0035461 k( 101) = ( 0.4585410 0.4732216 0.4888733), wk = 0.0035461 k( 102) = ( 0.4476234 0.4619544 0.4772335), wk = 0.0035461 k( 103) = ( 0.4367058 0.4506872 0.4655936), wk = 0.0035461 k( 104) = ( 0.4257881 0.4394200 0.4539538), wk = 0.0035461 k( 105) = ( 0.4148705 0.4281528 0.4423140), wk = 0.0035461 k( 106) = ( 0.4039528 0.4168857 0.4306741), wk = 0.0035461 k( 107) = ( 0.3930352 0.4056185 0.4190343), wk = 0.0035461 k( 108) = ( 0.3821175 0.3943513 0.4073944), wk = 0.0035461 k( 109) = ( 0.3711999 0.3830841 0.3957546), wk = 0.0035461 k( 110) = ( 0.3602822 0.3718169 0.3841148), wk = 0.0035461 k( 111) = ( 0.3493646 0.3605498 0.3724749), wk = 0.0035461 k( 112) = ( 0.3384470 0.3492826 0.3608351), wk = 0.0035461 k( 113) = ( 0.3275293 0.3380154 0.3491952), wk = 0.0035461 k( 114) = ( 0.3166117 0.3267482 0.3375554), wk = 0.0035461 k( 115) = ( 0.3056940 0.3154810 0.3259155), wk = 0.0035461 k( 116) = ( 0.2947764 0.3042139 0.3142757), wk = 0.0035461 k( 117) = ( 0.2838587 0.2929467 0.3026359), wk = 0.0035461 k( 118) = ( 0.2729411 0.2816795 0.2909960), wk = 0.0035461 k( 119) = ( 0.2620234 0.2704123 0.2793562), wk = 0.0035461 k( 120) = ( 0.2511058 0.2591451 0.2677163), wk = 0.0035461 k( 121) = ( 0.2401882 0.2478780 0.2560765), wk = 0.0035461 k( 122) = ( 0.2292705 0.2366108 0.2444367), wk = 0.0035461 k( 123) = ( 0.2183529 0.2253436 0.2327968), wk = 0.0035461 k( 124) = ( 0.2074352 0.2140764 0.2211570), wk = 0.0035461 k( 125) = ( 0.1965176 0.2028092 0.2095171), wk = 0.0035461 k( 126) = ( 0.1855999 0.1915421 0.1978773), wk = 0.0035461 k( 127) = ( 0.1746823 0.1802749 0.1862375), wk = 0.0035461 k( 128) = ( 0.1637647 0.1690077 0.1745976), wk = 0.0035461 k( 129) = ( 0.1528470 0.1577405 0.1629578), wk = 0.0035461 k( 130) = ( 0.1419294 0.1464733 0.1513179), wk = 0.0035461 k( 131) = ( 0.1310117 0.1352062 0.1396781), wk = 0.0035461 k( 132) = ( 0.1200941 0.1239390 0.1280383), wk = 0.0035461 k( 133) = ( 0.1091764 0.1126718 0.1163984), wk = 0.0035461 k( 134) = ( 0.0982588 0.1014046 0.1047586), wk = 0.0035461 k( 135) = ( 0.0873412 0.0901374 0.0931187), wk = 0.0035461 k( 136) = ( 0.0764235 0.0788703 0.0814789), wk = 0.0035461 k( 137) = ( 0.0655059 0.0676031 0.0698390), wk = 0.0035461 k( 138) = ( 0.0545882 0.0563359 0.0581992), wk = 0.0035461 k( 139) = ( 0.0436706 0.0450687 0.0465594), wk = 0.0035461 k( 140) = ( 0.0327529 0.0338015 0.0349195), wk = 0.0035461 k( 141) = ( 0.0218353 0.0225344 0.0232797), wk = 0.0035461 k( 142) = ( 0.0109176 0.0112672 0.0116398), wk = 0.0035461 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 145) = ( 0.0138889 -0.0134580 0.0000000), wk = 0.0035461 k( 146) = ( 0.0277778 -0.0269160 0.0000000), wk = 0.0035461 k( 147) = ( 0.0416667 -0.0403741 0.0000000), wk = 0.0035461 k( 148) = ( 0.0555556 -0.0538321 0.0000000), wk = 0.0035461 k( 149) = ( 0.0694444 -0.0672901 0.0000000), wk = 0.0035461 k( 150) = ( 0.0833333 -0.0807481 0.0000000), wk = 0.0035461 k( 151) = ( 0.0972222 -0.0942061 0.0000000), wk = 0.0035461 k( 152) = ( 0.1111111 -0.1076642 0.0000000), wk = 0.0035461 k( 153) = ( 0.1250000 -0.1211222 0.0000000), wk = 0.0035461 k( 154) = ( 0.1388889 -0.1345802 0.0000000), wk = 0.0035461 k( 155) = ( 0.1527778 -0.1480382 0.0000000), wk = 0.0035461 k( 156) = ( 0.1666667 -0.1614962 0.0000000), wk = 0.0035461 k( 157) = ( 0.1805556 -0.1749543 0.0000000), wk = 0.0035461 k( 158) = ( 0.1944444 -0.1884123 0.0000000), wk = 0.0035461 k( 159) = ( 0.2083333 -0.2018703 0.0000000), wk = 0.0035461 k( 160) = ( 0.2222222 -0.2153283 0.0000000), wk = 0.0035461 k( 161) = ( 0.2361111 -0.2287863 0.0000000), wk = 0.0035461 k( 162) = ( 0.2500000 -0.2422444 0.0000000), wk = 0.0035461 k( 163) = ( 0.2638889 -0.2557024 0.0000000), wk = 0.0035461 k( 164) = ( 0.2777778 -0.2691604 0.0000000), wk = 0.0035461 k( 165) = ( 0.2916667 -0.2826184 0.0000000), wk = 0.0035461 k( 166) = ( 0.3055556 -0.2960765 0.0000000), wk = 0.0035461 k( 167) = ( 0.3194444 -0.3095345 0.0000000), wk = 0.0035461 k( 168) = ( 0.3333333 -0.3229925 0.0000000), wk = 0.0035461 k( 169) = ( 0.3472222 -0.3364505 0.0000000), wk = 0.0035461 k( 170) = ( 0.3611111 -0.3499085 0.0000000), wk = 0.0035461 k( 171) = ( 0.3750000 -0.3633666 0.0000000), wk = 0.0035461 k( 172) = ( 0.3888889 -0.3768246 0.0000000), wk = 0.0035461 k( 173) = ( 0.4027778 -0.3902826 0.0000000), wk = 0.0035461 k( 174) = ( 0.4166667 -0.4037406 0.0000000), wk = 0.0035461 k( 175) = ( 0.4305556 -0.4171986 0.0000000), wk = 0.0035461 k( 176) = ( 0.4444444 -0.4306567 0.0000000), wk = 0.0035461 k( 177) = ( 0.4583333 -0.4441147 0.0000000), wk = 0.0035461 k( 178) = ( 0.4722222 -0.4575727 0.0000000), wk = 0.0035461 k( 179) = ( 0.4861111 -0.4710307 0.0000000), wk = 0.0035461 k( 180) = ( 0.5000000 -0.4844887 0.0000000), wk = 0.0035461 k( 181) = ( 0.5000000 -0.4844887 0.0000000), wk = 0.0035461 k( 182) = ( 0.5006108 -0.4838584 -0.0193693), wk = 0.0035461 k( 183) = ( 0.5012216 -0.4832280 -0.0387386), wk = 0.0035461 k( 184) = ( 0.5018325 -0.4825976 -0.0581079), wk = 0.0035461 k( 185) = ( 0.5024433 -0.4819672 -0.0774772), wk = 0.0035461 k( 186) = ( 0.5030541 -0.4813368 -0.0968465), wk = 0.0035461 k( 187) = ( 0.5036650 -0.4807064 -0.1162158), wk = 0.0035461 k( 188) = ( 0.5042758 -0.4800761 -0.1355851), wk = 0.0035461 k( 189) = ( 0.5048866 -0.4794457 -0.1549544), wk = 0.0035461 k( 190) = ( 0.5054974 -0.4788153 -0.1743236), wk = 0.0035461 k( 191) = ( 0.5061083 -0.4781849 -0.1936929), wk = 0.0035461 k( 192) = ( 0.5067191 -0.4775545 -0.2130622), wk = 0.0035461 k( 193) = ( 0.5073299 -0.4769241 -0.2324315), wk = 0.0035461 k( 194) = ( 0.5079407 -0.4762938 -0.2518008), wk = 0.0035461 k( 195) = ( 0.5085516 -0.4756634 -0.2711701), wk = 0.0035461 k( 196) = ( 0.5091624 -0.4750330 -0.2905394), wk = 0.0035461 k( 197) = ( 0.5097732 -0.4744026 -0.3099087), wk = 0.0035461 k( 198) = ( 0.5103840 -0.4737722 -0.3292780), wk = 0.0035461 k( 199) = ( 0.5109949 -0.4731419 -0.3486473), wk = 0.0035461 k( 200) = ( 0.5116057 -0.4725115 -0.3680166), wk = 0.0035461 k( 201) = ( 0.5122165 -0.4718811 -0.3873859), wk = 0.0035461 k( 202) = ( 0.5128274 -0.4712507 -0.4067552), wk = 0.0035461 k( 203) = ( 0.5134382 -0.4706203 -0.4261245), wk = 0.0035461 k( 204) = ( 0.5140490 -0.4699899 -0.4454938), wk = 0.0035461 k( 205) = ( 0.5146598 -0.4693596 -0.4648631), wk = 0.0035461 k( 206) = ( 0.5152707 -0.4687292 -0.4842324), wk = 0.0035461 k( 207) = ( 0.5152707 -0.4687292 -0.4842324), wk = 0.0035461 k( 208) = ( 0.5229060 -0.4608494 -0.4760920), wk = 0.0035461 k( 209) = ( 0.5305413 -0.4529696 -0.4679516), wk = 0.0035461 k( 210) = ( 0.5305413 -0.4529696 -0.4679516), wk = 0.0035461 k( 211) = ( 0.5296687 -0.4395774 -0.4541163), wk = 0.0035461 k( 212) = ( 0.5287961 -0.4261851 -0.4402811), wk = 0.0035461 k( 213) = ( 0.5279235 -0.4127928 -0.4264459), wk = 0.0035461 k( 214) = ( 0.5270509 -0.3994006 -0.4126107), wk = 0.0035461 k( 215) = ( 0.5261783 -0.3860083 -0.3987755), wk = 0.0035461 k( 216) = ( 0.5253057 -0.3726160 -0.3849403), wk = 0.0035461 k( 217) = ( 0.5244331 -0.3592238 -0.3711051), wk = 0.0035461 k( 218) = ( 0.5235604 -0.3458315 -0.3572699), wk = 0.0035461 k( 219) = ( 0.5226878 -0.3324393 -0.3434347), wk = 0.0035461 k( 220) = ( 0.5218152 -0.3190470 -0.3295994), wk = 0.0035461 k( 221) = ( 0.5209426 -0.3056547 -0.3157642), wk = 0.0035461 k( 222) = ( 0.5200700 -0.2922625 -0.3019290), wk = 0.0035461 k( 223) = ( 0.5191974 -0.2788702 -0.2880938), wk = 0.0035461 k( 224) = ( 0.5183248 -0.2654779 -0.2742586), wk = 0.0035461 k( 225) = ( 0.5174522 -0.2520857 -0.2604234), wk = 0.0035461 k( 226) = ( 0.5165796 -0.2386934 -0.2465882), wk = 0.0035461 k( 227) = ( 0.5157070 -0.2253012 -0.2327530), wk = 0.0035461 k( 228) = ( 0.5148344 -0.2119089 -0.2189178), wk = 0.0035461 k( 229) = ( 0.5139617 -0.1985166 -0.2050826), wk = 0.0035461 k( 230) = ( 0.5130891 -0.1851244 -0.1912473), wk = 0.0035461 k( 231) = ( 0.5122165 -0.1717321 -0.1774121), wk = 0.0035461 k( 232) = ( 0.5113439 -0.1583399 -0.1635769), wk = 0.0035461 k( 233) = ( 0.5104713 -0.1449476 -0.1497417), wk = 0.0035461 k( 234) = ( 0.5095987 -0.1315553 -0.1359065), wk = 0.0035461 k( 235) = ( 0.5087261 -0.1181631 -0.1220713), wk = 0.0035461 k( 236) = ( 0.5078535 -0.1047708 -0.1082361), wk = 0.0035461 k( 237) = ( 0.5069809 -0.0913785 -0.0944009), wk = 0.0035461 k( 238) = ( 0.5061083 -0.0779863 -0.0805657), wk = 0.0035461 k( 239) = ( 0.5052357 -0.0645940 -0.0667305), wk = 0.0035461 k( 240) = ( 0.5043631 -0.0512018 -0.0528952), wk = 0.0035461 k( 241) = ( 0.5034904 -0.0378095 -0.0390600), wk = 0.0035461 k( 242) = ( 0.5026178 -0.0244172 -0.0252248), wk = 0.0035461 k( 243) = ( 0.5017452 -0.0110250 -0.0113896), wk = 0.0035461 k( 244) = ( 0.5008726 0.0023673 0.0024456), wk = 0.0035461 k( 245) = ( 0.5000000 0.0157596 0.0162808), wk = 0.0035461 k( 246) = ( 0.5000000 0.0157596 0.0162808), wk = 0.0035461 k( 247) = ( 0.5000000 0.0018638 0.0297317), wk = 0.0035461 k( 248) = ( 0.5000000 -0.0120320 0.0431826), wk = 0.0035461 k( 249) = ( 0.5000000 -0.0259278 0.0566335), wk = 0.0035461 k( 250) = ( 0.5000000 -0.0398236 0.0700844), wk = 0.0035461 k( 251) = ( 0.5000000 -0.0537194 0.0835353), wk = 0.0035461 k( 252) = ( 0.5000000 -0.0676152 0.0969862), wk = 0.0035461 k( 253) = ( 0.5000000 -0.0815109 0.1104371), wk = 0.0035461 k( 254) = ( 0.5000000 -0.0954067 0.1238880), wk = 0.0035461 k( 255) = ( 0.5000000 -0.1093025 0.1373389), wk = 0.0035461 k( 256) = ( 0.5000000 -0.1231983 0.1507898), wk = 0.0035461 k( 257) = ( 0.5000000 -0.1370941 0.1642407), wk = 0.0035461 k( 258) = ( 0.5000000 -0.1509899 0.1776916), wk = 0.0035461 k( 259) = ( 0.5000000 -0.1648857 0.1911425), wk = 0.0035461 k( 260) = ( 0.5000000 -0.1787814 0.2045934), wk = 0.0035461 k( 261) = ( 0.5000000 -0.1926772 0.2180443), wk = 0.0035461 k( 262) = ( 0.5000000 -0.2065730 0.2314952), wk = 0.0035461 k( 263) = ( 0.5000000 -0.2204688 0.2449461), wk = 0.0035461 k( 264) = ( 0.5000000 -0.2343646 0.2583970), wk = 0.0035461 k( 265) = ( 0.5000000 -0.2482604 0.2718479), wk = 0.0035461 k( 266) = ( 0.5000000 -0.2621562 0.2852988), wk = 0.0035461 k( 267) = ( 0.5000000 -0.2760520 0.2987497), wk = 0.0035461 k( 268) = ( 0.5000000 -0.2899477 0.3122006), wk = 0.0035461 k( 269) = ( 0.5000000 -0.3038435 0.3256515), wk = 0.0035461 k( 270) = ( 0.5000000 -0.3177393 0.3391024), wk = 0.0035461 k( 271) = ( 0.5000000 -0.3316351 0.3525533), wk = 0.0035461 k( 272) = ( 0.5000000 -0.3455309 0.3660042), wk = 0.0035461 k( 273) = ( 0.5000000 -0.3594267 0.3794551), wk = 0.0035461 k( 274) = ( 0.5000000 -0.3733225 0.3929060), wk = 0.0035461 k( 275) = ( 0.5000000 -0.3872182 0.4063569), wk = 0.0035461 k( 276) = ( 0.5000000 -0.4011140 0.4198078), wk = 0.0035461 k( 277) = ( 0.5000000 -0.4150098 0.4332587), wk = 0.0035461 k( 278) = ( 0.5000000 -0.4289056 0.4467096), wk = 0.0035461 k( 279) = ( 0.5000000 -0.4428014 0.4601605), wk = 0.0035461 k( 280) = ( 0.5000000 -0.4566972 0.4736114), wk = 0.0035461 k( 281) = ( 0.5000000 -0.4705930 0.4870623), wk = 0.0035461 k( 282) = ( 0.5000000 -0.4844887 0.5005132), wk = 0.0035461 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 2) = ( 0.0110166 -0.0117107 0.0110166), wk = 0.0035461 k( 3) = ( 0.0220332 -0.0234214 0.0220331), wk = 0.0035461 k( 4) = ( 0.0330497 -0.0351321 0.0330497), wk = 0.0035461 k( 5) = ( 0.0440663 -0.0468428 0.0440663), wk = 0.0035461 k( 6) = ( 0.0550829 -0.0585535 0.0550829), wk = 0.0035461 k( 7) = ( 0.0660995 -0.0702642 0.0660995), wk = 0.0035461 k( 8) = ( 0.0771160 -0.0819749 0.0771160), wk = 0.0035461 k( 9) = ( 0.0881326 -0.0936856 0.0881326), wk = 0.0035461 k( 10) = ( 0.0991492 -0.1053963 0.0991492), wk = 0.0035461 k( 11) = ( 0.1101658 -0.1171070 0.1101658), wk = 0.0035461 k( 12) = ( 0.1211823 -0.1288177 0.1211823), wk = 0.0035461 k( 13) = ( 0.1321989 -0.1405284 0.1321989), wk = 0.0035461 k( 14) = ( 0.1432155 -0.1522391 0.1432155), wk = 0.0035461 k( 15) = ( 0.1542321 -0.1639498 0.1542321), wk = 0.0035461 k( 16) = ( 0.1652486 -0.1756604 0.1652486), wk = 0.0035461 k( 17) = ( 0.1762652 -0.1873711 0.1762652), wk = 0.0035461 k( 18) = ( 0.1872818 -0.1990819 0.1872818), wk = 0.0035461 k( 19) = ( 0.1982984 -0.2107925 0.1982984), wk = 0.0035461 k( 20) = ( 0.2093149 -0.2225032 0.2093149), wk = 0.0035461 k( 21) = ( 0.2203315 -0.2342139 0.2203315), wk = 0.0035461 k( 22) = ( 0.2313481 -0.2459246 0.2313481), wk = 0.0035461 k( 23) = ( 0.2423647 -0.2576353 0.2423647), wk = 0.0035461 k( 24) = ( 0.2533813 -0.2693460 0.2533812), wk = 0.0035461 k( 25) = ( 0.2643978 -0.2810567 0.2643978), wk = 0.0035461 k( 26) = ( 0.2754144 -0.2927674 0.2754144), wk = 0.0035461 k( 27) = ( 0.2864310 -0.3044781 0.2864310), wk = 0.0035461 k( 28) = ( 0.2974476 -0.3161888 0.2974476), wk = 0.0035461 k( 29) = ( 0.3084641 -0.3278995 0.3084641), wk = 0.0035461 k( 30) = ( 0.3194807 -0.3396102 0.3194807), wk = 0.0035461 k( 31) = ( 0.3304973 -0.3513209 0.3304973), wk = 0.0035461 k( 32) = ( 0.3415139 -0.3630316 0.3415139), wk = 0.0035461 k( 33) = ( 0.3525304 -0.3747423 0.3525304), wk = 0.0035461 k( 34) = ( 0.3635470 -0.3864530 0.3635470), wk = 0.0035461 k( 35) = ( 0.3745636 -0.3981637 0.3745636), wk = 0.0035461 k( 36) = ( 0.3855802 -0.4098744 0.3855802), wk = 0.0035461 k( 37) = ( 0.3965967 -0.4215851 0.3965967), wk = 0.0035461 k( 38) = ( 0.4076133 -0.4332958 0.4076133), wk = 0.0035461 k( 39) = ( 0.4186299 -0.4450065 0.4186299), wk = 0.0035461 k( 40) = ( 0.4296465 -0.4567172 0.4296465), wk = 0.0035461 k( 41) = ( 0.4406630 -0.4684279 0.4406630), wk = 0.0035461 k( 42) = ( 0.4516796 -0.4801386 0.4516796), wk = 0.0035461 k( 43) = ( 0.4626962 -0.4918493 0.4626962), wk = 0.0035461 k( 44) = ( 0.4737128 -0.5035600 0.4737128), wk = 0.0035461 k( 45) = ( 0.4847293 -0.5152707 0.4847293), wk = 0.0035461 k( 46) = ( 0.4847293 -0.5152707 0.4847293), wk = 0.0035461 k( 47) = ( 0.4923647 -0.5076353 0.4923647), wk = 0.0035461 k( 48) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0035461 k( 49) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0035461 k( 50) = ( 0.4993892 -0.4806108 0.4993892), wk = 0.0035461 k( 51) = ( 0.4987783 -0.4612216 0.4987783), wk = 0.0035461 k( 52) = ( 0.4981675 -0.4418325 0.4981675), wk = 0.0035461 k( 53) = ( 0.4975567 -0.4224433 0.4975567), wk = 0.0035461 k( 54) = ( 0.4969459 -0.4030541 0.4969459), wk = 0.0035461 k( 55) = ( 0.4963350 -0.3836650 0.4963350), wk = 0.0035461 k( 56) = ( 0.4957242 -0.3642758 0.4957242), wk = 0.0035461 k( 57) = ( 0.4951134 -0.3448866 0.4951134), wk = 0.0035461 k( 58) = ( 0.4945026 -0.3254974 0.4945026), wk = 0.0035461 k( 59) = ( 0.4938917 -0.3061083 0.4938917), wk = 0.0035461 k( 60) = ( 0.4932809 -0.2867191 0.4932809), wk = 0.0035461 k( 61) = ( 0.4926701 -0.2673299 0.4926701), wk = 0.0035461 k( 62) = ( 0.4920593 -0.2479407 0.4920593), wk = 0.0035461 k( 63) = ( 0.4914484 -0.2285516 0.4914484), wk = 0.0035461 k( 64) = ( 0.4908376 -0.2091624 0.4908376), wk = 0.0035461 k( 65) = ( 0.4902268 -0.1897732 0.4902268), wk = 0.0035461 k( 66) = ( 0.4896160 -0.1703841 0.4896159), wk = 0.0035461 k( 67) = ( 0.4890051 -0.1509949 0.4890051), wk = 0.0035461 k( 68) = ( 0.4883943 -0.1316057 0.4883943), wk = 0.0035461 k( 69) = ( 0.4877835 -0.1122165 0.4877835), wk = 0.0035461 k( 70) = ( 0.4871726 -0.0928274 0.4871726), wk = 0.0035461 k( 71) = ( 0.4865618 -0.0734382 0.4865618), wk = 0.0035461 k( 72) = ( 0.4859510 -0.0540490 0.4859510), wk = 0.0035461 k( 73) = ( 0.4853402 -0.0346598 0.4853402), wk = 0.0035461 k( 74) = ( 0.4847293 -0.0152707 0.4847293), wk = 0.0035461 k( 75) = ( 0.4841185 0.0041185 0.4841185), wk = 0.0035461 k( 76) = ( 0.4835077 0.0235077 0.4835077), wk = 0.0035461 k( 77) = ( 0.4828969 0.0428969 0.4828969), wk = 0.0035461 k( 78) = ( 0.4822860 0.0622860 0.4822860), wk = 0.0035461 k( 79) = ( 0.4816752 0.0816752 0.4816752), wk = 0.0035461 k( 80) = ( 0.4810644 0.1010644 0.4810644), wk = 0.0035461 k( 81) = ( 0.4804536 0.1204535 0.4804535), wk = 0.0035461 k( 82) = ( 0.4798427 0.1398427 0.4798427), wk = 0.0035461 k( 83) = ( 0.4792319 0.1592319 0.4792319), wk = 0.0035461 k( 84) = ( 0.4786211 0.1786211 0.4786211), wk = 0.0035461 k( 85) = ( 0.4780103 0.1980102 0.4780103), wk = 0.0035461 k( 86) = ( 0.4773994 0.2173994 0.4773994), wk = 0.0035461 k( 87) = ( 0.4767886 0.2367886 0.4767886), wk = 0.0035461 k( 88) = ( 0.4761778 0.2561778 0.4761778), wk = 0.0035461 k( 89) = ( 0.4755669 0.2755669 0.4755669), wk = 0.0035461 k( 90) = ( 0.4749561 0.2949561 0.4749561), wk = 0.0035461 k( 91) = ( 0.4743453 0.3143453 0.4743453), wk = 0.0035461 k( 92) = ( 0.4737345 0.3337345 0.4737345), wk = 0.0035461 k( 93) = ( 0.4731236 0.3531236 0.4731236), wk = 0.0035461 k( 94) = ( 0.4725128 0.3725128 0.4725128), wk = 0.0035461 k( 95) = ( 0.4719020 0.3919020 0.4719020), wk = 0.0035461 k( 96) = ( 0.4712912 0.4112912 0.4712912), wk = 0.0035461 k( 97) = ( 0.4706803 0.4306803 0.4706803), wk = 0.0035461 k( 98) = ( 0.4700695 0.4500695 0.4700695), wk = 0.0035461 k( 99) = ( 0.4694587 0.4694587 0.4694587), wk = 0.0035461 k( 100) = ( 0.4694587 0.4694587 0.4694587), wk = 0.0035461 k( 101) = ( 0.4585410 0.4585410 0.4585410), wk = 0.0035461 k( 102) = ( 0.4476234 0.4476234 0.4476234), wk = 0.0035461 k( 103) = ( 0.4367058 0.4367058 0.4367057), wk = 0.0035461 k( 104) = ( 0.4257881 0.4257881 0.4257881), wk = 0.0035461 k( 105) = ( 0.4148705 0.4148705 0.4148705), wk = 0.0035461 k( 106) = ( 0.4039528 0.4039528 0.4039528), wk = 0.0035461 k( 107) = ( 0.3930352 0.3930352 0.3930352), wk = 0.0035461 k( 108) = ( 0.3821175 0.3821175 0.3821175), wk = 0.0035461 k( 109) = ( 0.3711999 0.3711999 0.3711999), wk = 0.0035461 k( 110) = ( 0.3602822 0.3602822 0.3602822), wk = 0.0035461 k( 111) = ( 0.3493646 0.3493646 0.3493646), wk = 0.0035461 k( 112) = ( 0.3384470 0.3384470 0.3384470), wk = 0.0035461 k( 113) = ( 0.3275293 0.3275293 0.3275293), wk = 0.0035461 k( 114) = ( 0.3166117 0.3166117 0.3166117), wk = 0.0035461 k( 115) = ( 0.3056940 0.3056940 0.3056940), wk = 0.0035461 k( 116) = ( 0.2947764 0.2947764 0.2947764), wk = 0.0035461 k( 117) = ( 0.2838587 0.2838587 0.2838587), wk = 0.0035461 k( 118) = ( 0.2729411 0.2729411 0.2729411), wk = 0.0035461 k( 119) = ( 0.2620234 0.2620234 0.2620234), wk = 0.0035461 k( 120) = ( 0.2511058 0.2511058 0.2511058), wk = 0.0035461 k( 121) = ( 0.2401882 0.2401882 0.2401882), wk = 0.0035461 k( 122) = ( 0.2292705 0.2292705 0.2292705), wk = 0.0035461 k( 123) = ( 0.2183529 0.2183529 0.2183529), wk = 0.0035461 k( 124) = ( 0.2074352 0.2074352 0.2074352), wk = 0.0035461 k( 125) = ( 0.1965176 0.1965176 0.1965176), wk = 0.0035461 k( 126) = ( 0.1855999 0.1855999 0.1855999), wk = 0.0035461 k( 127) = ( 0.1746823 0.1746823 0.1746823), wk = 0.0035461 k( 128) = ( 0.1637647 0.1637647 0.1637647), wk = 0.0035461 k( 129) = ( 0.1528470 0.1528470 0.1528470), wk = 0.0035461 k( 130) = ( 0.1419294 0.1419294 0.1419294), wk = 0.0035461 k( 131) = ( 0.1310117 0.1310117 0.1310117), wk = 0.0035461 k( 132) = ( 0.1200941 0.1200941 0.1200941), wk = 0.0035461 k( 133) = ( 0.1091764 0.1091764 0.1091764), wk = 0.0035461 k( 134) = ( 0.0982588 0.0982588 0.0982588), wk = 0.0035461 k( 135) = ( 0.0873412 0.0873412 0.0873412), wk = 0.0035461 k( 136) = ( 0.0764235 0.0764235 0.0764235), wk = 0.0035461 k( 137) = ( 0.0655059 0.0655059 0.0655059), wk = 0.0035461 k( 138) = ( 0.0545882 0.0545882 0.0545882), wk = 0.0035461 k( 139) = ( 0.0436706 0.0436706 0.0436706), wk = 0.0035461 k( 140) = ( 0.0327529 0.0327529 0.0327529), wk = 0.0035461 k( 141) = ( 0.0218353 0.0218353 0.0218353), wk = 0.0035461 k( 142) = ( 0.0109176 0.0109176 0.0109176), wk = 0.0035461 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035461 k( 145) = ( 0.0138889 -0.0138889 0.0000000), wk = 0.0035461 k( 146) = ( 0.0277778 -0.0277778 0.0000000), wk = 0.0035461 k( 147) = ( 0.0416667 -0.0416667 0.0000000), wk = 0.0035461 k( 148) = ( 0.0555556 -0.0555556 0.0000000), wk = 0.0035461 k( 149) = ( 0.0694444 -0.0694444 0.0000000), wk = 0.0035461 k( 150) = ( 0.0833333 -0.0833333 0.0000000), wk = 0.0035461 k( 151) = ( 0.0972222 -0.0972222 -0.0000000), wk = 0.0035461 k( 152) = ( 0.1111111 -0.1111111 -0.0000000), wk = 0.0035461 k( 153) = ( 0.1250000 -0.1250000 0.0000000), wk = 0.0035461 k( 154) = ( 0.1388889 -0.1388889 -0.0000000), wk = 0.0035461 k( 155) = ( 0.1527778 -0.1527778 0.0000000), wk = 0.0035461 k( 156) = ( 0.1666667 -0.1666667 -0.0000000), wk = 0.0035461 k( 157) = ( 0.1805556 -0.1805556 -0.0000000), wk = 0.0035461 k( 158) = ( 0.1944444 -0.1944444 -0.0000000), wk = 0.0035461 k( 159) = ( 0.2083333 -0.2083333 0.0000000), wk = 0.0035461 k( 160) = ( 0.2222222 -0.2222222 -0.0000000), wk = 0.0035461 k( 161) = ( 0.2361111 -0.2361111 0.0000000), wk = 0.0035461 k( 162) = ( 0.2500000 -0.2500000 0.0000000), wk = 0.0035461 k( 163) = ( 0.2638889 -0.2638889 -0.0000000), wk = 0.0035461 k( 164) = ( 0.2777778 -0.2777778 -0.0000000), wk = 0.0035461 k( 165) = ( 0.2916667 -0.2916667 0.0000000), wk = 0.0035461 k( 166) = ( 0.3055556 -0.3055556 0.0000000), wk = 0.0035461 k( 167) = ( 0.3194444 -0.3194444 -0.0000000), wk = 0.0035461 k( 168) = ( 0.3333333 -0.3333333 -0.0000000), wk = 0.0035461 k( 169) = ( 0.3472222 -0.3472222 0.0000000), wk = 0.0035461 k( 170) = ( 0.3611111 -0.3611111 0.0000000), wk = 0.0035461 k( 171) = ( 0.3750000 -0.3750000 0.0000000), wk = 0.0035461 k( 172) = ( 0.3888889 -0.3888889 0.0000000), wk = 0.0035461 k( 173) = ( 0.4027778 -0.4027778 -0.0000000), wk = 0.0035461 k( 174) = ( 0.4166667 -0.4166667 0.0000000), wk = 0.0035461 k( 175) = ( 0.4305556 -0.4305556 0.0000000), wk = 0.0035461 k( 176) = ( 0.4444444 -0.4444444 -0.0000000), wk = 0.0035461 k( 177) = ( 0.4583333 -0.4583333 0.0000000), wk = 0.0035461 k( 178) = ( 0.4722222 -0.4722222 0.0000000), wk = 0.0035461 k( 179) = ( 0.4861111 -0.4861111 0.0000000), wk = 0.0035461 k( 180) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0035461 k( 181) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0035461 k( 182) = ( 0.5006108 -0.4993892 -0.0193892), wk = 0.0035461 k( 183) = ( 0.5012216 -0.4987783 -0.0387784), wk = 0.0035461 k( 184) = ( 0.5018325 -0.4981675 -0.0581675), wk = 0.0035461 k( 185) = ( 0.5024433 -0.4975567 -0.0775567), wk = 0.0035461 k( 186) = ( 0.5030541 -0.4969459 -0.0969459), wk = 0.0035461 k( 187) = ( 0.5036650 -0.4963350 -0.1163350), wk = 0.0035461 k( 188) = ( 0.5042758 -0.4957242 -0.1357242), wk = 0.0035461 k( 189) = ( 0.5048866 -0.4951134 -0.1551134), wk = 0.0035461 k( 190) = ( 0.5054974 -0.4945026 -0.1745026), wk = 0.0035461 k( 191) = ( 0.5061083 -0.4938917 -0.1938917), wk = 0.0035461 k( 192) = ( 0.5067191 -0.4932809 -0.2132809), wk = 0.0035461 k( 193) = ( 0.5073299 -0.4926701 -0.2326701), wk = 0.0035461 k( 194) = ( 0.5079407 -0.4920593 -0.2520593), wk = 0.0035461 k( 195) = ( 0.5085516 -0.4914484 -0.2714484), wk = 0.0035461 k( 196) = ( 0.5091624 -0.4908376 -0.2908376), wk = 0.0035461 k( 197) = ( 0.5097732 -0.4902268 -0.3102268), wk = 0.0035461 k( 198) = ( 0.5103840 -0.4896160 -0.3296159), wk = 0.0035461 k( 199) = ( 0.5109949 -0.4890051 -0.3490051), wk = 0.0035461 k( 200) = ( 0.5116057 -0.4883943 -0.3683943), wk = 0.0035461 k( 201) = ( 0.5122165 -0.4877835 -0.3877835), wk = 0.0035461 k( 202) = ( 0.5128274 -0.4871726 -0.4071727), wk = 0.0035461 k( 203) = ( 0.5134382 -0.4865618 -0.4265618), wk = 0.0035461 k( 204) = ( 0.5140490 -0.4859510 -0.4459510), wk = 0.0035461 k( 205) = ( 0.5146598 -0.4853402 -0.4653402), wk = 0.0035461 k( 206) = ( 0.5152707 -0.4847293 -0.4847293), wk = 0.0035461 k( 207) = ( 0.5152707 -0.4847293 -0.4847293), wk = 0.0035461 k( 208) = ( 0.5229060 -0.4770940 -0.4770940), wk = 0.0035461 k( 209) = ( 0.5305413 -0.4694587 -0.4694587), wk = 0.0035461 k( 210) = ( 0.5305413 -0.4694587 -0.4694587), wk = 0.0035461 k( 211) = ( 0.5296687 -0.4560456 -0.4560456), wk = 0.0035461 k( 212) = ( 0.5287961 -0.4426325 -0.4426325), wk = 0.0035461 k( 213) = ( 0.5279235 -0.4292194 -0.4292194), wk = 0.0035461 k( 214) = ( 0.5270509 -0.4158063 -0.4158063), wk = 0.0035461 k( 215) = ( 0.5261783 -0.4023932 -0.4023931), wk = 0.0035461 k( 216) = ( 0.5253057 -0.3889800 -0.3889801), wk = 0.0035461 k( 217) = ( 0.5244331 -0.3755669 -0.3755669), wk = 0.0035461 k( 218) = ( 0.5235604 -0.3621538 -0.3621538), wk = 0.0035461 k( 219) = ( 0.5226878 -0.3487407 -0.3487407), wk = 0.0035461 k( 220) = ( 0.5218152 -0.3353276 -0.3353276), wk = 0.0035461 k( 221) = ( 0.5209426 -0.3219145 -0.3219145), wk = 0.0035461 k( 222) = ( 0.5200700 -0.3085014 -0.3085014), wk = 0.0035461 k( 223) = ( 0.5191974 -0.2950883 -0.2950883), wk = 0.0035461 k( 224) = ( 0.5183248 -0.2816752 -0.2816752), wk = 0.0035461 k( 225) = ( 0.5174522 -0.2682621 -0.2682621), wk = 0.0035461 k( 226) = ( 0.5165796 -0.2548490 -0.2548490), wk = 0.0035461 k( 227) = ( 0.5157070 -0.2414359 -0.2414359), wk = 0.0035461 k( 228) = ( 0.5148344 -0.2280228 -0.2280228), wk = 0.0035461 k( 229) = ( 0.5139617 -0.2146097 -0.2146097), wk = 0.0035461 k( 230) = ( 0.5130891 -0.2011966 -0.2011966), wk = 0.0035461 k( 231) = ( 0.5122165 -0.1877835 -0.1877835), wk = 0.0035461 k( 232) = ( 0.5113439 -0.1743704 -0.1743704), wk = 0.0035461 k( 233) = ( 0.5104713 -0.1609573 -0.1609573), wk = 0.0035461 k( 234) = ( 0.5095987 -0.1475442 -0.1475442), wk = 0.0035461 k( 235) = ( 0.5087261 -0.1341311 -0.1341311), wk = 0.0035461 k( 236) = ( 0.5078535 -0.1207180 -0.1207179), wk = 0.0035461 k( 237) = ( 0.5069809 -0.1073048 -0.1073048), wk = 0.0035461 k( 238) = ( 0.5061083 -0.0938917 -0.0938917), wk = 0.0035461 k( 239) = ( 0.5052357 -0.0804786 -0.0804786), wk = 0.0035461 k( 240) = ( 0.5043631 -0.0670655 -0.0670655), wk = 0.0035461 k( 241) = ( 0.5034904 -0.0536524 -0.0536524), wk = 0.0035461 k( 242) = ( 0.5026178 -0.0402393 -0.0402393), wk = 0.0035461 k( 243) = ( 0.5017452 -0.0268262 -0.0268262), wk = 0.0035461 k( 244) = ( 0.5008726 -0.0134131 -0.0134131), wk = 0.0035461 k( 245) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035461 k( 246) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0035461 k( 247) = ( 0.5000000 -0.0138889 0.0138889), wk = 0.0035461 k( 248) = ( 0.5000000 -0.0277778 0.0277778), wk = 0.0035461 k( 249) = ( 0.5000000 -0.0416667 0.0416667), wk = 0.0035461 k( 250) = ( 0.5000000 -0.0555556 0.0555556), wk = 0.0035461 k( 251) = ( 0.5000000 -0.0694444 0.0694444), wk = 0.0035461 k( 252) = ( 0.5000000 -0.0833333 0.0833333), wk = 0.0035461 k( 253) = ( 0.5000000 -0.0972222 0.0972222), wk = 0.0035461 k( 254) = ( 0.5000000 -0.1111111 0.1111111), wk = 0.0035461 k( 255) = ( 0.5000000 -0.1250000 0.1250000), wk = 0.0035461 k( 256) = ( 0.5000000 -0.1388889 0.1388889), wk = 0.0035461 k( 257) = ( 0.5000000 -0.1527778 0.1527778), wk = 0.0035461 k( 258) = ( 0.5000000 -0.1666667 0.1666667), wk = 0.0035461 k( 259) = ( 0.5000000 -0.1805556 0.1805556), wk = 0.0035461 k( 260) = ( 0.5000000 -0.1944444 0.1944444), wk = 0.0035461 k( 261) = ( 0.5000000 -0.2083333 0.2083333), wk = 0.0035461 k( 262) = ( 0.5000000 -0.2222222 0.2222222), wk = 0.0035461 k( 263) = ( 0.5000000 -0.2361111 0.2361111), wk = 0.0035461 k( 264) = ( 0.5000000 -0.2500000 0.2500000), wk = 0.0035461 k( 265) = ( 0.5000000 -0.2638889 0.2638889), wk = 0.0035461 k( 266) = ( 0.5000000 -0.2777778 0.2777778), wk = 0.0035461 k( 267) = ( 0.5000000 -0.2916667 0.2916667), wk = 0.0035461 k( 268) = ( 0.5000000 -0.3055556 0.3055556), wk = 0.0035461 k( 269) = ( 0.5000000 -0.3194444 0.3194444), wk = 0.0035461 k( 270) = ( 0.5000000 -0.3333333 0.3333333), wk = 0.0035461 k( 271) = ( 0.5000000 -0.3472222 0.3472222), wk = 0.0035461 k( 272) = ( 0.5000000 -0.3611111 0.3611111), wk = 0.0035461 k( 273) = ( 0.5000000 -0.3750000 0.3750000), wk = 0.0035461 k( 274) = ( 0.5000000 -0.3888889 0.3888889), wk = 0.0035461 k( 275) = ( 0.5000000 -0.4027778 0.4027778), wk = 0.0035461 k( 276) = ( 0.5000000 -0.4166667 0.4166667), wk = 0.0035461 k( 277) = ( 0.5000000 -0.4305556 0.4305556), wk = 0.0035461 k( 278) = ( 0.5000000 -0.4444444 0.4444444), wk = 0.0035461 k( 279) = ( 0.5000000 -0.4583333 0.4583333), wk = 0.0035461 k( 280) = ( 0.5000000 -0.4722222 0.4722222), wk = 0.0035461 k( 281) = ( 0.5000000 -0.4861111 0.4861111), wk = 0.0035461 k( 282) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0035461 Dense grid: 155257 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 66023 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.43 Mb ( 354, 80) NL pseudopotentials 0.78 Mb ( 177, 288) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 3236) G-vector shells 0.02 Mb ( 2771) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.73 Mb ( 354, 320) Each subspace H/S matrix 1.56 Mb ( 320, 320) Each matrix 0.70 Mb ( 288, 2, 80) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./BNCl2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.4 secs Computing kpt #: 2 total cpu time spent up to now is 49.8 secs Computing kpt #: 3 total cpu time spent up to now is 55.5 secs Computing kpt #: 4 total cpu time spent up to now is 60.8 secs Computing kpt #: 5 total cpu time spent up to now is 66.1 secs Computing kpt #: 6 total cpu time spent up to now is 71.5 secs Computing kpt #: 7 total cpu time spent up to now is 77.3 secs Computing kpt #: 8 total cpu time spent up to now is 82.8 secs Computing kpt #: 9 total cpu time spent up to now is 88.5 secs Computing kpt #: 10 total cpu time spent up to now is 94.2 secs Computing kpt #: 11 total cpu time spent up to now is 99.6 secs Computing kpt #: 12 total cpu time spent up to now is 105.3 secs Computing kpt #: 13 total cpu time spent up to now is 111.0 secs Computing kpt #: 14 total cpu time spent up to now is 116.6 secs Computing kpt #: 15 total cpu time spent up to now is 122.3 secs Computing kpt #: 16 total cpu time spent up to now is 127.9 secs Computing kpt #: 17 total cpu time spent up to now is 133.6 secs Computing kpt #: 18 total cpu time spent up to now is 139.5 secs Computing kpt #: 19 total cpu time spent up to now is 145.8 secs Computing kpt #: 20 total cpu time spent up to now is 151.8 secs Computing kpt #: 21 total cpu time spent up to now is 157.8 secs Computing kpt #: 22 total cpu time spent up to now is 163.8 secs Computing kpt #: 23 total cpu time spent up to now is 169.7 secs Computing kpt #: 24 total cpu time spent up to now is 175.6 secs Computing kpt #: 25 total cpu time spent up to now is 181.8 secs Computing kpt #: 26 total cpu time spent up to now is 188.1 secs Computing kpt 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spent up to now is 299.0 secs Computing kpt #: 43 total cpu time spent up to now is 304.9 secs Computing kpt #: 44 total cpu time spent up to now is 311.3 secs Computing kpt #: 45 total cpu time spent up to now is 317.1 secs Computing kpt #: 46 total cpu time spent up to now is 323.1 secs Computing kpt #: 47 total cpu time spent up to now is 329.1 secs Computing kpt #: 48 total cpu time spent up to now is 334.8 secs Computing kpt #: 49 total cpu time spent up to now is 340.4 secs Computing kpt #: 50 total cpu time spent up to now is 346.5 secs Computing kpt #: 51 total cpu time spent up to now is 352.3 secs Computing kpt #: 52 total cpu time spent up to now is 358.3 secs Computing kpt #: 53 total cpu time spent up to now is 364.4 secs Computing kpt #: 54 total cpu time spent up to now is 370.5 secs Computing kpt #: 55 total cpu time spent up to now is 376.8 secs Computing kpt #: 56 total cpu time spent up to now is 383.9 secs Computing kpt #: 57 total cpu time spent up to now is 390.9 secs Computing kpt #: 58 total cpu time spent up to now is 397.7 secs Computing kpt #: 59 total cpu time spent up to now is 404.7 secs Computing kpt #: 60 total cpu time spent up to now is 411.6 secs Computing kpt #: 61 total cpu time spent up to now is 418.5 secs Computing kpt #: 62 total cpu time spent up to now is 425.4 secs Computing kpt #: 63 total cpu time spent up to now is 432.6 secs Computing kpt #: 64 total cpu time spent up to now is 439.5 secs Computing kpt #: 65 total cpu time spent up to now is 446.8 secs Computing kpt #: 66 total cpu time spent up to now is 454.2 secs Computing kpt #: 67 total cpu time spent up to now is 461.7 secs Computing kpt #: 68 total cpu time spent up to now is 468.8 secs Computing kpt #: 69 total cpu time spent up to now is 475.8 secs Computing kpt #: 70 total cpu time spent up to now is 482.8 secs Computing kpt #: 71 total cpu time spent up to now is 489.9 secs Computing kpt #: 72 total cpu time spent up to now is 497.1 secs Computing kpt #: 73 total cpu time spent up to now is 504.6 secs Computing kpt #: 74 total cpu time spent up to now is 512.1 secs Computing kpt #: 75 total cpu time spent up to now is 519.7 secs Computing kpt #: 76 total cpu time spent up to now is 532.7 secs Computing kpt #: 77 total cpu time spent up to now is 539.5 secs Computing kpt #: 78 total cpu time spent up to now is 546.4 secs Computing kpt #: 79 total cpu time spent up to now is 553.3 secs Computing kpt #: 80 total cpu time spent up to now is 560.4 secs Computing kpt #: 81 total cpu time spent up to now is 567.4 secs Computing kpt #: 82 total cpu time spent up to now is 574.5 secs Computing kpt #: 83 total cpu time spent up to now is 581.9 secs Computing kpt #: 84 total cpu time spent up to now is 589.4 secs Computing kpt #: 85 total cpu time spent up to now is 597.1 secs Computing kpt #: 86 total cpu time spent up to now is 604.2 secs Computing kpt #: 87 total cpu time spent up to now is 611.1 secs Computing kpt #: 88 total cpu time spent up to now is 618.1 secs Computing kpt #: 89 total cpu time spent up to now is 625.0 secs Computing kpt #: 90 total cpu time spent up to now is 631.8 secs Computing kpt #: 91 total cpu time spent up to now is 639.3 secs Computing kpt #: 92 total cpu time spent up to now is 646.0 secs Computing kpt #: 93 total cpu time spent up to now is 652.2 secs Computing kpt #: 94 total cpu time spent up to now is 658.5 secs Computing kpt #: 95 total cpu time spent up to now is 664.6 secs Computing kpt #: 96 total cpu time spent up to now is 670.5 secs Computing kpt #: 97 total cpu time spent up to now is 676.5 secs Computing kpt #: 98 total cpu time spent up to now is 682.2 secs Computing kpt #: 99 total cpu time spent up to now is 687.9 secs Computing kpt #: 100 total cpu time spent up to now is 693.7 secs Computing kpt #: 101 total cpu time spent up to now is 699.5 secs Computing kpt #: 102 total cpu time spent up to now is 705.3 secs Computing kpt #: 103 total cpu time spent up to now is 711.0 secs Computing kpt #: 104 total cpu time spent up to now is 716.8 secs Computing kpt #: 105 total cpu time spent up to now is 722.6 secs Computing kpt #: 106 total cpu time spent up to now is 728.3 secs Computing kpt #: 107 total cpu time spent up to now is 734.0 secs Computing kpt #: 108 total cpu time spent up to now is 739.8 secs Computing kpt #: 109 total cpu time spent up to now is 745.5 secs Computing kpt #: 110 total cpu time spent up to now is 751.1 secs Computing kpt #: 111 total cpu time spent up to now is 756.7 secs Computing kpt #: 112 total cpu time spent up to now is 762.7 secs Computing kpt #: 113 total cpu time spent up to now is 770.0 secs Computing kpt #: 114 total cpu time spent up to now is 775.7 secs Computing kpt #: 115 total cpu time spent up to now is 781.8 secs Computing kpt #: 116 total cpu time spent up to now is 787.6 secs Computing kpt #: 117 total cpu time spent up to now is 793.3 secs Computing kpt #: 118 total cpu time spent up to now is 799.0 secs Computing kpt #: 119 total cpu time spent up to now is 804.9 secs Computing kpt #: 120 total cpu time spent up to now is 810.7 secs Computing kpt #: 121 total cpu time spent up to now is 817.6 secs Computing kpt #: 122 total cpu time spent up to now is 823.4 secs Computing kpt #: 123 total cpu time spent up to now is 829.3 secs Computing kpt #: 124 total cpu time spent up to now is 835.1 secs Computing kpt #: 125 total cpu time spent up to now is 840.9 secs Computing kpt #: 126 total cpu time spent up to now is 846.7 secs Computing kpt #: 127 total cpu time spent up to now is 852.4 secs Computing kpt #: 128 total cpu time spent up to now is 858.1 secs Computing kpt #: 129 total cpu time spent up to now is 863.8 secs Computing kpt #: 130 total cpu time spent up to now is 869.7 secs Computing kpt #: 131 total cpu time spent up to now is 875.6 secs Computing kpt #: 132 total cpu time spent up to now is 881.4 secs Computing kpt #: 133 total cpu time spent up to now is 887.1 secs Computing kpt #: 134 total cpu time spent up to now is 892.9 secs Computing kpt #: 135 total cpu time spent up to now is 898.5 secs Computing kpt #: 136 total cpu time spent up to now is 904.2 secs Computing kpt #: 137 total cpu time spent up to now is 909.8 secs Computing kpt #: 138 total cpu time spent up to now is 915.4 secs Computing kpt #: 139 total cpu time spent up to now is 921.1 secs Computing kpt #: 140 total cpu time spent up to now is 926.7 secs Computing kpt #: 141 total cpu time spent up to now is 932.2 secs Computing kpt #: 142 total cpu time spent up to now is 937.7 secs Computing kpt #: 143 total cpu time spent up to now is 943.1 secs Computing kpt #: 144 total cpu time spent up to now is 948.6 secs Computing kpt #: 145 total cpu time spent up to now is 954.0 secs Computing kpt #: 146 total cpu time spent up to now is 958.9 secs Computing kpt #: 147 total cpu time spent up to now is 964.2 secs Computing kpt #: 148 total cpu time spent up to now is 969.7 secs Computing kpt #: 149 total cpu time spent up to now is 975.0 secs Computing kpt #: 150 total cpu time spent up to now is 980.6 secs Computing kpt #: 151 total cpu time spent up to now is 986.2 secs Computing kpt #: 152 total cpu time spent up to now is 991.8 secs Computing kpt #: 153 total cpu time spent up to now is 997.3 secs Computing kpt #: 154 total cpu time spent up to now is 1002.9 secs Computing kpt #: 155 total cpu time spent up to now is 1008.8 secs Computing kpt #: 156 total cpu time spent up to now is 1014.6 secs Computing kpt #: 157 total cpu time spent up to now is 1020.3 secs Computing kpt #: 158 total cpu time spent up to now is 1026.1 secs Computing kpt #: 159 total cpu time spent up to now is 1032.2 secs Computing kpt #: 160 total cpu time spent up to now is 1038.0 secs Computing kpt #: 161 total cpu time spent up to now is 1043.9 secs Computing kpt #: 162 total cpu time spent up to now is 1049.8 secs Computing kpt #: 163 total cpu time spent up to now is 1055.7 secs Computing kpt #: 164 total cpu time spent up to now is 1061.6 secs Computing kpt #: 165 total cpu time spent up to now is 1067.5 secs Computing kpt #: 166 total cpu time spent up to now is 1073.6 secs Computing kpt #: 167 total cpu time spent up to now is 1079.6 secs Computing kpt #: 168 total cpu time spent up to now is 1085.5 secs Computing kpt #: 169 total cpu time spent up to now is 1091.4 secs Computing kpt #: 170 total cpu time spent up to now is 1097.6 secs Computing kpt #: 171 total cpu time spent up to now is 1103.5 secs Computing kpt #: 172 total cpu time spent up to now is 1109.5 secs Computing kpt #: 173 total cpu time spent up to now is 1116.8 secs Computing kpt #: 174 total cpu time spent up to now is 1123.2 secs Computing kpt #: 175 total cpu time spent up to now is 1129.5 secs Computing kpt #: 176 total cpu time spent up to now is 1136.0 secs Computing kpt #: 177 total cpu time spent up to now is 1143.0 secs Computing kpt #: 178 total cpu time spent up to now is 1150.0 secs Computing kpt #: 179 total cpu time spent up to now is 1157.1 secs Computing kpt #: 180 total cpu time spent up to now is 1164.1 secs Computing kpt #: 181 total cpu time spent up to now is 1171.1 secs Computing kpt #: 182 total cpu time spent up to now is 1178.0 secs Computing kpt #: 183 total cpu time spent up to now is 1185.0 secs Computing kpt #: 184 total cpu time spent up to now is 1192.2 secs Computing kpt #: 185 total cpu time spent up to now is 1199.2 secs Computing kpt #: 186 total cpu time spent up to now is 1206.2 secs Computing kpt #: 187 total cpu time spent up to now is 1213.4 secs Computing kpt #: 188 total cpu time spent up to now is 1220.6 secs Computing kpt #: 189 total cpu time spent up to now is 1228.1 secs Computing kpt #: 190 total cpu time spent up to now is 1237.0 secs Computing kpt #: 191 total cpu time spent up to now is 1244.3 secs Computing kpt #: 192 total cpu time spent up to now is 1251.8 secs Computing kpt #: 193 total cpu time spent up to now is 1259.1 secs Computing kpt #: 194 total cpu time spent up to now is 1266.3 secs Computing kpt #: 195 total cpu time spent up to now is 1273.4 secs Computing kpt #: 196 total cpu time spent up to now is 1280.8 secs Computing kpt #: 197 total cpu time spent up to now is 1287.7 secs Computing kpt #: 198 total cpu time spent up to now is 1294.4 secs Computing kpt #: 199 total cpu time spent up to now is 1301.1 secs Computing kpt #: 200 total cpu time spent up to now is 1308.0 secs Computing kpt #: 201 total cpu time spent up to now is 1314.1 secs Computing kpt #: 202 total cpu time spent up to now is 1320.2 secs Computing kpt #: 203 total cpu time spent up to now is 1326.3 secs Computing kpt #: 204 total cpu time spent up to now is 1332.4 secs Computing kpt #: 205 total cpu time spent up to now is 1338.4 secs Computing kpt #: 206 total cpu time spent up to now is 1344.2 secs Computing kpt #: 207 total cpu time spent up to now is 1349.9 secs Computing kpt #: 208 total cpu time spent up to now is 1355.8 secs Computing kpt #: 209 total cpu time spent up to now is 1361.6 secs Computing kpt #: 210 total cpu time spent up to now is 1367.6 secs Computing kpt #: 211 total cpu time spent up to now is 1373.4 secs Computing kpt #: 212 total cpu time spent up to now is 1379.5 secs Computing kpt #: 213 total cpu time spent up to now is 1385.7 secs Computing kpt #: 214 total cpu time spent up to now is 1391.5 secs Computing kpt #: 215 total cpu time spent up to now is 1397.6 secs Computing kpt #: 216 total cpu time spent up to now is 1403.6 secs Computing kpt #: 217 total cpu time spent up to now is 1410.0 secs Computing kpt #: 218 total cpu time spent up to now is 1418.9 secs Computing kpt #: 219 total cpu time spent up to now is 1425.6 secs Computing kpt #: 220 total cpu time spent up to now is 1431.8 secs Computing kpt #: 221 total cpu time spent up to now is 1438.0 secs Computing kpt #: 222 total cpu time spent up to now is 1444.6 secs Computing kpt #: 223 total cpu time spent up to now is 1451.1 secs Computing kpt #: 224 total cpu time spent up to now is 1457.8 secs Computing kpt #: 225 total cpu time spent up to now is 1464.6 secs Computing kpt #: 226 total cpu time spent up to now is 1471.1 secs Computing kpt #: 227 total cpu time spent up to now is 1477.4 secs Computing kpt #: 228 total cpu time spent up to now is 1483.9 secs Computing kpt #: 229 total cpu time spent up to now is 1490.2 secs Computing kpt #: 230 total cpu time spent up to now is 1496.4 secs Computing kpt #: 231 total cpu time spent up to now is 1502.6 secs Computing kpt #: 232 total cpu time spent up to now is 1509.0 secs Computing kpt #: 233 total cpu time spent up to now is 1515.2 secs Computing kpt #: 234 total cpu time spent up to now is 1521.2 secs Computing kpt #: 235 total cpu time spent up to now is 1527.3 secs Computing kpt #: 236 total cpu time spent up to now is 1533.1 secs Computing kpt #: 237 total cpu time spent up to now is 1539.3 secs Computing kpt #: 238 total cpu time spent up to now is 1545.2 secs Computing kpt #: 239 total cpu time spent up to now is 1551.1 secs Computing kpt #: 240 total cpu time spent up to now is 1557.1 secs Computing kpt #: 241 total cpu time spent up to now is 1563.0 secs Computing kpt #: 242 total cpu time spent up to now is 1569.1 secs Computing kpt #: 243 total cpu time spent up to now is 1574.9 secs Computing kpt #: 244 total cpu time spent up to now is 1581.2 secs Computing kpt #: 245 total cpu time spent up to now is 1587.0 secs Computing kpt #: 246 total cpu time spent up to now is 1593.1 secs Computing kpt #: 247 total cpu time spent up to now is 1599.0 secs Computing kpt #: 248 total cpu time spent up to now is 1605.2 secs Computing kpt #: 249 total cpu time spent up to now is 1611.1 secs Computing kpt #: 250 total cpu time spent up to now is 1617.1 secs Computing kpt #: 251 total cpu time spent up to now is 1623.0 secs Computing kpt #: 252 total cpu time spent up to now is 1629.0 secs Computing kpt #: 253 total cpu time spent up to now is 1635.2 secs Computing kpt #: 254 total cpu time spent up to now is 1641.1 secs Computing kpt #: 255 total cpu time spent up to now is 1647.0 secs Computing kpt #: 256 total cpu time spent up to now is 1653.0 secs Computing kpt #: 257 total cpu time spent up to now is 1659.0 secs Computing kpt #: 258 total cpu time spent up to now is 1665.0 secs Computing kpt #: 259 total cpu time spent up to now is 1671.0 secs Computing kpt #: 260 total cpu time spent up to now is 1677.3 secs Computing kpt #: 261 total cpu time spent up to now is 1683.7 secs Computing kpt #: 262 total cpu time spent up to now is 1690.0 secs Computing kpt #: 263 total cpu time spent up to now is 1697.0 secs Computing kpt #: 264 total cpu time spent up to now is 1703.9 secs Computing kpt #: 265 total cpu time spent up to now is 1711.2 secs Computing kpt #: 266 total cpu time spent up to now is 1720.8 secs Computing kpt #: 267 total cpu time spent up to now is 1728.1 secs Computing kpt #: 268 total cpu time spent up to now is 1735.3 secs Computing kpt #: 269 total cpu time spent up to now is 1743.4 secs Computing kpt #: 270 total cpu time spent up to now is 1751.6 secs Computing kpt #: 271 total cpu time spent up to now is 1759.0 secs Computing kpt #: 272 total cpu time spent up to now is 1766.3 secs Computing kpt #: 273 total cpu time spent up to now is 1773.6 secs Computing kpt #: 274 total cpu time spent up to now is 1780.8 secs Computing kpt #: 275 total cpu time spent up to now is 1788.3 secs Computing kpt #: 276 total cpu time spent up to now is 1795.3 secs Computing kpt #: 277 total cpu time spent up to now is 1802.0 secs Computing kpt #: 278 total cpu time spent up to now is 1808.3 secs Computing kpt #: 279 total cpu time spent up to now is 1814.4 secs Computing kpt #: 280 total cpu time spent up to now is 1820.6 secs Computing kpt #: 281 total cpu time spent up to now is 1826.8 secs Computing kpt #: 282 total cpu time spent up to now is 1832.6 secs ethr = 1.52E-11, avg # of iterations = 35.5 total cpu time spent up to now is 1833.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8271 PWs) bands (ev): -17.0532 -17.0532 -16.1828 -16.1828 -16.1826 -16.1826 -12.9659 -12.9659 -12.9657 -12.9657 -12.8709 -12.8709 -12.8251 -12.8251 -11.3646 -11.3646 -11.3641 -11.3641 -6.3182 -6.3182 -6.3133 -6.3133 -6.0755 -6.0755 -5.4846 -5.4846 -3.9780 -3.9780 -3.9677 -3.9677 -3.2839 -3.2839 -3.0893 -3.0893 -2.4565 -2.4565 -2.4530 -2.4530 -2.0030 -2.0030 -1.9697 -1.9697 -0.4816 -0.4816 -0.4607 -0.4607 -0.3922 -0.3922 -0.3178 -0.3178 -0.3070 -0.3070 -0.1615 -0.1615 0.4926 0.4926 0.5817 0.5817 0.5918 0.5918 0.8691 0.8691 1.5495 1.5495 1.5498 1.5498 4.0159 4.0159 6.0458 6.0458 6.0555 6.0555 6.7619 6.7619 6.7619 6.7619 7.3552 7.3552 8.6336 8.6336 k = 0.0110-0.0114 0.0110 ( 8275 PWs) bands (ev): -17.0530 -17.0530 -16.1833 -16.1832 -16.1824 -16.1822 -12.9671 -12.9670 -12.9653 -12.9652 -12.8707 -12.8707 -12.8242 -12.8242 -11.3651 -11.3649 -11.3644 -11.3642 -6.3188 -6.3181 -6.3138 -6.3132 -6.0743 -6.0743 -5.4846 -5.4846 -3.9789 -3.9786 -3.9686 -3.9683 -3.2841 -3.2835 -3.0898 -3.0894 -2.4575 -2.4542 -2.4533 -2.4499 -2.0035 -2.0024 -1.9701 -1.9692 -0.4892 -0.4772 -0.4620 -0.4614 -0.4011 -0.3803 -0.3242 -0.3125 -0.3101 -0.3025 -0.1615 -0.1592 0.4910 0.4937 0.5797 0.5802 0.5891 0.5926 0.8707 0.8715 1.5473 1.5476 1.5500 1.5504 4.0179 4.0180 6.0443 6.0450 6.0542 6.0549 6.7585 6.7586 6.7641 6.7641 7.3577 7.3578 8.6357 8.6357 k = 0.0220-0.0227 0.0220 ( 8281 PWs) bands (ev): -17.0526 -17.0526 -16.1841 -16.1840 -16.1822 -16.1821 -12.9694 -12.9693 -12.9650 -12.9649 -12.8701 -12.8701 -12.8214 -12.8214 -11.3665 -11.3664 -11.3644 -11.3643 -6.3198 -6.3185 -6.3147 -6.3134 -6.0707 -6.0706 -5.4848 -5.4848 -3.9817 -3.9812 -3.9704 -3.9698 -3.2843 -3.2832 -3.0905 -3.0897 -2.4566 -2.4535 -2.4481 -2.4446 -2.0042 -2.0017 -1.9702 -1.9683 -0.4996 -0.4757 -0.4672 -0.4623 -0.4049 -0.3687 -0.3301 -0.3167 -0.3039 -0.2963 -0.1592 -0.1547 0.4888 0.4943 0.5728 0.5754 0.5858 0.5919 0.8762 0.8777 1.5434 1.5438 1.5490 1.5494 4.0242 4.0243 6.0391 6.0401 6.0531 6.0540 6.7538 6.7540 6.7656 6.7657 7.3652 7.3654 8.6418 8.6419 k = 0.0330-0.0341 0.0330 ( 8279 PWs) bands (ev): -17.0520 -17.0519 -16.1852 -16.1850 -16.1822 -16.1821 -12.9727 -12.9727 -12.9648 -12.9647 -12.8693 -12.8693 -12.8170 -12.8170 -11.3689 -11.3689 -11.3645 -11.3644 -6.3215 -6.3198 -6.3156 -6.3139 -6.0647 -6.0646 -5.4851 -5.4851 -3.9872 -3.9865 -3.9722 -3.9716 -3.2849 -3.2832 -3.0912 -3.0899 -2.4540 -2.4512 -2.4406 -2.4370 -2.0054 -2.0016 -1.9695 -1.9665 -0.5118 -0.4799 -0.4729 -0.4627 -0.4049 -0.3607 -0.3355 -0.3211 -0.2960 -0.2873 -0.1551 -0.1485 0.4858 0.4939 0.5617 0.5674 0.5823 0.5907 0.8850 0.8870 1.5378 1.5382 1.5466 1.5470 4.0345 4.0348 6.0288 6.0296 6.0535 6.0542 6.7475 6.7478 6.7667 6.7668 7.3776 7.3779 8.6518 8.6519 k = 0.0441-0.0455 0.0440 ( 8274 PWs) bands (ev): -17.0510 -17.0510 -16.1864 -16.1863 -16.1825 -16.1823 -12.9770 -12.9769 -12.9645 -12.9645 -12.8681 -12.8681 -12.8113 -12.8112 -11.3723 -11.3723 -11.3646 -11.3646 -6.3238 -6.3220 -6.3163 -6.3145 -6.0564 -6.0563 -5.4856 -5.4855 -3.9955 -3.9949 -3.9736 -3.9731 -3.2863 -3.2840 -3.0913 -3.0895 -2.4500 -2.4474 -2.4309 -2.4271 -2.0078 -2.0029 -1.9672 -1.9634 -0.5249 -0.4923 -0.4739 -0.4630 -0.4038 -0.3583 -0.3407 -0.3242 -0.2848 -0.2758 -0.1495 -0.1412 0.4814 0.4917 0.5483 0.5572 0.5785 0.5893 0.8964 0.8986 1.5305 1.5309 1.5428 1.5433 4.0489 4.0492 6.0138 6.0144 6.0548 6.0554 6.7396 6.7399 6.7676 6.7677 7.3948 7.3953 8.6655 8.6657 k = 0.0551-0.0568 0.0550 ( 8274 PWs) bands (ev): -17.0498 -17.0498 -16.1879 -16.1877 -16.1828 -16.1827 -12.9820 -12.9819 -12.9643 -12.9642 -12.8666 -12.8666 -12.8043 -12.8043 -11.3766 -11.3765 -11.3648 -11.3647 -6.3267 -6.3250 -6.3169 -6.3151 -6.0460 -6.0459 -5.4861 -5.4861 -4.0066 -4.0060 -3.9749 -3.9744 -3.2890 -3.2862 -3.0900 -3.0878 -2.4446 -2.4422 -2.4192 -2.4150 -2.0119 -2.0061 -1.9628 -1.9585 -0.5382 -0.5064 -0.4748 -0.4633 -0.4038 -0.3603 -0.3458 -0.3262 -0.2697 -0.2624 -0.1431 -0.1331 0.4748 0.4862 0.5348 0.5467 0.5744 0.5878 0.9095 0.9118 1.5214 1.5219 1.5377 1.5383 4.0670 4.0673 5.9944 5.9949 6.0568 6.0572 6.7302 6.7306 6.7685 6.7686 7.4165 7.4171 8.6824 8.6827 k = 0.0661-0.0682 0.0660 ( 8278 PWs) bands (ev): -17.0484 -17.0484 -16.1896 -16.1894 -16.1834 -16.1832 -12.9874 -12.9874 -12.9640 -12.9640 -12.8649 -12.8649 -12.7965 -12.7965 -11.3816 -11.3815 -11.3649 -11.3649 -6.3303 -6.3286 -6.3174 -6.3158 -6.0336 -6.0335 -5.4868 -5.4867 -4.0200 -4.0193 -3.9761 -3.9756 -3.2938 -3.2905 -3.0869 -3.0842 -2.4379 -2.4358 -2.4056 -2.4010 -2.0178 -2.0114 -1.9564 -1.9518 -0.5513 -0.5208 -0.4763 -0.4637 -0.4054 -0.3643 -0.3501 -0.3279 -0.2521 -0.2473 -0.1363 -0.1247 0.4651 0.4754 0.5234 0.5379 0.5703 0.5863 0.9236 0.9259 1.5106 1.5111 1.5313 1.5321 4.0886 4.0891 5.9711 5.9716 6.0593 6.0597 6.7196 6.7201 6.7693 6.7695 7.4427 7.4434 8.7023 8.7026 k = 0.0771-0.0796 0.0770 ( 8278 PWs) bands (ev): -17.0468 -17.0468 -16.1914 -16.1913 -16.1841 -16.1839 -12.9931 -12.9931 -12.9637 -12.9637 -12.8631 -12.8631 -12.7881 -12.7880 -11.3873 -11.3872 -11.3651 -11.3651 -6.3343 -6.3328 -6.3180 -6.3165 -6.0194 -6.0193 -5.4876 -5.4874 -4.0355 -4.0347 -3.9773 -3.9768 -3.3010 -3.2973 -3.0812 -3.0782 -2.4301 -2.4281 -2.3905 -2.3853 -2.0254 -2.0185 -1.9482 -1.9436 -0.5641 -0.5349 -0.4783 -0.4645 -0.4085 -0.3694 -0.3528 -0.3296 -0.2336 -0.2310 -0.1294 -0.1162 0.4516 0.4592 0.5148 0.5321 0.5663 0.5850 0.9383 0.9404 1.4982 1.4987 1.5239 1.5247 4.1136 4.1140 5.9442 5.9447 6.0622 6.0626 6.7079 6.7085 6.7702 6.7704 7.4729 7.4737 8.7245 8.7248 k = 0.0881-0.0910 0.0880 ( 8276 PWs) bands (ev): -17.0449 -17.0449 -16.1935 -16.1934 -16.1849 -16.1847 -12.9990 -12.9989 -12.9634 -12.9634 -12.8611 -12.8611 -12.7791 -12.7791 -11.3935 -11.3935 -11.3653 -11.3652 -6.3387 -6.3373 -6.3187 -6.3173 -6.0037 -6.0035 -5.4884 -5.4883 -4.0526 -4.0517 -3.9785 -3.9780 -3.3109 -3.3069 -3.0727 -3.0695 -2.4212 -2.4192 -2.3739 -2.3681 -2.0345 -2.0272 -1.9387 -1.9340 -0.5764 -0.5486 -0.4807 -0.4658 -0.4125 -0.3747 -0.3539 -0.3311 -0.2158 -0.2129 -0.1227 -0.1078 0.4346 0.4395 0.5084 0.5285 0.5630 0.5839 0.9530 0.9549 1.4842 1.4848 1.5153 1.5163 4.1414 4.1420 5.9142 5.9148 6.0655 6.0659 6.6956 6.6962 6.7712 6.7713 7.5069 7.5079 8.7485 8.7489 k = 0.0991-0.1023 0.0990 ( 8278 PWs) bands (ev): -17.0428 -17.0428 -16.1957 -16.1956 -16.1858 -16.1857 -13.0048 -13.0047 -12.9632 -12.9631 -12.8590 -12.8590 -12.7699 -12.7699 -11.4002 -11.4001 -11.3654 -11.3654 -6.3435 -6.3421 -6.3194 -6.3180 -5.9866 -5.9864 -5.4893 -5.4891 -4.0712 -4.0701 -3.9796 -3.9791 -3.3234 -3.3193 -3.0616 -3.0581 -2.4113 -2.4093 -2.3563 -2.3497 -2.0450 -2.0373 -1.9281 -1.9235 -0.5880 -0.5616 -0.4835 -0.4674 -0.4167 -0.3799 -0.3537 -0.3321 -0.1991 -0.1939 -0.1163 -0.0996 0.4152 0.4181 0.5032 0.5257 0.5607 0.5833 0.9674 0.9692 1.4688 1.4694 1.5058 1.5069 4.1718 4.1724 5.8815 5.8821 6.0690 6.0696 6.6829 6.6836 6.7722 6.7723 7.5446 7.5456 8.7739 8.7743 k = 0.1102-0.1137 0.1101 ( 8271 PWs) bands (ev): -17.0406 -17.0405 -16.1981 -16.1980 -16.1869 -16.1867 -13.0105 -13.0105 -12.9629 -12.9628 -12.8570 -12.8570 -12.7605 -12.7605 -11.4071 -11.4071 -11.3655 -11.3655 -6.3483 -6.3470 -6.3202 -6.3189 -5.9685 -5.9682 -5.4902 -5.4901 -4.0907 -4.0896 -3.9808 -3.9802 -3.3384 -3.3342 -3.0480 -3.0444 -2.4003 -2.3982 -2.3378 -2.3304 -2.0566 -2.0485 -1.9167 -1.9122 -0.5989 -0.5739 -0.4866 -0.4693 -0.4210 -0.3848 -0.3525 -0.3326 -0.1830 -0.1754 -0.1101 -0.0915 0.3940 0.3966 0.4987 0.5227 0.5596 0.5831 0.9813 0.9829 1.4521 1.4527 1.4953 1.4966 4.2044 4.2050 5.8465 5.8471 6.0728 6.0734 6.6702 6.6709 6.7733 6.7734 7.5855 7.5867 8.7999 8.8003 k = 0.1212-0.1251 0.1211 ( 8272 PWs) bands (ev): -17.0381 -17.0381 -16.2006 -16.2004 -16.1880 -16.1879 -13.0160 -13.0160 -12.9627 -12.9626 -12.8550 -12.8549 -12.7512 -12.7511 -11.4142 -11.4141 -11.3656 -11.3655 -6.3533 -6.3521 -6.3210 -6.3197 -5.9496 -5.9494 -5.4911 -5.4910 -4.1110 -4.1097 -3.9818 -3.9812 -3.3556 -3.3513 -3.0324 -3.0287 -2.3884 -2.3862 -2.3189 -2.3104 -2.0692 -2.0605 -1.9048 -1.9004 -0.6090 -0.5854 -0.4896 -0.4714 -0.4251 -0.3892 -0.3503 -0.3323 -0.1678 -0.1580 -0.1038 -0.0833 0.3720 0.3755 0.4945 0.5192 0.5598 0.5833 0.9944 0.9959 1.4342 1.4349 1.4840 1.4855 4.2386 4.2393 5.8097 5.8103 6.0768 6.0774 6.6577 6.6585 6.7744 6.7745 7.6295 7.6308 8.8259 8.8264 k = 0.1322-0.1364 0.1321 ( 8277 PWs) bands (ev): -17.0356 -17.0355 -16.2031 -16.2030 -16.1893 -16.1892 -13.0213 -13.0212 -12.9625 -12.9625 -12.8530 -12.8530 -12.7420 -12.7419 -11.4212 -11.4212 -11.3656 -11.3655 -6.3583 -6.3571 -6.3218 -6.3206 -5.9304 -5.9301 -5.4920 -5.4918 -4.1315 -4.1302 -3.9828 -3.9822 -3.3745 -3.3702 -3.0154 -3.0116 -2.3757 -2.3733 -2.2998 -2.2901 -2.0825 -2.0729 -1.8927 -1.8884 -0.6181 -0.5960 -0.4925 -0.4733 -0.4291 -0.3932 -0.3472 -0.3310 -0.1541 -0.1425 -0.0969 -0.0750 0.3503 0.3550 0.4906 0.5153 0.5610 0.5838 1.0065 1.0081 1.4154 1.4162 1.4720 1.4737 4.2739 4.2747 5.7717 5.7722 6.0808 6.0815 6.6457 6.6465 6.7755 6.7757 7.6762 7.6776 8.8514 8.8519 k = 0.1432-0.1478 0.1431 ( 8281 PWs) bands (ev): -17.0329 -17.0328 -16.2057 -16.2056 -16.1906 -16.1905 -13.0262 -13.0262 -12.9624 -12.9624 -12.8512 -12.8512 -12.7330 -12.7330 -11.4281 -11.4280 -11.3655 -11.3654 -6.3632 -6.3620 -6.3227 -6.3215 -5.9110 -5.9107 -5.4928 -5.4926 -4.1520 -4.1506 -3.9837 -3.9830 -3.3949 -3.3907 -2.9974 -2.9937 -2.3621 -2.3595 -2.2811 -2.2697 -2.0959 -2.0852 -1.8807 -1.8765 -0.6264 -0.6056 -0.4951 -0.4747 -0.4332 -0.3970 -0.3433 -0.3289 -0.1421 -0.1297 -0.0890 -0.0663 0.3295 0.3354 0.4868 0.5111 0.5627 0.5846 1.0176 1.0194 1.3957 1.3966 1.4593 1.4612 4.3098 4.3106 5.7330 5.7335 6.0847 6.0854 6.6345 6.6354 6.7767 6.7769 7.7254 7.7269 8.8757 8.8763 k = 0.1542-0.1592 0.1541 ( 8281 PWs) bands (ev): -17.0301 -17.0300 -16.2084 -16.2083 -16.1920 -16.1919 -13.0308 -13.0307 -12.9625 -12.9624 -12.8496 -12.8496 -12.7245 -12.7244 -11.4346 -11.4345 -11.3653 -11.3653 -6.3678 -6.3667 -6.3236 -6.3224 -5.8921 -5.8917 -5.4935 -5.4933 -4.1720 -4.1705 -3.9844 -3.9837 -3.4165 -3.4123 -2.9792 -2.9754 -2.3477 -2.3450 -2.2634 -2.2500 -2.1087 -2.0965 -1.8689 -1.8649 -0.6336 -0.6142 -0.4973 -0.4757 -0.4373 -0.4005 -0.3386 -0.3257 -0.1321 -0.1200 -0.0794 -0.0571 0.3099 0.3172 0.4832 0.5069 0.5647 0.5853 1.0275 1.0297 1.3755 1.3766 1.4461 1.4483 4.3454 4.3463 5.6944 5.6948 6.0884 6.0892 6.6242 6.6251 6.7779 6.7781 7.7769 7.7785 8.8982 8.8989 k = 0.1652-0.1705 0.1651 ( 8281 PWs) bands (ev): -17.0272 -17.0271 -16.2110 -16.2109 -16.1935 -16.1934 -13.0349 -13.0349 -12.9626 -12.9626 -12.8483 -12.8483 -12.7164 -12.7164 -11.4406 -11.4405 -11.3650 -11.3650 -6.3722 -6.3711 -6.3244 -6.3233 -5.8738 -5.8735 -5.4940 -5.4938 -4.1910 -4.1894 -3.9850 -3.9843 -3.4391 -3.4349 -2.9612 -2.9574 -2.3326 -2.3297 -2.2478 -2.2319 -2.1198 -2.1055 -1.8578 -1.8540 -0.6398 -0.6216 -0.4990 -0.4760 -0.4414 -0.4036 -0.3332 -0.3216 -0.1240 -0.1129 -0.0687 -0.0475 0.2921 0.3006 0.4798 0.5027 0.5666 0.5860 1.0361 1.0388 1.3550 1.3562 1.4324 1.4348 4.3801 4.3810 5.6567 5.6571 6.0919 6.0928 6.6151 6.6161 6.7791 6.7793 7.8303 7.8320 8.9183 8.9191 k = 0.1763-0.1819 0.1761 ( 8273 PWs) bands (ev): -17.0242 -17.0242 -16.2136 -16.2135 -16.1950 -16.1949 -13.0387 -13.0386 -12.9629 -12.9628 -12.8472 -12.8472 -12.7089 -12.7089 -11.4459 -11.4459 -11.3646 -11.3646 -6.3763 -6.3752 -6.3252 -6.3241 -5.8567 -5.8563 -5.4944 -5.4942 -4.2087 -4.2070 -3.9855 -3.9848 -3.4624 -3.4582 -2.9442 -2.9403 -2.3168 -2.3138 -2.2356 -2.2173 -2.1268 -2.1106 -1.8475 -1.8439 -0.6449 -0.6279 -0.5002 -0.4757 -0.4453 -0.4064 -0.3271 -0.3166 -0.1177 -0.1077 -0.0577 -0.0378 0.2762 0.2860 0.4766 0.4987 0.5681 0.5862 1.0434 1.0467 1.3343 1.3358 1.4184 1.4211 4.4130 4.4139 5.6207 5.6211 6.0950 6.0959 6.6073 6.6083 6.7803 6.7805 7.8853 7.8872 8.9356 8.9365 k = 0.1873-0.1933 0.1871 ( 8277 PWs) bands (ev): -17.0212 -17.0212 -16.2162 -16.2161 -16.1966 -16.1965 -13.0420 -13.0419 -12.9633 -12.9632 -12.8465 -12.8465 -12.7022 -12.7022 -11.4505 -11.4504 -11.3641 -11.3640 -6.3799 -6.3788 -6.3260 -6.3249 -5.8411 -5.8407 -5.4945 -5.4943 -4.2246 -4.2228 -3.9859 -3.9852 -3.4862 -3.4821 -2.9288 -2.9249 -2.3005 -2.2975 -2.2281 -2.2089 -2.1266 -2.1099 -1.8383 -1.8349 -0.6489 -0.6331 -0.5010 -0.4750 -0.4489 -0.4087 -0.3204 -0.3108 -0.1128 -0.1036 -0.0473 -0.0282 0.2626 0.2736 0.4737 0.4950 0.5689 0.5859 1.0494 1.0534 1.3139 1.3156 1.4041 1.4071 4.4429 4.4438 5.5876 5.5879 6.0976 6.0986 6.6009 6.6019 6.7815 6.7817 7.9416 7.9436 8.9496 8.9506 k = 0.1983-0.2046 0.1981 ( 8282 PWs) bands (ev): -17.0182 -17.0182 -16.2187 -16.2185 -16.1982 -16.1980 -13.0448 -13.0447 -12.9638 -12.9638 -12.8461 -12.8461 -12.6962 -12.6962 -11.4541 -11.4541 -11.3634 -11.3634 -6.3831 -6.3820 -6.3268 -6.3257 -5.8274 -5.8270 -5.4943 -5.4941 -4.2383 -4.2364 -3.9862 -3.9854 -3.5103 -3.5062 -2.9156 -2.9117 -2.2838 -2.2811 -2.2256 -2.2076 -2.1178 -2.1027 -1.8304 -1.8273 -0.6518 -0.6370 -0.5013 -0.4741 -0.4517 -0.4104 -0.3131 -0.3042 -0.1087 -0.1001 -0.0378 -0.0192 0.2514 0.2637 0.4709 0.4916 0.5688 0.5847 1.0541 1.0587 1.2939 1.2960 1.3898 1.3930 4.4687 4.4697 5.5585 5.5587 6.0996 6.1007 6.5960 6.5970 6.7827 6.7830 7.9988 8.0010 8.9600 8.9610 k = 0.2093-0.2160 0.2091 ( 8286 PWs) bands (ev): -17.0152 -17.0152 -16.2210 -16.2209 -16.1998 -16.1997 -13.0471 -13.0470 -12.9645 -12.9645 -12.8462 -12.8462 -12.6911 -12.6911 -11.4568 -11.4567 -11.3626 -11.3626 -6.3858 -6.3847 -6.3275 -6.3264 -5.8160 -5.8156 -5.4939 -5.4937 -4.2494 -4.2475 -3.9863 -3.9856 -3.5346 -3.5306 -2.9054 -2.9015 -2.2671 -2.2653 -2.2259 -2.2101 -2.1026 -2.0901 -1.8240 -1.8211 -0.6537 -0.6396 -0.5013 -0.4734 -0.4533 -0.4113 -0.3054 -0.2970 -0.1053 -0.0971 -0.0296 -0.0108 0.2428 0.2565 0.4684 0.4884 0.5676 0.5825 1.0573 1.0627 1.2746 1.2771 1.3754 1.3789 4.4894 4.4904 5.5345 5.5347 6.1010 6.1021 6.5925 6.5936 6.7839 6.7841 8.0565 8.0589 8.9665 8.9676 k = 0.2203-0.2274 0.2201 ( 8265 PWs) bands (ev): -17.0123 -17.0123 -16.2232 -16.2231 -16.2014 -16.2013 -13.0489 -13.0488 -12.9654 -12.9653 -12.8466 -12.8466 -12.6870 -12.6870 -11.4583 -11.4582 -11.3616 -11.3616 -6.3879 -6.3868 -6.3282 -6.3271 -5.8071 -5.8068 -5.4932 -5.4930 -4.2577 -4.2557 -3.9864 -3.9857 -3.5589 -3.5550 -2.8986 -2.8948 -2.2522 -2.2513 -2.2256 -2.2116 -2.0840 -2.0738 -1.8192 -1.8164 -0.6545 -0.6411 -0.5010 -0.4734 -0.4530 -0.4115 -0.2974 -0.2893 -0.1020 -0.0943 -0.0227 -0.0033 0.2369 0.2519 0.4660 0.4855 0.5649 0.5791 1.0592 1.0654 1.2564 1.2594 1.3611 1.3649 4.5038 4.5047 5.5167 5.5170 6.1016 6.1028 6.5906 6.5918 6.7851 6.7853 8.1142 8.1168 8.9693 8.9704 k = 0.2313-0.2388 0.2311 ( 8266 PWs) bands (ev): -17.0094 -17.0093 -16.2253 -16.2252 -16.2030 -16.2029 -13.0502 -13.0502 -12.9664 -12.9663 -12.8476 -12.8475 -12.6838 -12.6837 -11.4587 -11.4586 -11.3606 -11.3605 -6.3894 -6.3883 -6.3288 -6.3277 -5.8011 -5.8007 -5.4921 -5.4919 -4.2628 -4.2608 -3.9864 -3.9857 -3.5832 -3.5792 -2.8958 -2.8921 -2.2452 -2.2403 -2.2191 -2.2065 -2.0639 -2.0555 -1.8162 -1.8134 -0.6544 -0.6414 -0.5004 -0.4741 -0.4510 -0.4108 -0.2891 -0.2810 -0.0989 -0.0917 -0.0170 0.0033 0.2337 0.2498 0.4638 0.4828 0.5606 0.5742 1.0598 1.0667 1.2396 1.2430 1.3470 1.3511 4.5109 4.5118 5.5061 5.5064 6.1015 6.1028 6.5903 6.5914 6.7862 6.7865 8.1713 8.1740 8.9686 8.9696 k = 0.2424-0.2501 0.2421 ( 8274 PWs) bands (ev): -17.0065 -17.0065 -16.2272 -16.2271 -16.2046 -16.2045 -13.0510 -13.0510 -12.9675 -12.9675 -12.8489 -12.8489 -12.6815 -12.6815 -11.4578 -11.4578 -11.3593 -11.3593 -6.3903 -6.3892 -6.3293 -6.3282 -5.7980 -5.7976 -5.4908 -5.4906 -4.2648 -4.2626 -3.9863 -3.9856 -3.6072 -3.6033 -2.8973 -2.8937 -2.2431 -2.2363 -2.2049 -2.1935 -2.0431 -2.0358 -1.8148 -1.8120 -0.6534 -0.6406 -0.4994 -0.4748 -0.4475 -0.4092 -0.2806 -0.2724 -0.0958 -0.0894 -0.0122 0.0092 0.2330 0.2502 0.4616 0.4804 0.5546 0.5677 1.0591 1.0667 1.2242 1.2281 1.3332 1.3376 4.5102 4.5112 5.5033 5.5036 6.1006 6.1019 6.5914 6.5926 6.7873 6.7876 8.2269 8.2298 8.9650 8.9661 k = 0.2534-0.2615 0.2531 ( 8272 PWs) bands (ev): -17.0038 -17.0037 -16.2290 -16.2288 -16.2063 -16.2061 -13.0513 -13.0512 -12.9688 -12.9688 -12.8507 -12.8507 -12.6803 -12.6803 -11.4558 -11.4558 -11.3580 -11.3579 -6.3906 -6.3895 -6.3298 -6.3287 -5.7979 -5.7976 -5.4891 -5.4889 -4.2634 -4.2611 -3.9861 -3.9854 -3.6310 -3.6270 -2.9031 -2.8997 -2.2413 -2.2341 -2.1877 -2.1769 -2.0220 -2.0156 -1.8151 -1.8120 -0.6515 -0.6387 -0.4981 -0.4753 -0.4430 -0.4066 -0.2721 -0.2635 -0.0927 -0.0873 -0.0082 0.0143 0.2348 0.2528 0.4595 0.4781 0.5466 0.5596 1.0573 1.0654 1.2106 1.2149 1.3198 1.3244 4.5017 4.5027 5.5082 5.5087 6.0990 6.1003 6.5939 6.5952 6.7884 6.7886 8.2799 8.2830 8.9596 8.9607 k = 0.2644-0.2729 0.2641 ( 8272 PWs) bands (ev): -17.0011 -17.0011 -16.2305 -16.2304 -16.2078 -16.2077 -13.0511 -13.0510 -12.9702 -12.9702 -12.8530 -12.8530 -12.6800 -12.6800 -11.4527 -11.4526 -11.3565 -11.3564 -6.3902 -6.3891 -6.3301 -6.3291 -5.8009 -5.8005 -5.4871 -5.4869 -4.2587 -4.2564 -3.9858 -3.9851 -3.6543 -3.6503 -2.9131 -2.9099 -2.2381 -2.2310 -2.1698 -2.1591 -2.0011 -1.9951 -1.8169 -1.8134 -0.6487 -0.6357 -0.4965 -0.4751 -0.4376 -0.4032 -0.2636 -0.2544 -0.0898 -0.0852 -0.0047 0.0188 0.2389 0.2575 0.4572 0.4761 0.5368 0.5499 1.0543 1.0629 1.1988 1.2034 1.3069 1.3117 4.4858 4.4867 5.5206 5.5211 6.0966 6.0979 6.5979 6.5991 6.7894 6.7897 8.3292 8.3324 8.9539 8.9549 k = 0.2754-0.2842 0.2751 ( 8271 PWs) bands (ev): -16.9985 -16.9985 -16.2318 -16.2317 -16.2094 -16.2093 -13.0504 -13.0503 -12.9717 -12.9717 -12.8558 -12.8558 -12.6807 -12.6807 -11.4484 -11.4483 -11.3549 -11.3548 -6.3892 -6.3882 -6.3305 -6.3294 -5.8067 -5.8064 -5.4848 -5.4846 -4.2509 -4.2485 -3.9854 -3.9848 -3.6771 -3.6731 -2.9269 -2.9239 -2.2333 -2.2262 -2.1520 -2.1412 -1.9805 -1.9746 -1.8197 -1.8157 -0.6450 -0.6317 -0.4944 -0.4742 -0.4316 -0.3988 -0.2552 -0.2453 -0.0872 -0.0833 -0.0017 0.0228 0.2450 0.2641 0.4547 0.4741 0.5252 0.5390 1.0504 1.0591 1.1889 1.1937 1.2946 1.2995 4.4632 4.4641 5.5395 5.5401 6.0934 6.0947 6.6031 6.6044 6.7904 6.7907 8.3730 8.3763 8.9497 8.9507 k = 0.2864-0.2956 0.2861 ( 8275 PWs) bands (ev): -16.9961 -16.9961 -16.2330 -16.2329 -16.2109 -16.2108 -13.0492 -13.0492 -12.9733 -12.9733 -12.8590 -12.8589 -12.6823 -12.6822 -11.4431 -11.4430 -11.3532 -11.3531 -6.3877 -6.3866 -6.3307 -6.3296 -5.8152 -5.8149 -5.4822 -5.4820 -4.2402 -4.2377 -3.9850 -3.9843 -3.6992 -3.6953 -2.9441 -2.9413 -2.2269 -2.2198 -2.1348 -2.1237 -1.9605 -1.9544 -1.8233 -1.8188 -0.6405 -0.6267 -0.4920 -0.4724 -0.4249 -0.3935 -0.2472 -0.2365 -0.0852 -0.0814 0.0010 0.0263 0.2531 0.2723 0.4514 0.4720 0.5123 0.5274 1.0455 1.0542 1.1809 1.1857 1.2829 1.2879 4.4351 4.4359 5.5639 5.5647 6.0895 6.0909 6.6094 6.6107 6.7913 6.7916 8.4095 8.4128 8.9492 8.9503 k = 0.2974-0.3070 0.2971 ( 8273 PWs) bands (ev): -16.9938 -16.9938 -16.2339 -16.2338 -16.2124 -16.2123 -13.0476 -13.0475 -12.9750 -12.9750 -12.8625 -12.8625 -12.6847 -12.6846 -11.4368 -11.4368 -11.3514 -11.3513 -6.3855 -6.3844 -6.3309 -6.3298 -5.8261 -5.8258 -5.4793 -5.4792 -4.2269 -4.2243 -3.9845 -3.9838 -3.7207 -3.7167 -2.9641 -2.9615 -2.2192 -2.2121 -2.1186 -2.1071 -1.9414 -1.9347 -1.8270 -1.8218 -0.6352 -0.6207 -0.4892 -0.4700 -0.4175 -0.3873 -0.2395 -0.2279 -0.0838 -0.0794 0.0035 0.0293 0.2629 0.2821 0.4469 0.4689 0.4991 0.5158 1.0398 1.0482 1.1747 1.1793 1.2719 1.2768 4.4025 4.4034 5.5927 5.5935 6.0851 6.0864 6.6168 6.6182 6.7922 6.7925 8.4367 8.4401 8.9546 8.9556 k = 0.3085-0.3183 0.3081 ( 8274 PWs) bands (ev): -16.9917 -16.9916 -16.2347 -16.2346 -16.2138 -16.2137 -13.0455 -13.0455 -12.9767 -12.9766 -12.8665 -12.8665 -12.6878 -12.6878 -11.4297 -11.4297 -11.3495 -11.3494 -6.3829 -6.3818 -6.3310 -6.3299 -5.8390 -5.8387 -5.4763 -5.4761 -4.2113 -4.2087 -3.9839 -3.9832 -3.7415 -3.7374 -2.9863 -2.9839 -2.2107 -2.2036 -2.1039 -2.0921 -1.9234 -1.9158 -1.8302 -1.8242 -0.6289 -0.6137 -0.4861 -0.4668 -0.4096 -0.3803 -0.2324 -0.2199 -0.0830 -0.0777 0.0056 0.0317 0.2742 0.2932 0.4401 0.4623 0.4883 0.5056 1.0332 1.0412 1.1702 1.1746 1.2616 1.2665 4.3668 4.3676 5.6247 5.6255 6.0801 6.0814 6.6252 6.6265 6.7930 6.7934 8.4536 8.4569 8.9670 8.9682 k = 0.3195-0.3297 0.3192 ( 8273 PWs) bands (ev): -16.9897 -16.9896 -16.2353 -16.2352 -16.2152 -16.2151 -13.0430 -13.0430 -12.9784 -12.9783 -12.8708 -12.8708 -12.6916 -12.6916 -11.4220 -11.4219 -11.3476 -11.3475 -6.3798 -6.3786 -6.3311 -6.3299 -5.8536 -5.8534 -5.4732 -5.4730 -4.1939 -4.1912 -3.9832 -3.9825 -3.7614 -3.7573 -3.0100 -3.0079 -2.2016 -2.1946 -2.0912 -2.0792 -1.9070 -1.8981 -1.8318 -1.8248 -0.6217 -0.6058 -0.4827 -0.4630 -0.4009 -0.3724 -0.2258 -0.2125 -0.0827 -0.0764 0.0073 0.0333 0.2869 0.3054 0.4304 0.4498 0.4829 0.4980 1.0258 1.0332 1.1672 1.1712 1.2521 1.2568 4.3288 4.3296 5.6588 5.6597 6.0747 6.0759 6.6343 6.6356 6.7938 6.7942 8.4599 8.4631 8.9867 8.9881 k = 0.3305-0.3411 0.3302 ( 8266 PWs) bands (ev): -16.9878 -16.9878 -16.2357 -16.2356 -16.2165 -16.2164 -13.0402 -13.0402 -12.9800 -12.9800 -12.8754 -12.8754 -12.6960 -12.6960 -11.4137 -11.4136 -11.3456 -11.3456 -6.3762 -6.3751 -6.3311 -6.3299 -5.8696 -5.8693 -5.4699 -5.4697 -4.1751 -4.1722 -3.9824 -3.9817 -3.7804 -3.7763 -3.0348 -3.0329 -2.1925 -2.1855 -2.0812 -2.0689 -1.8927 -1.8821 -1.8309 -1.8228 -0.6137 -0.5969 -0.4791 -0.4588 -0.3916 -0.3637 -0.2200 -0.2060 -0.0828 -0.0755 0.0085 0.0341 0.3006 0.3183 0.4178 0.4333 0.4815 0.4934 1.0175 1.0242 1.1655 1.1692 1.2434 1.2479 4.2896 4.2903 5.6941 5.6950 6.0689 6.0701 6.6440 6.6453 6.7945 6.7949 8.4570 8.4601 9.0123 9.0139 k = 0.3415-0.3524 0.3412 ( 8250 PWs) bands (ev): -16.9861 -16.9861 -16.2359 -16.2358 -16.2178 -16.2177 -13.0370 -13.0370 -12.9817 -12.9816 -12.8802 -12.8802 -12.7008 -12.7008 -11.4050 -11.4050 -11.3437 -11.3436 -6.3723 -6.3712 -6.3311 -6.3299 -5.8864 -5.8862 -5.4666 -5.4664 -4.1552 -4.1522 -3.9816 -3.9808 -3.7985 -3.7942 -3.0601 -3.0584 -2.1835 -2.1766 -2.0741 -2.0617 -1.8805 -1.8686 -1.8263 -1.8174 -0.6049 -0.5872 -0.4753 -0.4542 -0.3817 -0.3543 -0.2149 -0.2004 -0.0834 -0.0753 0.0088 0.0339 0.3144 0.3312 0.4038 0.4158 0.4821 0.4916 1.0084 1.0144 1.1650 1.1683 1.2355 1.2397 4.2501 4.2507 5.7298 5.7307 6.0630 6.0641 6.6542 6.6554 6.7952 6.7956 8.4468 8.4497 9.0415 9.0433 k = 0.3525-0.3638 0.3522 ( 8255 PWs) bands (ev): -16.9845 -16.9845 -16.2360 -16.2359 -16.2190 -16.2189 -13.0336 -13.0335 -12.9832 -12.9831 -12.8852 -12.8852 -12.7060 -12.7060 -11.3962 -11.3961 -11.3417 -11.3417 -6.3682 -6.3670 -6.3310 -6.3298 -5.9037 -5.9035 -5.4633 -5.4631 -4.1348 -4.1317 -3.9806 -3.9797 -3.8156 -3.8112 -3.0853 -3.0839 -2.1751 -2.1680 -2.0704 -2.0578 -1.8699 -1.8575 -1.8178 -1.8089 -0.5953 -0.5766 -0.4715 -0.4493 -0.3711 -0.3441 -0.2107 -0.1959 -0.0843 -0.0757 0.0083 0.0326 0.3268 0.3413 0.3921 0.4001 0.4838 0.4917 0.9984 1.0037 1.1653 1.1684 1.2283 1.2323 4.2108 4.2114 5.7652 5.7661 6.0569 6.0579 6.6646 6.6658 6.7958 6.7962 8.4312 8.4340 9.0716 9.0736 k = 0.3635-0.3752 0.3632 ( 8245 PWs) bands (ev): -16.9831 -16.9831 -16.2360 -16.2359 -16.2201 -16.2200 -13.0299 -13.0299 -12.9846 -12.9846 -12.8903 -12.8903 -12.7114 -12.7114 -11.3873 -11.3872 -11.3398 -11.3398 -6.3639 -6.3626 -6.3309 -6.3296 -5.9211 -5.9209 -5.4600 -5.4599 -4.1143 -4.1110 -3.9796 -3.9786 -3.8316 -3.8271 -3.1102 -3.1089 -2.1673 -2.1600 -2.0699 -2.0571 -1.8598 -1.8478 -1.8067 -1.7984 -0.5852 -0.5654 -0.4678 -0.4443 -0.3599 -0.3332 -0.2072 -0.1926 -0.0855 -0.0768 0.0068 0.0300 0.3326 0.3425 0.3891 0.3919 0.4863 0.4932 0.9878 0.9923 1.1664 1.1692 1.2219 1.2256 4.1725 4.1730 5.7996 5.8005 6.0508 6.0518 6.6752 6.6763 6.7963 6.7967 8.4124 8.4150 9.1001 9.1023 k = 0.3746-0.3866 0.3742 ( 8248 PWs) bands (ev): -16.9818 -16.9818 -16.2359 -16.2358 -16.2212 -16.2210 -13.0261 -13.0260 -12.9859 -12.9858 -12.8954 -12.8954 -12.7169 -12.7169 -11.3785 -11.3784 -11.3380 -11.3379 -6.3596 -6.3582 -6.3308 -6.3294 -5.9382 -5.9380 -5.4569 -5.4568 -4.0939 -4.0906 -3.9786 -3.9774 -3.8465 -3.8420 -3.1342 -3.1332 -2.1604 -2.1525 -2.0721 -2.0589 -1.8496 -1.8383 -1.7945 -1.7871 -0.5745 -0.5536 -0.4642 -0.4393 -0.3482 -0.3217 -0.2046 -0.1904 -0.0869 -0.0786 0.0042 0.0260 0.3261 0.3330 0.3940 0.4004 0.4896 0.4958 0.9765 0.9803 1.1680 1.1707 1.2163 1.2196 4.1357 4.1362 5.8325 5.8335 6.0449 6.0458 6.6856 6.6867 6.7968 6.7971 8.3917 8.3942 9.1248 9.1270 k = 0.3856-0.3979 0.3852 ( 8241 PWs) bands (ev): -16.9807 -16.9807 -16.2357 -16.2356 -16.2222 -16.2220 -13.0222 -13.0221 -12.9871 -12.9870 -12.9005 -12.9005 -12.7224 -12.7224 -11.3700 -11.3700 -11.3362 -11.3361 -6.3553 -6.3538 -6.3307 -6.3292 -5.9547 -5.9546 -5.4540 -5.4539 -4.0743 -4.0708 -3.9774 -3.9762 -3.8603 -3.8556 -3.1571 -3.1562 -2.1546 -2.1457 -2.0765 -2.0625 -1.8389 -1.8283 -1.7824 -1.7757 -0.5636 -0.5414 -0.4608 -0.4342 -0.3359 -0.3096 -0.2027 -0.1895 -0.0884 -0.0810 0.0005 0.0206 0.3121 0.3185 0.4070 0.4153 0.4933 0.4989 0.9647 0.9679 1.1700 1.1725 1.2114 1.2144 4.1009 4.1014 5.8635 5.8645 6.0392 6.0400 6.6958 6.6968 6.7971 6.7975 8.3704 8.3727 9.1442 9.1464 k = 0.3966-0.4093 0.3962 ( 8233 PWs) bands (ev): -16.9797 -16.9796 -16.2354 -16.2353 -16.2231 -16.2229 -13.0183 -13.0182 -12.9880 -12.9879 -12.9054 -12.9054 -12.7279 -12.7278 -11.3620 -11.3619 -11.3346 -11.3345 -6.3511 -6.3495 -6.3306 -6.3289 -5.9704 -5.9702 -5.4513 -5.4512 -4.0555 -4.0519 -3.9763 -3.9749 -3.8729 -3.8681 -3.1785 -3.1778 -2.1500 -2.1396 -2.0824 -2.0673 -1.8278 -1.8179 -1.7710 -1.7650 -0.5526 -0.5291 -0.4577 -0.4294 -0.3231 -0.2971 -0.2015 -0.1897 -0.0900 -0.0840 -0.0044 0.0138 0.2965 0.3025 0.4234 0.4320 0.4974 0.5026 0.9527 0.9553 1.1721 1.1745 1.2071 1.2099 4.0686 4.0690 5.8921 5.8933 6.0338 6.0346 6.7056 6.7065 6.7974 6.7977 8.3494 8.3516 9.1578 9.1600 k = 0.4076-0.4207 0.4072 ( 8231 PWs) bands (ev): -16.9788 -16.9788 -16.2351 -16.2350 -16.2239 -16.2238 -13.0145 -13.0144 -12.9888 -12.9887 -12.9102 -12.9102 -12.7330 -12.7330 -11.3545 -11.3544 -11.3330 -11.3329 -6.3472 -6.3454 -6.3305 -6.3286 -5.9848 -5.9847 -5.4488 -5.4487 -4.0381 -4.0344 -3.9751 -3.9735 -3.8844 -3.8794 -3.1982 -3.1976 -2.1465 -2.1343 -2.0890 -2.0724 -1.8167 -1.8073 -1.7608 -1.7552 -0.5418 -0.5169 -0.4550 -0.4248 -0.3100 -0.2844 -0.2009 -0.1910 -0.0917 -0.0872 -0.0102 0.0057 0.2814 0.2869 0.4407 0.4489 0.5017 0.5064 0.9406 0.9427 1.1742 1.1766 1.2035 1.2061 4.0391 4.0395 5.9181 5.9194 6.0287 6.0296 6.7149 6.7157 6.7974 6.7978 8.3295 8.3315 9.1661 9.1683 k = 0.4186-0.4320 0.4182 ( 8227 PWs) bands (ev): -16.9780 -16.9780 -16.2348 -16.2346 -16.2247 -16.2246 -13.0109 -13.0107 -12.9894 -12.9892 -12.9147 -12.9146 -12.7378 -12.7378 -11.3478 -11.3477 -11.3316 -11.3315 -6.3437 -6.3416 -6.3304 -6.3283 -5.9978 -5.9977 -5.4466 -5.4465 -4.0222 -4.0185 -3.9739 -3.9722 -3.8946 -3.8896 -3.2159 -3.2154 -2.1440 -2.1297 -2.0958 -2.0774 -1.8057 -1.7969 -1.7520 -1.7468 -0.5313 -0.5049 -0.4529 -0.4207 -0.2967 -0.2716 -0.2006 -0.1931 -0.0942 -0.0902 -0.0168 -0.0036 0.2677 0.2725 0.4578 0.4653 0.5060 0.5103 0.9287 0.9304 1.1761 1.1785 1.2005 1.2029 4.0128 4.0131 5.9411 5.9426 6.0242 6.0253 6.7235 6.7241 6.7973 6.7976 8.3112 8.3130 9.1701 9.1722 k = 0.4296-0.4434 0.4292 ( 8222 PWs) bands (ev): -16.9774 -16.9774 -16.2344 -16.2343 -16.2254 -16.2253 -13.0076 -13.0074 -12.9897 -12.9896 -12.9187 -12.9187 -12.7421 -12.7421 -11.3419 -11.3418 -11.3304 -11.3303 -6.3407 -6.3382 -6.3303 -6.3278 -6.0091 -6.0091 -5.4447 -5.4446 -4.0082 -4.0045 -3.9727 -3.9708 -3.9035 -3.8985 -3.2313 -3.2309 -2.1426 -2.1259 -2.1021 -2.0818 -1.7954 -1.7869 -1.7447 -1.7397 -0.5215 -0.4936 -0.4514 -0.4172 -0.2835 -0.2593 -0.2006 -0.1957 -0.0977 -0.0923 -0.0238 -0.0136 0.2557 0.2599 0.4738 0.4805 0.5102 0.5141 0.9175 0.9188 1.1778 1.1803 1.1981 1.2003 3.9900 3.9903 5.9608 5.9627 6.0202 6.0217 6.7313 6.7318 6.7969 6.7972 8.2950 8.2965 9.1713 9.1731 k = 0.4407-0.4548 0.4402 ( 8223 PWs) bands (ev): -16.9768 -16.9768 -16.2340 -16.2339 -16.2261 -16.2260 -13.0047 -13.0045 -12.9899 -12.9898 -12.9223 -12.9223 -12.7458 -12.7458 -11.3370 -11.3368 -11.3293 -11.3292 -6.3382 -6.3354 -6.3302 -6.3273 -6.0187 -6.0186 -5.4431 -5.4430 -3.9962 -3.9929 -3.9716 -3.9694 -3.9112 -3.9063 -3.2442 -3.2439 -2.1418 -2.1233 -2.1073 -2.0855 -1.7858 -1.7777 -1.7391 -1.7342 -0.5125 -0.4830 -0.4505 -0.4145 -0.2707 -0.2480 -0.2009 -0.1983 -0.1016 -0.0939 -0.0311 -0.0238 0.2458 0.2493 0.4880 0.4938 0.5142 0.5177 0.9073 0.9084 1.1792 1.1817 1.1961 1.1983 3.9710 3.9712 5.9768 5.9794 6.0167 6.0190 6.7383 6.7387 6.7962 6.7965 8.2813 8.2825 9.1706 9.1722 k = 0.4517-0.4661 0.4512 ( 8216 PWs) bands (ev): -16.9764 -16.9764 -16.2336 -16.2335 -16.2267 -16.2266 -13.0023 -13.0021 -12.9900 -12.9898 -12.9253 -12.9253 -12.7488 -12.7488 -11.3332 -11.3329 -11.3284 -11.3282 -6.3363 -6.3331 -6.3301 -6.3268 -6.0262 -6.0261 -5.4418 -5.4418 -3.9866 -3.9839 -3.9705 -3.9678 -3.9174 -3.9129 -3.2545 -3.2543 -2.1413 -2.1223 -2.1104 -2.0886 -1.7772 -1.7695 -1.7352 -1.7303 -0.5045 -0.4736 -0.4505 -0.4130 -0.2590 -0.2385 -0.2027 -0.1992 -0.1048 -0.0954 -0.0381 -0.0337 0.2380 0.2407 0.4995 0.5043 0.5181 0.5211 0.8987 0.8995 1.1804 1.1828 1.1945 1.1967 3.9560 3.9562 5.9888 5.9926 6.0139 6.0174 6.7445 6.7448 6.7951 6.7954 8.2704 8.2713 9.1693 9.1705 k = 0.4627-0.4775 0.4622 ( 8220 PWs) bands (ev): -16.9761 -16.9761 -16.2333 -16.2331 -16.2273 -16.2271 -13.0004 -13.0003 -12.9901 -12.9899 -12.9276 -12.9276 -12.7510 -12.7510 -11.3305 -11.3302 -11.3277 -11.3274 -6.3350 -6.3316 -6.3298 -6.3264 -6.0316 -6.0316 -5.4409 -5.4409 -3.9798 -3.9778 -3.9691 -3.9661 -3.9220 -3.9183 -3.2620 -3.2618 -2.1408 -2.1232 -2.1110 -2.0910 -1.7698 -1.7624 -1.7331 -1.7281 -0.4977 -0.4654 -0.4513 -0.4127 -0.2492 -0.2312 -0.2055 -0.1989 -0.1059 -0.0969 -0.0447 -0.0422 0.2326 0.2344 0.5078 0.5111 0.5220 0.5244 0.8921 0.8926 1.1812 1.1836 1.1932 1.1953 3.9451 3.9452 5.9966 6.0021 6.0119 6.0172 6.7498 6.7501 6.7934 6.7937 8.2624 8.2630 9.1680 9.1688 k = 0.4737-0.4889 0.4732 ( 8215 PWs) bands (ev): -16.9758 -16.9758 -16.2329 -16.2327 -16.2278 -16.2277 -12.9991 -12.9989 -12.9904 -12.9902 -12.9290 -12.9290 -12.7523 -12.7523 -11.3290 -11.3286 -11.3271 -11.3267 -6.3341 -6.3311 -6.3292 -6.3262 -6.0349 -6.0349 -5.4404 -5.4403 -3.9763 -3.9744 -3.9674 -3.9648 -3.9247 -3.9226 -3.2665 -3.2665 -2.1400 -2.1250 -2.1101 -2.0930 -1.7639 -1.7567 -1.7327 -1.7276 -0.4920 -0.4587 -0.4531 -0.4140 -0.2421 -0.2263 -0.2082 -0.1995 -0.1039 -0.0980 -0.0505 -0.0488 0.2294 0.2304 0.5125 0.5144 0.5253 0.5271 0.8880 0.8882 1.1819 1.1843 1.1919 1.1940 3.9385 3.9386 6.0006 6.0077 6.0108 6.0177 6.7544 6.7546 6.7912 6.7914 8.2575 8.2578 9.1673 9.1678 k = 0.4847-0.5002 0.4842 ( 8204 PWs) bands (ev): -16.9757 -16.9757 -16.2324 -16.2323 -16.2284 -16.2282 -12.9981 -12.9979 -12.9910 -12.9908 -12.9295 -12.9295 -12.7527 -12.7527 -11.3284 -11.3280 -11.3269 -11.3265 -6.3337 -6.3312 -6.3288 -6.3263 -6.0360 -6.0359 -5.4401 -5.4401 -3.9752 -3.9736 -3.9661 -3.9647 -3.9254 -3.9253 -3.2681 -3.2681 -2.1386 -2.1264 -2.1084 -2.0945 -1.7595 -1.7525 -1.7340 -1.7288 -0.4876 -0.4561 -0.4534 -0.4170 -0.2381 -0.2235 -0.2114 -0.2017 -0.0987 -0.0973 -0.0550 -0.0535 0.2283 0.2287 0.5141 0.5152 0.5267 0.5281 0.8866 0.8867 1.1825 1.1848 1.1907 1.1928 3.9362 3.9363 6.0021 6.0085 6.0114 6.0177 6.7582 6.7584 6.7882 6.7885 8.2558 8.2559 9.1676 9.1677 k = 0.4847-0.5002 0.4842 ( 8204 PWs) bands (ev): -16.9757 -16.9757 -16.2324 -16.2323 -16.2284 -16.2282 -12.9981 -12.9979 -12.9910 -12.9908 -12.9295 -12.9295 -12.7527 -12.7527 -11.3284 -11.3280 -11.3269 -11.3265 -6.3337 -6.3312 -6.3288 -6.3263 -6.0360 -6.0359 -5.4401 -5.4401 -3.9752 -3.9736 -3.9661 -3.9647 -3.9254 -3.9253 -3.2681 -3.2681 -2.1386 -2.1264 -2.1084 -2.0945 -1.7595 -1.7525 -1.7340 -1.7288 -0.4876 -0.4561 -0.4534 -0.4170 -0.2381 -0.2235 -0.2114 -0.2017 -0.0987 -0.0973 -0.0550 -0.0535 0.2283 0.2287 0.5141 0.5152 0.5267 0.5281 0.8866 0.8867 1.1825 1.1848 1.1907 1.1928 3.9362 3.9363 6.0021 6.0085 6.0114 6.0177 6.7582 6.7584 6.7882 6.7885 8.2558 8.2559 9.1676 9.1677 k = 0.4924-0.4924 0.4924 ( 8210 PWs) bands (ev): -16.9756 -16.9756 -16.2315 -16.2314 -16.2295 -16.2293 -12.9964 -12.9962 -12.9928 -12.9926 -12.9297 -12.9296 -12.7525 -12.7525 -11.3280 -11.3276 -11.3272 -11.3268 -6.3331 -6.3319 -6.3282 -6.3270 -6.0359 -6.0358 -5.4400 -5.4400 -3.9748 -3.9740 -3.9658 -3.9651 -3.9267 -3.9266 -3.2684 -3.2683 -2.1352 -2.1291 -2.1045 -2.0976 -1.7519 -1.7455 -1.7391 -1.7335 -0.4794 -0.4636 -0.4440 -0.4256 -0.2324 -0.2192 -0.2190 -0.2083 -0.0898 -0.0886 -0.0628 -0.0616 0.2281 0.2283 0.5145 0.5150 0.5271 0.5278 0.8866 0.8866 1.1840 1.1862 1.1881 1.1902 3.9361 3.9361 6.0036 6.0068 6.0129 6.0160 6.7658 6.7660 6.7809 6.7811 8.2555 8.2556 9.1687 9.1687 k = 0.5000-0.4845 0.5005 ( 8198 PWs) bands (ev): -16.9755 -16.9755 -16.2305 -16.2305 -16.2304 -16.2304 -12.9946 -12.9946 -12.9944 -12.9944 -12.9297 -12.9297 -12.7525 -12.7525 -11.3276 -11.3276 -11.3272 -11.3272 -6.3325 -6.3325 -6.3276 -6.3276 -6.0358 -6.0358 -5.4400 -5.4400 -3.9744 -3.9744 -3.9655 -3.9655 -3.9271 -3.9271 -3.2684 -3.2684 -2.1320 -2.1320 -2.1009 -2.1009 -1.7451 -1.7451 -1.7391 -1.7391 -0.4714 -0.4714 -0.4347 -0.4347 -0.2260 -0.2260 -0.2141 -0.2141 -0.0847 -0.0847 -0.0664 -0.0664 0.2281 0.2281 0.5147 0.5147 0.5275 0.5275 0.8866 0.8866 1.1858 1.1858 1.1880 1.1880 3.9361 3.9361 6.0052 6.0052 6.0145 6.0145 6.7734 6.7734 6.7736 6.7736 8.2554 8.2554 9.1690 9.1690 k = 0.5000-0.4845 0.5005 ( 8198 PWs) bands (ev): -16.9755 -16.9755 -16.2305 -16.2305 -16.2304 -16.2304 -12.9946 -12.9946 -12.9944 -12.9944 -12.9297 -12.9297 -12.7525 -12.7525 -11.3276 -11.3276 -11.3272 -11.3272 -6.3325 -6.3325 -6.3276 -6.3276 -6.0358 -6.0358 -5.4400 -5.4400 -3.9744 -3.9744 -3.9655 -3.9655 -3.9271 -3.9271 -3.2684 -3.2684 -2.1320 -2.1320 -2.1009 -2.1009 -1.7451 -1.7451 -1.7391 -1.7391 -0.4714 -0.4714 -0.4347 -0.4347 -0.2260 -0.2260 -0.2141 -0.2141 -0.0847 -0.0847 -0.0664 -0.0664 0.2281 0.2281 0.5147 0.5147 0.5275 0.5275 0.8866 0.8866 1.1858 1.1858 1.1880 1.1880 3.9361 3.9361 6.0052 6.0052 6.0145 6.0145 6.7734 6.7734 6.7736 6.7736 8.2554 8.2554 9.1690 9.1690 k = 0.4994-0.4651 0.5005 ( 8209 PWs) bands (ev): -16.9756 -16.9756 -16.2313 -16.2311 -16.2297 -16.2295 -12.9962 -12.9960 -12.9933 -12.9932 -12.9293 -12.9293 -12.7521 -12.7521 -11.3282 -11.3279 -11.3274 -11.3271 -6.3331 -6.3321 -6.3282 -6.3272 -6.0350 -6.0350 -5.4401 -5.4401 -3.9754 -3.9748 -3.9670 -3.9651 -3.9272 -3.9252 -3.2672 -3.2672 -2.1343 -2.1294 -2.1035 -2.0980 -1.7511 -1.7449 -1.7407 -1.7351 -0.4784 -0.4655 -0.4426 -0.4281 -0.2331 -0.2203 -0.2188 -0.2104 -0.0901 -0.0832 -0.0642 -0.0618 0.2286 0.2294 0.5132 0.5144 0.5263 0.5268 0.8876 0.8879 1.1842 1.1864 1.1876 1.1897 3.9378 3.9378 6.0033 6.0058 6.0127 6.0152 6.7671 6.7673 6.7790 6.7793 8.2566 8.2569 9.1691 9.1695 k = 0.4988-0.4457 0.5005 ( 8221 PWs) bands (ev): -16.9758 -16.9758 -16.2321 -16.2319 -16.2288 -16.2287 -12.9981 -12.9980 -12.9922 -12.9921 -12.9282 -12.9282 -12.7511 -12.7511 -11.3297 -11.3294 -11.3276 -11.3273 -6.3341 -6.3322 -6.3290 -6.3271 -6.0324 -6.0324 -5.4406 -5.4406 -3.9782 -3.9771 -3.9688 -3.9660 -3.9252 -3.9217 -3.2637 -3.2636 -2.1365 -2.1269 -2.1057 -2.0947 -1.7590 -1.7526 -1.7375 -1.7325 -0.4864 -0.4611 -0.4515 -0.4229 -0.2408 -0.2245 -0.2158 -0.2076 -0.0950 -0.0856 -0.0560 -0.0539 0.2310 0.2326 0.5095 0.5120 0.5238 0.5245 0.8908 0.8913 1.1827 1.1849 1.1896 1.1916 3.9429 3.9430 5.9996 6.0036 6.0114 6.0153 6.7602 6.7604 6.7842 6.7844 8.2604 8.2609 9.1698 9.1705 k = 0.4982-0.4264 0.5005 ( 8226 PWs) bands (ev): -16.9761 -16.9761 -16.2328 -16.2326 -16.2279 -16.2277 -13.0005 -13.0003 -12.9913 -12.9911 -12.9264 -12.9264 -12.7495 -12.7495 -11.3321 -11.3319 -11.3279 -11.3277 -6.3354 -6.3330 -6.3295 -6.3271 -6.0282 -6.0282 -5.4413 -5.4413 -3.9834 -3.9816 -3.9702 -3.9675 -3.9212 -3.9168 -3.2578 -3.2577 -2.1391 -2.1257 -2.1060 -2.0906 -1.7693 -1.7627 -1.7352 -1.7307 -0.4953 -0.4621 -0.4573 -0.4194 -0.2489 -0.2306 -0.2132 -0.2059 -0.0980 -0.0883 -0.0472 -0.0432 0.2351 0.2376 0.5030 0.5071 0.5207 0.5215 0.8960 0.8967 1.1811 1.1833 1.1919 1.1939 3.9514 3.9515 5.9934 5.9972 6.0121 6.0157 6.7527 6.7529 6.7888 6.7891 8.2667 8.2675 9.1709 9.1720 k = 0.4976-0.4070 0.5005 ( 8227 PWs) bands (ev): -16.9765 -16.9765 -16.2335 -16.2333 -16.2269 -16.2268 -13.0032 -13.0031 -12.9903 -12.9902 -12.9240 -12.9239 -12.7472 -12.7472 -11.3354 -11.3353 -11.3283 -11.3282 -6.3372 -6.3348 -6.3296 -6.3272 -6.0224 -6.0223 -5.4424 -5.4423 -3.9909 -3.9884 -3.9715 -3.9692 -3.9153 -3.9104 -3.2497 -3.2495 -2.1424 -2.1276 -2.1030 -2.0854 -1.7819 -1.7751 -1.7335 -1.7296 -0.5049 -0.4724 -0.4560 -0.4178 -0.2567 -0.2371 -0.2123 -0.2048 -0.0992 -0.0898 -0.0384 -0.0313 0.2409 0.2441 0.4939 0.4993 0.5173 0.5185 0.9028 0.9039 1.1794 1.1816 1.1948 1.1967 3.9631 3.9633 5.9844 5.9875 6.0138 6.0167 6.7445 6.7448 6.7929 6.7933 8.2756 8.2766 9.1722 9.1737 k = 0.4969-0.3876 0.5005 ( 8229 PWs) bands (ev): -16.9770 -16.9770 -16.2341 -16.2340 -16.2260 -16.2258 -13.0063 -13.0062 -12.9893 -12.9892 -12.9210 -12.9210 -12.7444 -12.7444 -11.3397 -11.3396 -11.3289 -11.3287 -6.3395 -6.3372 -6.3295 -6.3273 -6.0150 -6.0149 -5.4437 -5.4436 -4.0005 -3.9975 -3.9726 -3.9707 -3.9077 -3.9027 -3.2394 -3.2391 -2.1470 -2.1326 -2.0966 -2.0788 -1.7970 -1.7898 -1.7322 -1.7288 -0.5151 -0.4837 -0.4560 -0.4180 -0.2639 -0.2436 -0.2130 -0.2040 -0.0991 -0.0899 -0.0296 -0.0193 0.2480 0.2520 0.4826 0.4893 0.5138 0.5154 0.9110 0.9124 1.1775 1.1798 1.1980 1.1999 3.9781 3.9783 5.9725 5.9751 6.0161 6.0183 6.7358 6.7362 6.7966 6.7970 8.2869 8.2882 9.1737 9.1755 k = 0.4963-0.3682 0.5005 ( 8229 PWs) bands (ev): -16.9776 -16.9776 -16.2348 -16.2346 -16.2249 -16.2248 -13.0097 -13.0096 -12.9882 -12.9881 -12.9176 -12.9176 -12.7411 -12.7411 -11.3447 -11.3446 -11.3295 -11.3294 -6.3422 -6.3402 -6.3293 -6.3273 -6.0061 -6.0060 -5.4452 -5.4452 -4.0118 -4.0087 -3.9739 -3.9722 -3.8986 -3.8937 -3.2270 -3.2267 -2.1530 -2.1398 -2.0881 -2.0707 -1.8144 -1.8066 -1.7312 -1.7282 -0.5258 -0.4955 -0.4574 -0.4202 -0.2701 -0.2500 -0.2146 -0.2036 -0.0983 -0.0886 -0.0211 -0.0077 0.2562 0.2609 0.4698 0.4776 0.5101 0.5122 0.9202 0.9219 1.1755 1.1779 1.2018 1.2036 3.9961 3.9963 5.9579 5.9601 6.0188 6.0205 6.7265 6.7269 6.8000 6.8004 8.3005 8.3020 9.1750 9.1770 k = 0.4957-0.3488 0.5005 ( 8244 PWs) bands (ev): -16.9783 -16.9783 -16.2354 -16.2353 -16.2239 -16.2237 -13.0133 -13.0132 -12.9871 -12.9870 -12.9139 -12.9139 -12.7373 -12.7373 -11.3505 -11.3504 -11.3303 -11.3302 -6.3454 -6.3437 -6.3291 -6.3273 -5.9958 -5.9957 -5.4471 -5.4470 -4.0247 -4.0216 -3.9751 -3.9736 -3.8880 -3.8833 -3.2128 -3.2124 -2.1607 -2.1487 -2.0781 -2.0612 -1.8337 -1.8252 -1.7305 -1.7277 -0.5368 -0.5076 -0.4603 -0.4242 -0.2751 -0.2561 -0.2167 -0.2034 -0.0973 -0.0861 -0.0131 0.0031 0.2651 0.2703 0.4563 0.4650 0.5062 0.5088 0.9301 0.9321 1.1735 1.1760 1.2059 1.2077 4.0169 4.0172 5.9407 5.9427 6.0219 6.0233 6.7168 6.7172 6.8030 6.8035 8.3163 8.3181 9.1757 9.1781 k = 0.4951-0.3295 0.5005 ( 8252 PWs) bands (ev): -16.9791 -16.9790 -16.2360 -16.2358 -16.2228 -16.2227 -13.0171 -13.0170 -12.9858 -12.9857 -12.9099 -12.9098 -12.7332 -12.7332 -11.3570 -11.3569 -11.3312 -11.3311 -6.3490 -6.3474 -6.3289 -6.3273 -5.9842 -5.9841 -5.4491 -5.4490 -4.0391 -4.0361 -3.9764 -3.9751 -3.8761 -3.8715 -3.1968 -3.1964 -2.1701 -2.1594 -2.0671 -2.0504 -1.8546 -1.8451 -1.7301 -1.7273 -0.5481 -0.5200 -0.4645 -0.4297 -0.2791 -0.2617 -0.2188 -0.2034 -0.0960 -0.0831 -0.0056 0.0131 0.2739 0.2794 0.4426 0.4522 0.5022 0.5053 0.9404 0.9427 1.1716 1.1742 1.2105 1.2122 4.0404 4.0407 5.9212 5.9229 6.0253 6.0265 6.7066 6.7071 6.8057 6.8064 8.3342 8.3361 9.1756 9.1782 k = 0.4945-0.3101 0.5005 ( 8244 PWs) bands (ev): -16.9799 -16.9799 -16.2365 -16.2364 -16.2217 -16.2216 -13.0210 -13.0209 -12.9845 -12.9844 -12.9056 -12.9056 -12.7288 -12.7288 -11.3640 -11.3640 -11.3321 -11.3321 -6.3529 -6.3515 -6.3287 -6.3273 -5.9715 -5.9714 -5.4514 -5.4512 -4.0547 -4.0519 -3.9777 -3.9765 -3.8630 -3.8586 -3.1793 -3.1788 -2.1813 -2.1716 -2.0554 -2.0388 -1.8766 -1.8658 -1.7298 -1.7269 -0.5595 -0.5326 -0.4697 -0.4364 -0.2820 -0.2668 -0.2207 -0.2034 -0.0947 -0.0800 0.0013 0.0222 0.2820 0.2876 0.4298 0.4401 0.4981 0.5017 0.9508 0.9535 1.1697 1.1725 1.2153 1.2171 4.0664 4.0667 5.8995 5.9011 6.0292 6.0300 6.6960 6.6967 6.8083 6.8089 8.3540 8.3561 9.1743 9.1772 k = 0.4939-0.2907 0.5005 ( 8242 PWs) bands (ev): -16.9808 -16.9808 -16.2371 -16.2370 -16.2206 -16.2205 -13.0250 -13.0249 -12.9830 -12.9829 -12.9012 -12.9012 -12.7241 -12.7241 -11.3715 -11.3715 -11.3331 -11.3331 -6.3570 -6.3558 -6.3285 -6.3272 -5.9578 -5.9577 -5.4538 -5.4537 -4.0714 -4.0687 -3.9791 -3.9780 -3.8488 -3.8446 -3.1604 -3.1598 -2.1943 -2.1855 -2.0438 -2.0268 -1.8989 -1.8864 -1.7297 -1.7267 -0.5709 -0.5452 -0.4756 -0.4441 -0.2842 -0.2712 -0.2224 -0.2032 -0.0933 -0.0771 0.0075 0.0303 0.2884 0.2937 0.4189 0.4295 0.4941 0.4982 0.9612 0.9642 1.1681 1.1710 1.2205 1.2223 4.0945 4.0948 5.8757 5.8772 6.0333 6.0340 6.6853 6.6860 6.8106 6.8113 8.3755 8.3777 9.1716 9.1746 k = 0.4933-0.2713 0.5005 ( 8247 PWs) bands (ev): -16.9817 -16.9817 -16.2376 -16.2375 -16.2194 -16.2193 -13.0289 -13.0288 -12.9815 -12.9814 -12.8968 -12.8968 -12.7193 -12.7193 -11.3794 -11.3794 -11.3342 -11.3341 -6.3613 -6.3602 -6.3283 -6.3272 -5.9433 -5.9431 -5.4563 -5.4562 -4.0889 -4.0864 -3.9804 -3.9794 -3.8336 -3.8296 -3.1403 -3.1397 -2.2090 -2.2009 -2.0332 -2.0155 -1.9203 -1.9058 -1.7298 -1.7266 -0.5822 -0.5578 -0.4821 -0.4522 -0.2860 -0.2751 -0.2237 -0.2029 -0.0921 -0.0748 0.0133 0.0375 0.2919 0.2967 0.4108 0.4214 0.4902 0.4947 0.9713 0.9747 1.1669 1.1699 1.2259 1.2277 4.1244 4.1248 5.8502 5.8516 6.0376 6.0382 6.6744 6.6751 6.8128 6.8136 8.3985 8.4008 9.1672 9.1704 k = 0.4927-0.2519 0.5005 ( 8250 PWs) bands (ev): -16.9827 -16.9827 -16.2381 -16.2380 -16.2183 -16.2182 -13.0327 -13.0327 -12.9799 -12.9798 -12.8923 -12.8923 -12.7145 -12.7145 -11.3875 -11.3875 -11.3353 -11.3352 -6.3656 -6.3647 -6.3281 -6.3271 -5.9282 -5.9280 -5.4590 -5.4589 -4.1070 -4.1047 -3.9816 -3.9808 -3.8176 -3.8138 -3.1192 -3.1186 -2.2254 -2.2179 -2.0257 -2.0075 -1.9380 -1.9217 -1.7300 -1.7266 -0.5933 -0.5702 -0.4887 -0.4607 -0.2876 -0.2782 -0.2246 -0.2025 -0.0912 -0.0732 0.0186 0.0438 0.2916 0.2960 0.4064 0.4167 0.4866 0.4915 0.9811 0.9847 1.1660 1.1692 1.2314 1.2332 4.1559 4.1563 5.8232 5.8245 6.0422 6.0426 6.6634 6.6642 6.8148 6.8157 8.4228 8.4251 9.1610 9.1644 k = 0.4921-0.2326 0.5005 ( 8246 PWs) bands (ev): -16.9837 -16.9836 -16.2385 -16.2385 -16.2172 -16.2171 -13.0365 -13.0364 -12.9782 -12.9782 -12.8878 -12.8878 -12.7096 -12.7096 -11.3957 -11.3957 -11.3364 -11.3363 -6.3700 -6.3692 -6.3279 -6.3270 -5.9126 -5.9125 -5.4618 -5.4616 -4.1254 -4.1233 -3.9828 -3.9821 -3.8009 -3.7973 -3.0975 -3.0967 -2.2433 -2.2362 -2.0244 -2.0085 -1.9463 -1.9310 -1.7305 -1.7267 -0.6042 -0.5825 -0.4954 -0.4691 -0.2892 -0.2806 -0.2250 -0.2019 -0.0905 -0.0723 0.0235 0.0494 0.2869 0.2919 0.4056 0.4154 0.4832 0.4886 0.9903 0.9942 1.1657 1.1690 1.2370 1.2388 4.1886 4.1890 5.7949 5.7961 6.0469 6.0472 6.6526 6.6534 6.8168 6.8177 8.4481 8.4504 9.1532 9.1567 k = 0.4914-0.2132 0.5005 ( 8238 PWs) bands (ev): -16.9846 -16.9846 -16.2390 -16.2389 -16.2161 -16.2160 -13.0401 -13.0400 -12.9766 -12.9765 -12.8835 -12.8835 -12.7048 -12.7048 -11.4039 -11.4039 -11.3374 -11.3374 -6.3743 -6.3736 -6.3277 -6.3270 -5.8970 -5.8968 -5.4645 -5.4643 -4.1439 -4.1419 -3.9840 -3.9833 -3.7837 -3.7803 -3.0752 -3.0745 -2.2626 -2.2557 -2.0317 -2.0211 -1.9424 -1.9311 -1.7311 -1.7271 -0.6146 -0.5944 -0.5018 -0.4774 -0.2910 -0.2824 -0.2250 -0.2012 -0.0901 -0.0723 0.0281 0.0543 0.2787 0.2852 0.4072 0.4169 0.4803 0.4860 0.9990 1.0031 1.1658 1.1693 1.2426 1.2443 4.2221 4.2225 5.7658 5.7669 6.0516 6.0519 6.6419 6.6428 6.8187 6.8196 8.4741 8.4764 9.1439 9.1474 k = 0.4908-0.1938 0.5005 ( 8243 PWs) bands (ev): -16.9856 -16.9856 -16.2394 -16.2393 -16.2150 -16.2150 -13.0435 -13.0434 -12.9749 -12.9749 -12.8793 -12.8793 -12.7001 -12.7001 -11.4120 -11.4120 -11.3385 -11.3385 -6.3785 -6.3779 -6.3276 -6.3269 -5.8814 -5.8812 -5.4672 -5.4671 -4.1621 -4.1604 -3.9850 -3.9845 -3.7663 -3.7631 -3.0528 -3.0520 -2.2828 -2.2762 -2.0459 -2.0398 -1.9318 -1.9238 -1.7320 -1.7277 -0.6246 -0.6059 -0.5078 -0.4853 -0.2927 -0.2836 -0.2247 -0.2006 -0.0901 -0.0730 0.0326 0.0587 0.2686 0.2765 0.4104 0.4200 0.4778 0.4838 1.0070 1.0112 1.1666 1.1700 1.2481 1.2498 4.2560 4.2563 5.7361 5.7371 6.0563 6.0565 6.6316 6.6325 6.8205 6.8214 8.5005 8.5028 9.1333 9.1369 k = 0.4902-0.1744 0.5005 ( 8247 PWs) bands (ev): -16.9865 -16.9865 -16.2398 -16.2397 -16.2140 -16.2139 -13.0467 -13.0466 -12.9733 -12.9733 -12.8753 -12.8753 -12.6957 -12.6957 -11.4198 -11.4198 -11.3395 -11.3395 -6.3825 -6.3820 -6.3274 -6.3269 -5.8661 -5.8659 -5.4699 -5.4697 -4.1799 -4.1783 -3.9860 -3.9855 -3.7489 -3.7459 -3.0306 -3.0297 -2.3036 -2.2972 -2.0638 -2.0599 -1.9188 -1.9124 -1.7332 -1.7286 -0.6340 -0.6169 -0.5134 -0.4928 -0.2942 -0.2846 -0.2240 -0.2002 -0.0903 -0.0743 0.0369 0.0625 0.2578 0.2668 0.4140 0.4236 0.4758 0.4820 1.0143 1.0186 1.1678 1.1712 1.2535 1.2551 4.2897 4.2900 5.7063 5.7073 6.0609 6.0611 6.6217 6.6226 6.8223 6.8231 8.5270 8.5293 9.1218 9.1253 k = 0.4896-0.1550 0.5005 ( 8250 PWs) bands (ev): -16.9874 -16.9874 -16.2402 -16.2401 -16.2130 -16.2130 -13.0496 -13.0495 -12.9717 -12.9717 -12.8716 -12.8716 -12.6915 -12.6915 -11.4273 -11.4272 -11.3405 -11.3405 -6.3863 -6.3858 -6.3273 -6.3268 -5.8515 -5.8513 -5.4724 -5.4722 -4.1969 -4.1954 -3.9869 -3.9865 -3.7317 -3.7289 -3.0088 -3.0080 -2.3246 -2.3184 -2.0831 -2.0798 -1.9051 -1.8993 -1.7346 -1.7297 -0.6427 -0.6273 -0.5183 -0.4997 -0.2955 -0.2853 -0.2232 -0.2000 -0.0907 -0.0762 0.0411 0.0660 0.2470 0.2569 0.4176 0.4270 0.4743 0.4806 1.0209 1.0251 1.1696 1.1729 1.2587 1.2602 4.3227 4.3231 5.6770 5.6779 6.0654 6.0656 6.6124 6.6132 6.8239 6.8248 8.5532 8.5555 9.1097 9.1130 k = 0.4890-0.1357 0.5005 ( 8254 PWs) bands (ev): -16.9883 -16.9883 -16.2405 -16.2405 -16.2121 -16.2121 -13.0522 -13.0522 -12.9702 -12.9702 -12.8682 -12.8682 -12.6876 -12.6876 -11.4342 -11.4342 -11.3414 -11.3414 -6.3897 -6.3893 -6.3272 -6.3268 -5.8377 -5.8375 -5.4748 -5.4746 -4.2128 -4.2115 -3.9877 -3.9873 -3.7151 -3.7125 -2.9880 -2.9872 -2.3452 -2.3393 -2.1023 -2.0988 -1.8914 -1.8859 -1.7362 -1.7312 -0.6507 -0.6370 -0.5225 -0.5060 -0.2964 -0.2859 -0.2222 -0.2002 -0.0912 -0.0785 0.0453 0.0690 0.2367 0.2472 0.4207 0.4298 0.4734 0.4796 1.0268 1.0308 1.1717 1.1748 1.2635 1.2649 4.3544 4.3548 5.6486 5.6494 6.0696 6.0698 6.6037 6.6045 6.8256 6.8264 8.5788 8.5809 9.0972 9.1004 k = 0.4884-0.1163 0.5005 ( 8243 PWs) bands (ev): -16.9890 -16.9890 -16.2408 -16.2408 -16.2113 -16.2112 -13.0546 -13.0545 -12.9689 -12.9689 -12.8651 -12.8651 -12.6841 -12.6841 -11.4404 -11.4404 -11.3422 -11.3422 -6.3928 -6.3925 -6.3271 -6.3268 -5.8252 -5.8250 -5.4769 -5.4768 -4.2272 -4.2261 -3.9884 -3.9880 -3.6993 -3.6970 -2.9685 -2.9677 -2.3649 -2.3594 -2.1204 -2.1168 -1.8782 -1.8728 -1.7381 -1.7330 -0.6578 -0.6459 -0.5260 -0.5117 -0.2969 -0.2864 -0.2211 -0.2008 -0.0918 -0.0809 0.0494 0.0717 0.2274 0.2380 0.4232 0.4318 0.4729 0.4789 1.0319 1.0357 1.1742 1.1769 1.2680 1.2694 4.3842 4.3846 5.6219 5.6226 6.0734 6.0737 6.5958 6.5965 6.8271 6.8279 8.6032 8.6051 9.0847 9.0875 k = 0.4878-0.0969 0.5005 ( 8248 PWs) bands (ev): -16.9897 -16.9897 -16.2411 -16.2411 -16.2105 -16.2104 -13.0566 -13.0566 -12.9677 -12.9676 -12.8625 -12.8625 -12.6811 -12.6811 -11.4460 -11.4459 -11.3430 -11.3430 -6.3955 -6.3953 -6.3270 -6.3267 -5.8140 -5.8138 -5.4789 -5.4787 -4.2401 -4.2391 -3.9890 -3.9887 -3.6847 -3.6826 -2.9508 -2.9500 -2.3833 -2.3782 -2.1368 -2.1332 -1.8658 -1.8607 -1.7402 -1.7352 -0.6640 -0.6540 -0.5288 -0.5167 -0.2970 -0.2868 -0.2200 -0.2018 -0.0923 -0.0832 0.0535 0.0741 0.2193 0.2297 0.4251 0.4331 0.4728 0.4784 1.0364 1.0397 1.1768 1.1792 1.2721 1.2733 4.4114 4.4117 5.5975 5.5981 6.0769 6.0771 6.5887 6.5893 6.8286 6.8293 8.6259 8.6276 9.0725 9.0750 k = 0.4872-0.0775 0.5005 ( 8243 PWs) bands (ev): -16.9904 -16.9903 -16.2413 -16.2413 -16.2098 -16.2097 -13.0583 -13.0582 -12.9666 -12.9666 -12.8602 -12.8602 -12.6786 -12.6786 -11.4506 -11.4506 -11.3436 -11.3436 -6.3978 -6.3976 -6.3269 -6.3267 -5.8045 -5.8044 -5.4805 -5.4804 -4.2510 -4.2501 -3.9894 -3.9892 -3.6715 -3.6697 -2.9353 -2.9346 -2.3997 -2.3952 -2.1511 -2.1478 -1.8547 -1.8499 -1.7423 -1.7376 -0.6692 -0.6611 -0.5308 -0.5210 -0.2968 -0.2872 -0.2189 -0.2033 -0.0926 -0.0854 0.0575 0.0760 0.2125 0.2224 0.4264 0.4338 0.4728 0.4780 1.0400 1.0430 1.1794 1.1813 1.2757 1.2769 4.4351 4.4353 5.5762 5.5767 6.0798 6.0800 6.5826 6.5831 6.8300 6.8306 8.6462 8.6477 9.0610 9.0631 k = 0.4866-0.0581 0.5005 ( 8235 PWs) bands (ev): -16.9909 -16.9909 -16.2415 -16.2415 -16.2092 -16.2091 -13.0596 -13.0596 -12.9657 -12.9657 -12.8584 -12.8584 -12.6766 -12.6766 -11.4544 -11.4544 -11.3441 -11.3441 -6.3996 -6.3994 -6.3267 -6.3266 -5.7969 -5.7968 -5.4818 -5.4817 -4.2597 -4.2590 -3.9898 -3.9896 -3.6602 -3.6586 -2.9225 -2.9219 -2.4137 -2.4099 -2.1629 -2.1600 -1.8450 -1.8408 -1.7444 -1.7402 -0.6733 -0.6671 -0.5320 -0.5246 -0.2962 -0.2875 -0.2177 -0.2050 -0.0927 -0.0872 0.0613 0.0774 0.2072 0.2162 0.4272 0.4339 0.4730 0.4777 1.0430 1.0454 1.1820 1.1834 1.2788 1.2799 4.4546 4.4548 5.5586 5.5590 6.0822 6.0824 6.5775 6.5780 6.8312 6.8318 8.6635 8.6647 9.0508 9.0524 k = 0.4860-0.0388 0.5005 ( 8229 PWs) bands (ev): -16.9913 -16.9913 -16.2417 -16.2417 -16.2086 -16.2086 -13.0606 -13.0605 -12.9650 -12.9650 -12.8571 -12.8571 -12.6752 -12.6752 -11.4572 -11.4572 -11.3444 -11.3444 -6.4009 -6.4008 -6.3266 -6.3266 -5.7913 -5.7912 -5.4828 -5.4827 -4.2661 -4.2655 -3.9901 -3.9899 -3.6509 -3.6497 -2.9129 -2.9125 -2.4249 -2.4220 -2.1718 -2.1694 -1.8372 -1.8340 -1.7461 -1.7428 -0.6764 -0.6721 -0.5325 -0.5274 -0.2953 -0.2878 -0.2164 -0.2069 -0.0927 -0.0884 0.0650 0.0784 0.2035 0.2111 0.4277 0.4337 0.4732 0.4774 1.0452 1.0470 1.1842 1.1852 1.2813 1.2823 4.4692 4.4694 5.5456 5.5458 6.0840 6.0842 6.5736 6.5739 6.8324 6.8328 8.6769 8.6778 9.0424 9.0435 k = 0.4853-0.0194 0.5005 ( 8230 PWs) bands (ev): -16.9916 -16.9916 -16.2418 -16.2418 -16.2082 -16.2082 -13.0612 -13.0612 -12.9645 -12.9645 -12.8563 -12.8563 -12.6744 -12.6744 -11.4589 -11.4589 -11.3447 -11.3447 -6.4017 -6.4016 -6.3266 -6.3265 -5.7880 -5.7879 -5.4834 -5.4834 -4.2700 -4.2695 -3.9903 -3.9902 -3.6440 -3.6431 -2.9068 -2.9065 -2.4330 -2.4309 -2.1776 -2.1759 -1.8317 -1.8297 -1.7471 -1.7451 -0.6783 -0.6758 -0.5323 -0.5296 -0.2943 -0.2880 -0.2150 -0.2090 -0.0924 -0.0890 0.0684 0.0788 0.2013 0.2074 0.4280 0.4332 0.4733 0.4771 1.0466 1.0479 1.1861 1.1868 1.2831 1.2842 4.4783 4.4784 5.5376 5.5377 6.0851 6.0853 6.5707 6.5709 6.8334 6.8338 8.6857 8.6863 9.0365 9.0370 k = 0.4847 0.0000 0.5005 ( 8226 PWs) bands (ev): -16.9918 -16.9918 -16.2419 -16.2419 -16.2079 -16.2079 -13.0614 -13.0614 -12.9642 -12.9642 -12.8559 -12.8559 -12.6742 -12.6742 -11.4596 -11.4596 -11.3448 -11.3448 -6.4020 -6.4019 -6.3265 -6.3264 -5.7869 -5.7869 -5.4837 -5.4837 -4.2713 -4.2710 -3.9903 -3.9903 -3.6397 -3.6392 -2.9045 -2.9043 -2.4377 -2.4365 -2.1800 -2.1790 -1.8288 -1.8284 -1.7473 -1.7468 -0.6795 -0.6780 -0.5316 -0.5309 -0.2932 -0.2881 -0.2136 -0.2110 -0.0921 -0.0886 0.0714 0.0786 0.2008 0.2050 0.4280 0.4325 0.4734 0.4768 1.0473 1.0480 1.1873 1.1882 1.2843 1.2855 4.4815 4.4817 5.5350 5.5351 6.0855 6.0857 6.5690 6.5691 6.8343 6.8345 8.6894 8.6897 9.0334 9.0337 k = 0.4841 0.0194 0.5005 ( 8232 PWs) bands (ev): -16.9919 -16.9919 -16.2420 -16.2419 -16.2077 -16.2077 -13.0613 -13.0613 -12.9641 -12.9641 -12.8561 -12.8561 -12.6747 -12.6747 -11.4592 -11.4592 -11.3447 -11.3447 -6.4018 -6.4017 -6.3265 -6.3263 -5.7882 -5.7881 -5.4836 -5.4836 -4.2700 -4.2698 -3.9903 -3.9902 -3.6381 -3.6379 -2.9061 -2.9058 -2.4389 -2.4386 -2.1792 -2.1788 -1.8301 -1.8289 -1.7478 -1.7465 -0.6805 -0.6779 -0.5320 -0.5297 -0.2922 -0.2880 -0.2137 -0.2114 -0.0917 -0.0875 0.0739 0.0778 0.2017 0.2042 0.4280 0.4317 0.4734 0.4764 1.0471 1.0474 1.1880 1.1894 1.2849 1.2862 4.4787 4.4789 5.5380 5.5381 6.0852 6.0854 6.5685 6.5686 6.8351 6.8352 8.6874 8.6878 9.0330 9.0338 k = 0.4835 0.0388 0.5005 ( 8229 PWs) bands (ev): -16.9919 -16.9919 -16.2420 -16.2419 -16.2076 -16.2076 -13.0608 -13.0607 -12.9642 -12.9642 -12.8567 -12.8567 -12.6757 -12.6757 -11.4577 -11.4577 -11.3446 -11.3446 -6.4011 -6.4009 -6.3265 -6.3262 -5.7917 -5.7917 -5.4832 -5.4831 -4.2661 -4.2660 -3.9902 -3.9901 -3.6393 -3.6392 -2.9115 -2.9112 -2.4372 -2.4363 -2.1755 -2.1749 -1.8347 -1.8320 -1.7477 -1.7450 -0.6806 -0.6762 -0.5321 -0.5275 -0.2915 -0.2875 -0.2155 -0.2098 -0.0911 -0.0857 0.0755 0.0767 0.2038 0.2052 0.4278 0.4307 0.4735 0.4761 1.0457 1.0465 1.1881 1.1901 1.2848 1.2862 4.4701 4.4702 5.5463 5.5465 6.0842 6.0844 6.5691 6.5694 6.8356 6.8357 8.6800 8.6808 9.0356 9.0369 k = 0.4829 0.0581 0.5005 ( 8229 PWs) bands (ev): -16.9918 -16.9918 -16.2419 -16.2419 -16.2077 -16.2076 -13.0599 -13.0599 -12.9645 -12.9645 -12.8579 -12.8578 -12.6774 -12.6774 -11.4552 -11.4552 -11.3443 -11.3442 -6.3999 -6.3996 -6.3264 -6.3261 -5.7975 -5.7974 -5.4824 -5.4823 -4.2598 -4.2596 -3.9900 -3.9899 -3.6435 -3.6430 -2.9205 -2.9200 -2.4321 -2.4304 -2.1688 -2.1677 -1.8417 -1.8379 -1.7468 -1.7429 -0.6795 -0.6733 -0.5314 -0.5245 -0.2911 -0.2865 -0.2172 -0.2080 -0.0902 -0.0834 0.0744 0.0772 0.2064 0.2088 0.4274 0.4297 0.4735 0.4758 1.0435 1.0448 1.1879 1.1904 1.2841 1.2856 4.4558 4.4560 5.5597 5.5601 6.0826 6.0827 6.5709 6.5713 6.8360 6.8362 8.6680 8.6690 9.0407 9.0425 k = 0.4823 0.0775 0.5005 ( 8230 PWs) bands (ev): -16.9916 -16.9915 -16.2419 -16.2418 -16.2078 -16.2077 -13.0587 -13.0587 -12.9651 -12.9651 -12.8595 -12.8595 -12.6796 -12.6796 -11.4516 -11.4516 -11.3438 -11.3438 -6.3982 -6.3978 -6.3264 -6.3260 -5.8053 -5.8051 -5.4813 -5.4811 -4.2512 -4.2509 -3.9897 -3.9895 -3.6502 -3.6494 -2.9326 -2.9321 -2.4236 -2.4211 -2.1594 -2.1578 -1.8508 -1.8462 -1.7453 -1.7407 -0.6773 -0.6693 -0.5300 -0.5208 -0.2910 -0.2853 -0.2188 -0.2062 -0.0890 -0.0807 0.0721 0.0777 0.2102 0.2140 0.4269 0.4284 0.4737 0.4757 1.0405 1.0424 1.1872 1.1902 1.2828 1.2844 4.4367 4.4369 5.5776 5.5781 6.0803 6.0804 6.5739 6.5743 6.8362 6.8365 8.6519 8.6532 9.0477 9.0500 k = 0.4817 0.0969 0.5005 ( 8231 PWs) bands (ev): -16.9912 -16.9912 -16.2418 -16.2417 -16.2080 -16.2080 -13.0571 -13.0571 -12.9658 -12.9658 -12.8615 -12.8615 -12.6824 -12.6824 -11.4472 -11.4472 -11.3432 -11.3432 -6.3960 -6.3956 -6.3264 -6.3259 -5.8149 -5.8148 -5.4798 -5.4797 -4.2404 -4.2400 -3.9893 -3.9890 -3.6593 -3.6582 -2.9476 -2.9470 -2.4120 -2.4088 -2.1475 -2.1455 -1.8616 -1.8564 -1.7436 -1.7385 -0.6740 -0.6642 -0.5279 -0.5165 -0.2907 -0.2840 -0.2201 -0.2044 -0.0877 -0.0778 0.0693 0.0775 0.2155 0.2205 0.4260 0.4272 0.4739 0.4757 1.0368 1.0391 1.1863 1.1897 1.2808 1.2825 4.4134 4.4136 5.5993 5.5999 6.0774 6.0775 6.5779 6.5785 6.8363 6.8367 8.6325 8.6341 9.0561 9.0588 k = 0.4811 0.1163 0.5005 ( 8230 PWs) bands (ev): -16.9908 -16.9907 -16.2416 -16.2416 -16.2084 -16.2083 -13.0552 -13.0552 -12.9667 -12.9666 -12.8641 -12.8640 -12.6856 -12.6856 -11.4419 -11.4418 -11.3426 -11.3426 -6.3934 -6.3929 -6.3264 -6.3258 -5.8263 -5.8261 -5.4781 -5.4779 -4.2277 -4.2271 -3.9887 -3.9884 -3.6705 -3.6691 -2.9649 -2.9643 -2.3976 -2.3939 -2.1335 -2.1314 -1.8737 -1.8681 -1.7418 -1.7365 -0.6695 -0.6580 -0.5250 -0.5114 -0.2904 -0.2827 -0.2213 -0.2029 -0.0864 -0.0747 0.0662 0.0766 0.2222 0.2281 0.4245 0.4260 0.4742 0.4761 1.0323 1.0350 1.1851 1.1889 1.2783 1.2801 4.3865 4.3868 5.6240 5.6247 6.0740 6.0742 6.5830 6.5837 6.8363 6.8367 8.6107 8.6124 9.0652 9.0682 k = 0.4805 0.1357 0.5005 ( 8229 PWs) bands (ev): -16.9902 -16.9902 -16.2415 -16.2414 -16.2088 -16.2088 -13.0530 -13.0530 -12.9677 -12.9677 -12.8670 -12.8670 -12.6893 -12.6893 -11.4358 -11.4358 -11.3418 -11.3418 -6.3904 -6.3898 -6.3264 -6.3257 -5.8390 -5.8388 -5.4761 -5.4759 -4.2133 -4.2125 -3.9881 -3.9878 -3.6835 -3.6818 -2.9841 -2.9835 -2.3809 -2.3767 -2.1179 -2.1158 -1.8868 -1.8809 -1.7401 -1.7347 -0.6640 -0.6509 -0.5214 -0.5057 -0.2898 -0.2815 -0.2222 -0.2015 -0.0852 -0.0717 0.0628 0.0751 0.2301 0.2366 0.4223 0.4248 0.4747 0.4769 1.0271 1.0301 1.1838 1.1879 1.2753 1.2771 4.3570 4.3573 5.6510 5.6518 6.0702 6.0703 6.5890 6.5898 6.8361 6.8366 8.5870 8.5889 9.0747 9.0780 k = 0.4798 0.1550 0.5005 ( 8227 PWs) bands (ev): -16.9896 -16.9896 -16.2413 -16.2412 -16.2094 -16.2093 -13.0505 -13.0505 -12.9689 -12.9688 -12.8702 -12.8702 -12.6933 -12.6933 -11.4290 -11.4290 -11.3409 -11.3409 -6.3870 -6.3863 -6.3264 -6.3257 -5.8529 -5.8527 -5.4738 -5.4737 -4.1975 -4.1966 -3.9873 -3.9869 -3.6980 -3.6960 -3.0047 -3.0040 -2.3624 -2.3577 -2.1012 -2.0991 -1.9006 -1.8944 -1.7385 -1.7332 -0.6576 -0.6429 -0.5170 -0.4992 -0.2891 -0.2803 -0.2229 -0.2005 -0.0842 -0.0690 0.0590 0.0730 0.2391 0.2457 0.4199 0.4234 0.4755 0.4781 1.0211 1.0244 1.1824 1.1867 1.2718 1.2737 4.3255 4.3258 5.6796 5.6805 6.0660 6.0661 6.5959 6.5968 6.8359 6.8364 8.5620 8.5640 9.0843 9.0878 k = 0.4792 0.1744 0.5005 ( 8233 PWs) bands (ev): -16.9888 -16.9888 -16.2410 -16.2410 -16.2100 -16.2099 -13.0478 -13.0477 -12.9701 -12.9700 -12.8738 -12.8738 -12.6977 -12.6977 -11.4217 -11.4217 -11.3400 -11.3399 -6.3833 -6.3825 -6.3264 -6.3256 -5.8677 -5.8675 -5.4714 -5.4712 -4.1805 -4.1795 -3.9865 -3.9860 -3.7137 -3.7115 -3.0262 -3.0256 -2.3425 -2.3375 -2.0842 -2.0814 -1.9146 -1.9079 -1.7371 -1.7319 -0.6503 -0.6341 -0.5119 -0.4921 -0.2881 -0.2791 -0.2233 -0.1997 -0.0835 -0.0666 0.0551 0.0704 0.2487 0.2551 0.4173 0.4219 0.4768 0.4797 1.0144 1.0178 1.1811 1.1855 1.2678 1.2697 4.2926 4.2930 5.7091 5.7101 6.0616 6.0617 6.6036 6.6045 6.8356 6.8361 8.5361 8.5382 9.0938 9.0974 k = 0.4786 0.1938 0.5005 ( 8238 PWs) bands (ev): -16.9881 -16.9880 -16.2408 -16.2407 -16.2107 -16.2106 -13.0448 -13.0447 -12.9714 -12.9714 -12.8777 -12.8777 -12.7023 -12.7023 -11.4140 -11.4140 -11.3390 -11.3389 -6.3794 -6.3785 -6.3265 -6.3255 -5.8830 -5.8828 -5.4689 -5.4687 -4.1628 -4.1616 -3.9855 -3.9850 -3.7302 -3.7278 -3.0483 -3.0477 -2.3219 -2.3165 -2.0677 -2.0630 -1.9285 -1.9206 -1.7359 -1.7309 -0.6422 -0.6247 -0.5060 -0.4844 -0.2870 -0.2778 -0.2234 -0.1991 -0.0834 -0.0649 0.0509 0.0672 0.2585 0.2643 0.4148 0.4204 0.4785 0.4818 1.0070 1.0104 1.1799 1.1843 1.2635 1.2654 4.2591 4.2594 5.7390 5.7401 6.0570 6.0571 6.6120 6.6128 6.8351 6.8357 8.5098 8.5120 9.1030 9.1068 k = 0.4780 0.2132 0.5005 ( 8234 PWs) bands (ev): -16.9872 -16.9872 -16.2405 -16.2404 -16.2115 -16.2114 -13.0416 -13.0416 -12.9728 -12.9727 -12.8818 -12.8818 -12.7071 -12.7071 -11.4060 -11.4060 -11.3379 -11.3379 -6.3753 -6.3743 -6.3265 -6.3255 -5.8987 -5.8985 -5.4662 -5.4660 -4.1445 -4.1432 -3.9844 -3.9839 -3.7473 -3.7446 -3.0706 -3.0701 -2.3011 -2.2953 -2.0531 -2.0447 -1.9415 -1.9313 -1.7348 -1.7300 -0.6335 -0.6147 -0.4995 -0.4761 -0.2859 -0.2765 -0.2232 -0.1987 -0.0838 -0.0639 0.0464 0.0635 0.2679 0.2728 0.4129 0.4194 0.4808 0.4843 0.9989 1.0023 1.1789 1.1833 1.2589 1.2608 4.2253 4.2257 5.7687 5.7699 6.0523 6.0524 6.6209 6.6217 6.8346 6.8352 8.4835 8.4857 9.1119 9.1156 k = 0.4774 0.2326 0.5005 ( 8242 PWs) bands (ev): -16.9863 -16.9863 -16.2402 -16.2401 -16.2124 -16.2123 -13.0383 -13.0382 -12.9741 -12.9740 -12.8861 -12.8861 -12.7120 -12.7119 -11.3979 -11.3978 -11.3368 -11.3368 -6.3710 -6.3699 -6.3266 -6.3254 -5.9145 -5.9143 -5.4635 -5.4633 -4.1260 -4.1245 -3.9833 -3.9827 -3.7646 -3.7617 -3.0928 -3.0923 -2.2805 -2.2743 -2.0422 -2.0283 -1.9519 -1.9376 -1.7338 -1.7293 -0.6243 -0.6042 -0.4925 -0.4672 -0.2848 -0.2749 -0.2225 -0.1983 -0.0849 -0.0638 0.0417 0.0593 0.2759 0.2799 0.4123 0.4197 0.4835 0.4871 0.9902 0.9935 1.1781 1.1824 1.2540 1.2559 4.1919 4.1923 5.7979 5.7992 6.0476 6.0478 6.6302 6.6310 6.8340 6.8346 8.4574 8.4597 9.1201 9.1239 k = 0.4768 0.2519 0.5005 ( 8238 PWs) bands (ev): -16.9854 -16.9854 -16.2398 -16.2397 -16.2133 -16.2132 -13.0348 -13.0347 -12.9755 -12.9754 -12.8905 -12.8905 -12.7169 -12.7169 -11.3897 -11.3896 -11.3357 -11.3357 -6.3667 -6.3654 -6.3267 -6.3254 -5.9301 -5.9299 -5.4608 -5.4606 -4.1075 -4.1059 -3.9820 -3.9814 -3.7819 -3.7789 -3.1146 -3.1142 -2.2608 -2.2539 -2.0373 -2.0174 -1.9560 -1.9372 -1.7329 -1.7287 -0.6146 -0.5934 -0.4850 -0.4579 -0.2839 -0.2729 -0.2213 -0.1978 -0.0867 -0.0649 0.0368 0.0545 0.2815 0.2850 0.4136 0.4219 0.4866 0.4903 0.9809 0.9841 1.1776 1.1818 1.2490 1.2509 4.1592 4.1596 5.8261 5.8276 6.0429 6.0432 6.6398 6.6406 6.8333 6.8339 8.4320 8.4342 9.1277 9.1313 k = 0.4762 0.2713 0.5005 ( 8248 PWs) bands (ev): -16.9844 -16.9844 -16.2395 -16.2394 -16.2143 -16.2142 -13.0313 -13.0312 -12.9768 -12.9767 -12.8950 -12.8950 -12.7218 -12.7218 -11.3816 -11.3815 -11.3346 -11.3346 -6.3625 -6.3609 -6.3269 -6.3253 -5.9452 -5.9451 -5.4581 -5.4580 -4.0894 -4.0876 -3.9807 -3.9800 -3.7990 -3.7958 -3.1358 -3.1353 -2.2422 -2.2346 -2.0394 -2.0167 -1.9491 -1.9292 -1.7321 -1.7281 -0.6047 -0.5824 -0.4772 -0.4483 -0.2831 -0.2706 -0.2196 -0.1971 -0.0893 -0.0670 0.0317 0.0491 0.2839 0.2874 0.4176 0.4265 0.4902 0.4937 0.9712 0.9742 1.1774 1.1814 1.2438 1.2457 4.1276 4.1280 5.8530 5.8546 6.0384 6.0389 6.6497 6.6504 6.8324 6.8330 8.4074 8.4095 9.1344 9.1379 k = 0.4756 0.2907 0.5005 ( 8242 PWs) bands (ev): -16.9834 -16.9834 -16.2391 -16.2390 -16.2154 -16.2152 -13.0277 -13.0276 -12.9780 -12.9779 -12.8994 -12.8994 -12.7266 -12.7266 -11.3737 -11.3736 -11.3335 -11.3335 -6.3583 -6.3565 -6.3271 -6.3253 -5.9598 -5.9596 -5.4555 -5.4554 -4.0718 -4.0698 -3.9794 -3.9786 -3.8156 -3.8123 -3.1560 -3.1556 -2.2251 -2.2165 -2.0464 -2.0238 -1.9336 -1.9154 -1.7312 -1.7275 -0.5945 -0.5712 -0.4693 -0.4386 -0.2824 -0.2679 -0.2174 -0.1960 -0.0927 -0.0704 0.0263 0.0431 0.2829 0.2870 0.4245 0.4337 0.4939 0.4973 0.9611 0.9639 1.1774 1.1812 1.2386 1.2405 4.0976 4.0980 5.8783 5.8801 6.0340 6.0348 6.6596 6.6603 6.8314 6.8320 8.3839 8.3860 9.1402 9.1435 k = 0.4750 0.3101 0.5005 ( 8250 PWs) bands (ev): -16.9825 -16.9825 -16.2387 -16.2386 -16.2164 -16.2163 -13.0241 -13.0240 -12.9791 -12.9790 -12.9038 -12.9038 -12.7312 -12.7312 -11.3662 -11.3661 -11.3325 -11.3324 -6.3543 -6.3523 -6.3273 -6.3252 -5.9734 -5.9733 -5.4531 -5.4529 -4.0550 -4.0529 -3.9780 -3.9771 -3.8316 -3.8281 -3.1751 -3.1747 -2.2098 -2.1998 -2.0560 -2.0339 -1.9145 -1.8984 -1.7304 -1.7269 -0.5843 -0.5601 -0.4615 -0.4290 -0.2815 -0.2648 -0.2147 -0.1944 -0.0969 -0.0749 0.0207 0.0364 0.2792 0.2836 0.4340 0.4432 0.4979 0.5010 0.9508 0.9533 1.1776 1.1812 1.2334 1.2353 4.0694 4.0698 5.9016 5.9037 6.0300 6.0311 6.6694 6.6700 6.8302 6.8308 8.3619 8.3639 9.1449 9.1480 k = 0.4743 0.3295 0.5005 ( 8242 PWs) bands (ev): -16.9815 -16.9815 -16.2383 -16.2382 -16.2175 -16.2174 -13.0207 -13.0205 -12.9802 -12.9800 -12.9081 -12.9081 -12.7355 -12.7355 -11.3591 -11.3590 -11.3315 -11.3314 -6.3505 -6.3482 -6.3275 -6.3252 -5.9861 -5.9860 -5.4507 -5.4506 -4.0392 -4.0370 -3.9766 -3.9756 -3.8468 -3.8431 -3.1928 -3.1925 -2.1963 -2.1848 -2.0666 -2.0444 -1.8942 -1.8800 -1.7296 -1.7263 -0.5741 -0.5490 -0.4542 -0.4197 -0.2802 -0.2614 -0.2114 -0.1923 -0.1019 -0.0806 0.0149 0.0291 0.2734 0.2780 0.4454 0.4542 0.5019 0.5047 0.9404 0.9426 1.1780 1.1814 1.2284 1.2302 4.0433 4.0437 5.9229 5.9253 6.0263 6.0278 6.6791 6.6797 6.8288 6.8293 8.3415 8.3433 9.1487 9.1515 k = 0.4737 0.3488 0.5005 ( 8246 PWs) bands (ev): -16.9806 -16.9806 -16.2378 -16.2377 -16.2186 -16.2185 -13.0173 -13.0172 -12.9811 -12.9809 -12.9122 -12.9122 -12.7396 -12.7396 -11.3525 -11.3524 -11.3306 -11.3304 -6.3471 -6.3445 -6.3277 -6.3251 -5.9976 -5.9975 -5.4486 -5.4485 -4.0247 -4.0224 -3.9753 -3.9741 -3.8609 -3.8572 -3.2090 -3.2087 -2.1848 -2.1714 -2.0771 -2.0543 -1.8740 -1.8613 -1.7287 -1.7255 -0.5640 -0.5380 -0.4476 -0.4113 -0.2784 -0.2577 -0.2075 -0.1895 -0.1077 -0.0871 0.0088 0.0213 0.2663 0.2709 0.4579 0.4660 0.5059 0.5083 0.9302 0.9321 1.1785 1.1817 1.2235 1.2254 4.0196 4.0200 5.9418 5.9447 6.0229 6.0251 6.6886 6.6891 6.8271 6.8276 8.3229 8.3246 9.1515 9.1540 k = 0.4731 0.3682 0.5005 ( 8240 PWs) bands (ev): -16.9798 -16.9798 -16.2374 -16.2373 -16.2197 -16.2196 -13.0142 -13.0141 -12.9819 -12.9818 -12.9160 -12.9160 -12.7432 -12.7432 -11.3467 -11.3465 -11.3297 -11.3295 -6.3440 -6.3410 -6.3280 -6.3249 -6.0078 -6.0077 -5.4467 -5.4466 -4.0116 -4.0093 -3.9739 -3.9725 -3.8740 -3.8701 -3.2235 -3.2233 -2.1752 -2.1596 -2.0869 -2.0631 -1.8547 -1.8431 -1.7278 -1.7246 -0.5541 -0.5273 -0.4421 -0.4040 -0.2757 -0.2537 -0.2031 -0.1862 -0.1141 -0.0944 0.0024 0.0129 0.2588 0.2630 0.4706 0.4779 0.5098 0.5119 0.9204 0.9220 1.1790 1.1820 1.2188 1.2207 3.9985 3.9989 5.9581 5.9617 6.0200 6.0229 6.6978 6.6982 6.8250 6.8255 8.3063 8.3079 9.1537 9.1559 k = 0.4725 0.3876 0.5005 ( 8230 PWs) bands (ev): -16.9790 -16.9790 -16.2369 -16.2368 -16.2208 -16.2207 -13.0113 -13.0112 -12.9826 -12.9825 -12.9195 -12.9195 -12.7463 -12.7463 -11.3416 -11.3414 -11.3289 -11.3287 -6.3414 -6.3380 -6.3282 -6.3248 -6.0166 -6.0165 -5.4450 -5.4449 -4.0003 -3.9979 -3.9727 -3.9709 -3.8858 -3.8819 -3.2362 -3.2360 -2.1675 -2.1494 -2.0959 -2.0705 -1.8368 -1.8260 -1.7269 -1.7236 -0.5445 -0.5169 -0.4380 -0.3983 -0.2721 -0.2495 -0.1983 -0.1823 -0.1209 -0.1020 -0.0042 0.0041 0.2513 0.2551 0.4827 0.4891 0.5134 0.5153 0.9112 0.9125 1.1794 1.1823 1.2145 1.2164 3.9803 3.9807 5.9717 5.9762 6.0175 6.0214 6.7065 6.7069 6.8226 6.8230 8.2920 8.2933 9.1553 9.1572 k = 0.4719 0.4070 0.5005 ( 8222 PWs) bands (ev): -16.9782 -16.9782 -16.2364 -16.2363 -16.2219 -16.2217 -13.0087 -13.0086 -12.9833 -12.9831 -12.9226 -12.9226 -12.7490 -12.7490 -11.3373 -11.3371 -11.3282 -11.3279 -6.3393 -6.3354 -6.3285 -6.3246 -6.0238 -6.0237 -5.4435 -5.4435 -3.9909 -3.9885 -3.9715 -3.9691 -3.8962 -3.8924 -3.2468 -3.2466 -2.1614 -2.1406 -2.1036 -2.0765 -1.8206 -1.8105 -1.7260 -1.7225 -0.5353 -0.5068 -0.4355 -0.3946 -0.2677 -0.2451 -0.1936 -0.1784 -0.1274 -0.1094 -0.0111 -0.0049 0.2445 0.2476 0.4935 0.4989 0.5166 0.5188 0.9031 0.9041 1.1798 1.1825 1.2104 1.2123 3.9651 3.9654 5.9823 5.9881 6.0155 6.0208 6.7148 6.7151 6.8197 6.8201 8.2800 8.2811 9.1567 9.1582 k = 0.4713 0.4264 0.5005 ( 8216 PWs) bands (ev): -16.9776 -16.9776 -16.2359 -16.2357 -16.2230 -16.2228 -13.0064 -13.0063 -12.9840 -12.9838 -12.9252 -12.9252 -12.7510 -12.7510 -11.3340 -11.3337 -11.3275 -11.3272 -6.3376 -6.3333 -6.3288 -6.3245 -6.0295 -6.0294 -5.4424 -5.4423 -3.9839 -3.9811 -3.9703 -3.9671 -3.9050 -3.9015 -3.2554 -3.2552 -2.1567 -2.1333 -2.1100 -2.0811 -1.8065 -1.7969 -1.7253 -1.7215 -0.5266 -0.4973 -0.4347 -0.3930 -0.2625 -0.2408 -0.1897 -0.1754 -0.1322 -0.1158 -0.0180 -0.0137 0.2386 0.2411 0.5023 0.5068 0.5195 0.5223 0.8962 0.8970 1.1801 1.1827 1.2067 1.2087 3.9530 3.9533 5.9898 5.9972 6.0141 6.0210 6.7227 6.7229 6.8163 6.8167 8.2704 8.2713 9.1580 9.1591 k = 0.4707 0.4457 0.5005 ( 8222 PWs) bands (ev): -16.9770 -16.9770 -16.2353 -16.2352 -16.2240 -16.2238 -13.0045 -13.0043 -12.9848 -12.9847 -12.9272 -12.9272 -12.7524 -12.7524 -11.3316 -11.3313 -11.3269 -11.3265 -6.3363 -6.3317 -6.3291 -6.3245 -6.0335 -6.0334 -5.4414 -5.4414 -3.9794 -3.9760 -3.9691 -3.9652 -3.9120 -3.9093 -3.2617 -3.2616 -2.1529 -2.1271 -2.1150 -2.0845 -1.7945 -1.7853 -1.7250 -1.7208 -0.5184 -0.4882 -0.4356 -0.3937 -0.2572 -0.2367 -0.1877 -0.1756 -0.1326 -0.1201 -0.0250 -0.0222 0.2340 0.2358 0.5085 0.5121 0.5223 0.5255 0.8910 0.8915 1.1804 1.1828 1.2033 1.2053 3.9442 3.9445 5.9948 6.0035 6.0132 6.0215 6.7300 6.7301 6.8124 6.8127 8.2634 8.2640 9.1594 9.1602 k = 0.4701 0.4651 0.5005 ( 8213 PWs) bands (ev): -16.9766 -16.9766 -16.2348 -16.2346 -16.2250 -16.2249 -13.0028 -13.0026 -12.9859 -12.9857 -12.9285 -12.9285 -12.7531 -12.7531 -11.3302 -11.3298 -11.3265 -11.3261 -6.3354 -6.3306 -6.3294 -6.3246 -6.0358 -6.0357 -5.4408 -5.4408 -3.9769 -3.9734 -3.9676 -3.9639 -3.9171 -3.9155 -3.2657 -3.2656 -2.1496 -2.1222 -2.1185 -2.0872 -1.7845 -1.7759 -1.7253 -1.7209 -0.5108 -0.4797 -0.4383 -0.3965 -0.2521 -0.2332 -0.1891 -0.1797 -0.1274 -0.1210 -0.0319 -0.0300 0.2310 0.2321 0.5120 0.5149 0.5247 0.5279 0.8878 0.8881 1.1806 1.1830 1.2002 1.2021 3.9388 3.9390 5.9977 6.0071 6.0127 6.0218 6.7368 6.7369 6.8078 6.8081 8.2589 8.2593 9.1612 9.1616 k = 0.4695 0.4845 0.5005 ( 8210 PWs) bands (ev): -16.9762 -16.9762 -16.2342 -16.2340 -16.2260 -16.2258 -13.0014 -13.0012 -12.9872 -12.9870 -12.9291 -12.9291 -12.7532 -12.7532 -11.3295 -11.3290 -11.3264 -11.3260 -6.3348 -6.3300 -6.3299 -6.3250 -6.0364 -6.0364 -5.4405 -5.4404 -3.9759 -3.9728 -3.9666 -3.9638 -3.9201 -3.9200 -3.2673 -3.2672 -2.1464 -2.1216 -2.1173 -2.0892 -1.7765 -1.7683 -1.7267 -1.7221 -0.5040 -0.4720 -0.4426 -0.4013 -0.2480 -0.2304 -0.1946 -0.1859 -0.1183 -0.1174 -0.0385 -0.0369 0.2295 0.2302 0.5134 0.5156 0.5259 0.5286 0.8867 0.8868 1.1809 1.1832 1.1972 1.1992 3.9368 3.9370 5.9993 6.0087 6.0119 6.0210 6.7430 6.7432 6.8026 6.8029 8.2570 8.2572 9.1633 9.1635 k = 0.4695 0.4845 0.5005 ( 8210 PWs) bands (ev): -16.9762 -16.9762 -16.2342 -16.2340 -16.2260 -16.2258 -13.0014 -13.0012 -12.9872 -12.9870 -12.9291 -12.9291 -12.7532 -12.7532 -11.3295 -11.3290 -11.3264 -11.3260 -6.3348 -6.3300 -6.3299 -6.3250 -6.0364 -6.0364 -5.4405 -5.4404 -3.9759 -3.9728 -3.9666 -3.9638 -3.9201 -3.9200 -3.2673 -3.2672 -2.1464 -2.1216 -2.1173 -2.0892 -1.7765 -1.7683 -1.7267 -1.7221 -0.5040 -0.4720 -0.4426 -0.4013 -0.2480 -0.2304 -0.1946 -0.1859 -0.1183 -0.1174 -0.0385 -0.0369 0.2295 0.2302 0.5134 0.5156 0.5259 0.5286 0.8867 0.8868 1.1809 1.1832 1.1972 1.1992 3.9368 3.9370 5.9993 6.0087 6.0119 6.0210 6.7430 6.7432 6.8026 6.8029 8.2570 8.2572 9.1633 9.1635 k = 0.4585 0.4732 0.4889 ( 8210 PWs) bands (ev): -16.9768 -16.9768 -16.2352 -16.2351 -16.2242 -16.2241 -13.0036 -13.0035 -12.9845 -12.9843 -12.9287 -12.9287 -12.7538 -12.7538 -11.3303 -11.3299 -11.3261 -11.3257 -6.3356 -6.3308 -6.3289 -6.3240 -6.0369 -6.0368 -5.4409 -5.4408 -3.9765 -3.9723 -3.9670 -3.9631 -3.9141 -3.9140 -3.2663 -3.2663 -2.1526 -2.1245 -2.1187 -2.0860 -1.7899 -1.7807 -1.7241 -1.7198 -0.5154 -0.4848 -0.4342 -0.3917 -0.2538 -0.2340 -0.1823 -0.1726 -0.1323 -0.1315 -0.0276 -0.0259 0.2310 0.2319 0.5127 0.5158 0.5252 0.5289 0.8868 0.8869 1.1807 1.1831 1.2028 1.2047 3.9374 3.9377 5.9975 6.0071 6.0143 6.0234 6.7323 6.7324 6.8124 6.8127 8.2584 8.2587 9.1585 9.1588 k = 0.4476 0.4620 0.4772 ( 8189 PWs) bands (ev): -16.9776 -16.9776 -16.2362 -16.2360 -16.2223 -16.2222 -13.0058 -13.0056 -12.9817 -12.9815 -12.9281 -12.9281 -12.7546 -12.7546 -11.3312 -11.3307 -11.3260 -11.3256 -6.3364 -6.3315 -6.3280 -6.3231 -6.0375 -6.0374 -5.4414 -5.4413 -3.9770 -3.9718 -3.9673 -3.9624 -3.9063 -3.9062 -3.2651 -3.2650 -2.1594 -2.1324 -2.1162 -2.0833 -1.8041 -1.7938 -1.7238 -1.7197 -0.5261 -0.4969 -0.4272 -0.3837 -0.2588 -0.2367 -0.1738 -0.1575 -0.1471 -0.1398 -0.0179 -0.0161 0.2331 0.2341 0.5121 0.5160 0.5245 0.5292 0.8869 0.8871 1.1813 1.1838 1.2092 1.2110 3.9383 3.9386 5.9961 6.0056 6.0167 6.0258 6.7218 6.7219 6.8217 6.8220 8.2602 8.2605 9.1522 9.1526 k = 0.4367 0.4507 0.4656 ( 8192 PWs) bands (ev): -16.9786 -16.9786 -16.2370 -16.2368 -16.2204 -16.2202 -13.0077 -13.0076 -12.9789 -12.9787 -12.9273 -12.9273 -12.7556 -12.7556 -11.3321 -11.3317 -11.3259 -11.3255 -6.3371 -6.3322 -6.3270 -6.3221 -6.0383 -6.0382 -5.4420 -5.4419 -3.9776 -3.9713 -3.9677 -3.9617 -3.8968 -3.8966 -3.2636 -3.2635 -2.1669 -2.1411 -2.1140 -2.0809 -1.8189 -1.8073 -1.7258 -1.7219 -0.5360 -0.5079 -0.4215 -0.3773 -0.2631 -0.2387 -0.1773 -0.1616 -0.1411 -0.1349 -0.0096 -0.0076 0.2356 0.2368 0.5113 0.5162 0.5237 0.5296 0.8870 0.8873 1.1828 1.1853 1.2164 1.2181 3.9393 3.9397 5.9948 6.0045 6.0191 6.0281 6.7116 6.7117 6.8304 6.8307 8.2623 8.2628 9.1444 9.1449 k = 0.4258 0.4394 0.4540 ( 8219 PWs) bands (ev): -16.9797 -16.9797 -16.2376 -16.2375 -16.2184 -16.2182 -13.0096 -13.0094 -12.9761 -12.9759 -12.9265 -12.9265 -12.7567 -12.7567 -11.3331 -11.3327 -11.3259 -11.3255 -6.3377 -6.3329 -6.3260 -6.3211 -6.0392 -6.0391 -5.4427 -5.4427 -3.9781 -3.9708 -3.9681 -3.9611 -3.8855 -3.8854 -3.2619 -3.2618 -2.1751 -2.1506 -2.1121 -2.0789 -1.8340 -1.8211 -1.7302 -1.7265 -0.5450 -0.5179 -0.4170 -0.3724 -0.2671 -0.2399 -0.1889 -0.1755 -0.1235 -0.1209 -0.0028 -0.0005 0.2388 0.2400 0.5106 0.5164 0.5229 0.5299 0.8872 0.8875 1.1850 1.1875 1.2242 1.2259 3.9406 3.9409 5.9939 6.0036 6.0213 6.0303 6.7019 6.7019 6.8385 6.8389 8.2648 8.2653 9.1351 9.1357 k = 0.4149 0.4282 0.4423 ( 8225 PWs) bands (ev): -16.9810 -16.9810 -16.2382 -16.2380 -16.2163 -16.2162 -13.0113 -13.0111 -12.9733 -12.9731 -12.9255 -12.9255 -12.7580 -12.7580 -11.3342 -11.3338 -11.3261 -11.3256 -6.3383 -6.3335 -6.3250 -6.3201 -6.0402 -6.0400 -5.4436 -5.4435 -3.9786 -3.9704 -3.9685 -3.9606 -3.8725 -3.8724 -3.2599 -3.2598 -2.1839 -2.1608 -2.1105 -2.0772 -1.8493 -1.8349 -1.7370 -1.7334 -0.5530 -0.5267 -0.4138 -0.3689 -0.2708 -0.2406 -0.2024 -0.1885 -0.1052 -0.1041 0.0025 0.0052 0.2424 0.2436 0.5099 0.5166 0.5222 0.5303 0.8873 0.8876 1.1881 1.1906 1.2328 1.2344 3.9420 3.9424 5.9933 6.0031 6.0233 6.0324 6.6925 6.6925 6.8460 6.8463 8.2675 8.2680 9.1244 9.1250 k = 0.4040 0.4169 0.4307 ( 8231 PWs) bands (ev): -16.9824 -16.9824 -16.2385 -16.2384 -16.2142 -16.2141 -13.0129 -13.0127 -12.9705 -12.9704 -12.9244 -12.9244 -12.7594 -12.7594 -11.3354 -11.3350 -11.3263 -11.3259 -6.3389 -6.3340 -6.3240 -6.3191 -6.0413 -6.0411 -5.4445 -5.4444 -3.9791 -3.9700 -3.9688 -3.9600 -3.8580 -3.8579 -3.2577 -3.2576 -2.1934 -2.1718 -2.1091 -2.0758 -1.8645 -1.8485 -1.7461 -1.7425 -0.5600 -0.5344 -0.4117 -0.3666 -0.2747 -0.2407 -0.2161 -0.2002 -0.0866 -0.0865 0.0063 0.0095 0.2464 0.2475 0.5092 0.5169 0.5215 0.5307 0.8874 0.8877 1.1919 1.1944 1.2420 1.2435 3.9436 3.9440 5.9930 6.0028 6.0252 6.0342 6.6837 6.6838 6.8528 6.8531 8.2703 8.2710 9.1122 9.1129 k = 0.3930 0.4056 0.4190 ( 8228 PWs) bands (ev): -16.9840 -16.9840 -16.2388 -16.2386 -16.2121 -16.2119 -13.0143 -13.0141 -12.9678 -12.9676 -12.9232 -12.9232 -12.7610 -12.7610 -11.3365 -11.3361 -11.3266 -11.3262 -6.3394 -6.3345 -6.3230 -6.3181 -6.0424 -6.0422 -5.4455 -5.4454 -3.9796 -3.9695 -3.9692 -3.9596 -3.8419 -3.8419 -3.2553 -3.2552 -2.2036 -2.1836 -2.1079 -2.0747 -1.8795 -1.8619 -1.7574 -1.7538 -0.5659 -0.5409 -0.4106 -0.3655 -0.2789 -0.2404 -0.2295 -0.2103 -0.0691 -0.0679 0.0086 0.0128 0.2507 0.2517 0.5085 0.5173 0.5208 0.5312 0.8874 0.8878 1.1964 1.1989 1.2519 1.2533 3.9453 3.9458 5.9930 6.0029 6.0269 6.0359 6.6755 6.6756 6.8589 6.8592 8.2732 8.2739 9.0988 9.0995 k = 0.3821 0.3944 0.4074 ( 8252 PWs) bands (ev): -16.9858 -16.9858 -16.2389 -16.2387 -16.2099 -16.2097 -13.0156 -13.0154 -12.9651 -12.9649 -12.9219 -12.9219 -12.7627 -12.7627 -11.3378 -11.3374 -11.3270 -11.3266 -6.3398 -6.3350 -6.3220 -6.3171 -6.0437 -6.0435 -5.4466 -5.4465 -3.9801 -3.9696 -3.9692 -3.9591 -3.8245 -3.8244 -3.2528 -3.2526 -2.2144 -2.1960 -2.1069 -2.0738 -1.8943 -1.8748 -1.7707 -1.7671 -0.5709 -0.5463 -0.4104 -0.3653 -0.2837 -0.2423 -0.2398 -0.2187 -0.0522 -0.0495 0.0098 0.0151 0.2552 0.2561 0.5080 0.5177 0.5202 0.5318 0.8874 0.8879 1.2017 1.2042 1.2623 1.2636 3.9472 3.9477 5.9934 6.0034 6.0284 6.0374 6.6680 6.6682 6.8643 6.8646 8.2760 8.2768 9.0841 9.0849 k = 0.3712 0.3831 0.3958 ( 8255 PWs) bands (ev): -16.9876 -16.9876 -16.2388 -16.2386 -16.2077 -16.2076 -13.0167 -13.0165 -12.9625 -12.9623 -12.9205 -12.9205 -12.7646 -12.7646 -11.3390 -11.3386 -11.3275 -11.3271 -6.3402 -6.3354 -6.3211 -6.3161 -6.0450 -6.0448 -5.4478 -5.4477 -3.9805 -3.9700 -3.9688 -3.9587 -3.8058 -3.8057 -3.2501 -3.2499 -2.2257 -2.2090 -2.1061 -2.0732 -1.9085 -1.8873 -1.7858 -1.7822 -0.5750 -0.5507 -0.4111 -0.3661 -0.2894 -0.2543 -0.2388 -0.2251 -0.0366 -0.0318 0.0098 0.0170 0.2598 0.2604 0.5076 0.5182 0.5198 0.5325 0.8873 0.8878 1.2077 1.2102 1.2733 1.2745 3.9493 3.9498 5.9941 6.0041 6.0297 6.0387 6.6612 6.6614 6.8689 6.8692 8.2784 8.2794 9.0685 9.0694 k = 0.3603 0.3718 0.3841 ( 8255 PWs) bands (ev): -16.9896 -16.9896 -16.2386 -16.2384 -16.2055 -16.2054 -13.0176 -13.0174 -12.9599 -12.9598 -12.9190 -12.9190 -12.7665 -12.7665 -11.3403 -11.3399 -11.3281 -11.3276 -6.3405 -6.3357 -6.3201 -6.3152 -6.0463 -6.0461 -5.4491 -5.4490 -3.9809 -3.9704 -3.9685 -3.9584 -3.7859 -3.7858 -3.2473 -3.2471 -2.2376 -2.2225 -2.1054 -2.0728 -1.9222 -1.8991 -1.8026 -1.7989 -0.5782 -0.5542 -0.4125 -0.3675 -0.2957 -0.2656 -0.2377 -0.2297 -0.0233 -0.0150 0.0088 0.0192 0.2642 0.2646 0.5073 0.5189 0.5195 0.5332 0.8871 0.8877 1.2144 1.2169 1.2848 1.2859 3.9515 3.9520 5.9951 6.0052 6.0307 6.0397 6.6552 6.6554 6.8729 6.8732 8.2804 8.2814 9.0520 9.0529 k = 0.3494 0.3605 0.3725 ( 8243 PWs) bands (ev): -16.9918 -16.9918 -16.2382 -16.2381 -16.2033 -16.2032 -13.0183 -13.0181 -12.9575 -12.9573 -12.9174 -12.9174 -12.7686 -12.7686 -11.3416 -11.3412 -11.3287 -11.3283 -6.3408 -6.3359 -6.3191 -6.3142 -6.0477 -6.0475 -5.4504 -5.4503 -3.9813 -3.9707 -3.9682 -3.9581 -3.7649 -3.7649 -3.2443 -3.2441 -2.2500 -2.2365 -2.1049 -2.0726 -1.9353 -1.9104 -1.8207 -1.8168 -0.5807 -0.5569 -0.4145 -0.3696 -0.3024 -0.2759 -0.2364 -0.2327 -0.0134 0.0006 0.0072 0.0230 0.2684 0.2685 0.5073 0.5194 0.5196 0.5341 0.8869 0.8876 1.2217 1.2242 1.2967 1.2977 3.9538 3.9543 5.9964 6.0066 6.0315 6.0405 6.6499 6.6501 6.8763 6.8765 8.2815 8.2826 9.0350 9.0359 k = 0.3384 0.3493 0.3608 ( 8243 PWs) bands (ev): -16.9940 -16.9940 -16.2377 -16.2376 -16.2011 -16.2010 -13.0189 -13.0187 -12.9551 -12.9549 -12.9157 -12.9157 -12.7707 -12.7707 -11.3430 -11.3426 -11.3295 -11.3291 -6.3410 -6.3361 -6.3182 -6.3133 -6.0491 -6.0489 -5.4517 -5.4516 -3.9816 -3.9711 -3.9679 -3.9578 -3.7430 -3.7430 -3.2413 -3.2411 -2.2627 -2.2508 -2.1046 -2.0727 -1.9477 -1.9210 -1.8399 -1.8359 -0.5827 -0.5590 -0.4171 -0.3723 -0.3093 -0.2854 -0.2352 -0.2347 -0.0081 0.0049 0.0147 0.0293 0.2722 0.2723 0.5075 0.5195 0.5204 0.5351 0.8866 0.8873 1.2297 1.2322 1.3089 1.3100 3.9562 3.9567 5.9980 6.0082 6.0321 6.0411 6.6454 6.6457 6.8790 6.8792 8.2815 8.2827 9.0177 9.0186 k = 0.3275 0.3380 0.3492 ( 8243 PWs) bands (ev): -16.9963 -16.9963 -16.2371 -16.2369 -16.1990 -16.1988 -13.0193 -13.0191 -12.9529 -12.9527 -12.9140 -12.9140 -12.7729 -12.7729 -11.3443 -11.3439 -11.3303 -11.3299 -6.3411 -6.3363 -6.3173 -6.3124 -6.0506 -6.0504 -5.4532 -5.4531 -3.9820 -3.9714 -3.9677 -3.9575 -3.7203 -3.7202 -3.2382 -3.2380 -2.2757 -2.2653 -2.1046 -2.0732 -1.9594 -1.9309 -1.8600 -1.8557 -0.5840 -0.5604 -0.4201 -0.3755 -0.3161 -0.2940 -0.2358 -0.2340 -0.0065 0.0022 0.0273 0.0373 0.2754 0.2758 0.5079 0.5199 0.5214 0.5362 0.8862 0.8869 1.2383 1.2407 1.3216 1.3225 3.9587 3.9593 5.9999 6.0102 6.0324 6.0415 6.6417 6.6421 6.8812 6.8814 8.2800 8.2813 9.0003 9.0013 k = 0.3166 0.3267 0.3376 ( 8243 PWs) bands (ev): -16.9987 -16.9987 -16.2363 -16.2361 -16.1969 -16.1967 -13.0195 -13.0194 -12.9507 -12.9506 -12.9122 -12.9122 -12.7752 -12.7752 -11.3457 -11.3453 -11.3312 -11.3308 -6.3412 -6.3363 -6.3165 -6.3115 -6.0520 -6.0518 -5.4546 -5.4545 -3.9823 -3.9716 -3.9675 -3.9573 -3.6968 -3.6968 -3.2351 -3.2348 -2.2890 -2.2799 -2.1048 -2.0741 -1.9705 -1.9402 -1.8804 -1.8758 -0.5849 -0.5613 -0.4235 -0.3791 -0.3225 -0.3017 -0.2366 -0.2331 -0.0071 -0.0007 0.0380 0.0454 0.2782 0.2789 0.5087 0.5205 0.5225 0.5374 0.8857 0.8865 1.2474 1.2499 1.3345 1.3353 3.9613 3.9619 6.0020 6.0123 6.0326 6.0417 6.6388 6.6392 6.8829 6.8830 8.2766 8.2780 8.9832 8.9842 k = 0.3057 0.3155 0.3259 ( 8246 PWs) bands (ev): -17.0012 -17.0012 -16.2353 -16.2352 -16.1948 -16.1946 -13.0196 -13.0194 -12.9488 -12.9486 -12.9104 -12.9104 -12.7775 -12.7775 -11.3471 -11.3466 -11.3322 -11.3318 -6.3411 -6.3363 -6.3156 -6.3107 -6.0535 -6.0532 -5.4561 -5.4560 -3.9825 -3.9719 -3.9673 -3.9572 -3.6728 -3.6728 -3.2319 -3.2317 -2.3023 -2.2945 -2.1055 -2.0758 -1.9809 -1.9487 -1.9010 -1.8959 -0.5853 -0.5618 -0.4272 -0.3831 -0.3285 -0.3085 -0.2373 -0.2324 -0.0089 -0.0038 0.0468 0.0525 0.2806 0.2816 0.5097 0.5214 0.5237 0.5387 0.8852 0.8860 1.2571 1.2595 1.3476 1.3484 3.9640 3.9645 6.0044 6.0147 6.0325 6.0417 6.6367 6.6371 6.8841 6.8842 8.2709 8.2723 8.9667 8.9677 k = 0.2948 0.3042 0.3143 ( 8228 PWs) bands (ev): -17.0037 -17.0037 -16.2343 -16.2341 -16.1928 -16.1926 -13.0194 -13.0193 -12.9469 -12.9468 -12.9085 -12.9085 -12.7799 -12.7799 -11.3484 -11.3480 -11.3332 -11.3328 -6.3410 -6.3362 -6.3149 -6.3099 -6.0549 -6.0547 -5.4576 -5.4575 -3.9827 -3.9721 -3.9672 -3.9571 -3.6483 -3.6483 -3.2288 -3.2285 -2.3156 -2.3090 -2.1068 -2.0783 -1.9906 -1.9566 -1.9212 -1.9155 -0.5853 -0.5619 -0.4311 -0.3874 -0.3340 -0.3146 -0.2380 -0.2322 -0.0112 -0.0069 0.0536 0.0581 0.2827 0.2838 0.5111 0.5226 0.5251 0.5402 0.8845 0.8854 1.2673 1.2697 1.3608 1.3616 3.9667 3.9672 6.0069 6.0173 6.0323 6.0416 6.6354 6.6358 6.8849 6.8849 8.2624 8.2639 8.9510 8.9520 k = 0.2839 0.2929 0.3026 ( 8225 PWs) bands (ev): -17.0063 -17.0063 -16.2331 -16.2329 -16.1908 -16.1906 -13.0191 -13.0190 -12.9452 -12.9451 -12.9066 -12.9066 -12.7823 -12.7823 -11.3498 -11.3493 -11.3343 -11.3339 -6.3409 -6.3360 -6.3141 -6.3091 -6.0563 -6.0561 -5.4592 -5.4591 -3.9829 -3.9723 -3.9672 -3.9570 -3.6236 -3.6235 -3.2256 -3.2254 -2.3289 -2.3233 -2.1090 -2.0822 -1.9998 -1.9638 -1.9405 -1.9340 -0.5850 -0.5616 -0.4353 -0.3919 -0.3389 -0.3200 -0.2389 -0.2325 -0.0139 -0.0099 0.0583 0.0619 0.2845 0.2858 0.5128 0.5241 0.5266 0.5417 0.8839 0.8848 1.2780 1.2803 1.3742 1.3749 3.9695 3.9700 6.0096 6.0200 6.0320 6.0413 6.6347 6.6352 6.8853 6.8853 8.2508 8.2523 8.9363 8.9373 k = 0.2729 0.2817 0.2910 ( 8222 PWs) bands (ev): -17.0089 -17.0089 -16.2317 -16.2316 -16.1889 -16.1887 -13.0186 -13.0185 -12.9437 -12.9436 -12.9047 -12.9047 -12.7847 -12.7847 -11.3511 -11.3507 -11.3355 -11.3351 -6.3406 -6.3358 -6.3134 -6.3084 -6.0577 -6.0575 -5.4607 -5.4606 -3.9831 -3.9725 -3.9671 -3.9570 -3.5986 -3.5986 -3.2225 -3.2222 -2.3420 -2.3373 -2.1126 -2.0880 -2.0084 -1.9704 -1.9582 -1.9507 -0.5843 -0.5609 -0.4396 -0.3966 -0.3434 -0.3248 -0.2403 -0.2334 -0.0167 -0.0129 0.0608 0.0637 0.2862 0.2876 0.5148 0.5259 0.5282 0.5434 0.8831 0.8841 1.2891 1.2913 1.3876 1.3882 3.9723 3.9728 6.0124 6.0228 6.0316 6.0410 6.6348 6.6353 6.8853 6.8853 8.2355 8.2371 8.9227 8.9236 k = 0.2620 0.2704 0.2794 ( 8216 PWs) bands (ev): -17.0116 -17.0116 -16.2303 -16.2302 -16.1871 -16.1869 -13.0180 -13.0178 -12.9424 -12.9422 -12.9027 -12.9027 -12.7871 -12.7871 -11.3524 -11.3520 -11.3367 -11.3363 -6.3403 -6.3355 -6.3127 -6.3078 -6.0590 -6.0588 -5.4622 -5.4622 -3.9832 -3.9726 -3.9671 -3.9570 -3.5737 -3.5737 -3.2193 -3.2190 -2.3548 -2.3510 -2.1180 -2.0962 -2.0165 -1.9762 -1.9738 -1.9649 -0.5831 -0.5599 -0.4439 -0.4014 -0.3475 -0.3290 -0.2422 -0.2350 -0.0197 -0.0158 0.0612 0.0635 0.2879 0.2894 0.5171 0.5280 0.5300 0.5452 0.8823 0.8833 1.3005 1.3027 1.4009 1.4015 3.9752 3.9756 6.0153 6.0257 6.0312 6.0406 6.6355 6.6360 6.8849 6.8850 8.2165 8.2181 8.9102 8.9111 k = 0.2511 0.2591 0.2677 ( 8222 PWs) bands (ev): -17.0142 -17.0142 -16.2288 -16.2286 -16.1854 -16.1852 -13.0171 -13.0170 -12.9412 -12.9411 -12.9008 -12.9008 -12.7895 -12.7895 -11.3537 -11.3532 -11.3380 -11.3375 -6.3400 -6.3351 -6.3121 -6.3072 -6.0603 -6.0601 -5.4637 -5.4637 -3.9833 -3.9727 -3.9672 -3.9571 -3.5488 -3.5488 -3.2161 -3.2159 -2.3672 -2.3641 -2.1259 -2.1071 -2.0238 -1.9866 -1.9814 -1.9762 -0.5817 -0.5585 -0.4483 -0.4063 -0.3513 -0.3328 -0.2447 -0.2373 -0.0228 -0.0187 0.0594 0.0611 0.2898 0.2914 0.5197 0.5303 0.5319 0.5471 0.8815 0.8825 1.3123 1.3144 1.4142 1.4147 3.9780 3.9784 6.0183 6.0286 6.0307 6.0401 6.6368 6.6373 6.8843 6.8844 8.1934 8.1949 8.8986 8.8996 k = 0.2402 0.2479 0.2561 ( 8234 PWs) bands (ev): -17.0169 -17.0169 -16.2271 -16.2270 -16.1838 -16.1836 -13.0161 -13.0160 -12.9403 -12.9401 -12.8988 -12.8988 -12.7920 -12.7920 -11.3549 -11.3545 -11.3393 -11.3388 -6.3395 -6.3347 -6.3116 -6.3066 -6.0616 -6.0614 -5.4653 -5.4652 -3.9834 -3.9728 -3.9673 -3.9572 -3.5243 -3.5243 -3.2129 -3.2126 -2.3793 -2.3767 -2.1366 -2.1207 -2.0301 -1.9965 -1.9860 -1.9843 -0.5798 -0.5568 -0.4527 -0.4113 -0.3548 -0.3362 -0.2479 -0.2404 -0.0261 -0.0216 0.0554 0.0567 0.2922 0.2938 0.5225 0.5328 0.5339 0.5490 0.8807 0.8818 1.3243 1.3264 1.4272 1.4277 3.9808 3.9812 6.0212 6.0302 6.0315 6.0397 6.6386 6.6391 6.8833 6.8835 8.1661 8.1677 8.8878 8.8888 k = 0.2293 0.2366 0.2444 ( 8237 PWs) bands (ev): -17.0195 -17.0195 -16.2253 -16.2252 -16.1822 -16.1821 -13.0150 -13.0148 -12.9395 -12.9393 -12.8969 -12.8969 -12.7943 -12.7943 -11.3561 -11.3557 -11.3406 -11.3401 -6.3390 -6.3342 -6.3111 -6.3062 -6.0628 -6.0626 -5.4668 -5.4667 -3.9834 -3.9729 -3.9675 -3.9574 -3.5001 -3.5001 -3.2096 -3.2093 -2.3908 -2.3888 -2.1500 -2.1367 -2.0350 -2.0039 -1.9899 -1.9896 -0.5775 -0.5547 -0.4571 -0.4162 -0.3582 -0.3393 -0.2518 -0.2443 -0.0297 -0.0248 0.0494 0.0504 0.2953 0.2969 0.5255 0.5354 0.5361 0.5511 0.8799 0.8810 1.3365 1.3385 1.4400 1.4405 3.9836 3.9839 6.0242 6.0297 6.0344 6.0393 6.6408 6.6413 6.8820 6.8822 8.1348 8.1363 8.8774 8.8783 k = 0.2184 0.2253 0.2328 ( 8243 PWs) bands (ev): -17.0222 -17.0222 -16.2235 -16.2234 -16.1808 -16.1807 -13.0137 -13.0135 -12.9389 -12.9388 -12.8950 -12.8950 -12.7967 -12.7967 -11.3572 -11.3568 -11.3419 -11.3415 -6.3384 -6.3336 -6.3107 -6.3058 -6.0640 -6.0638 -5.4682 -5.4682 -3.9835 -3.9729 -3.9677 -3.9576 -3.4766 -3.4766 -3.2062 -3.2059 -2.4018 -2.4002 -2.1658 -2.1545 -2.0384 -2.0091 -1.9931 -1.9927 -0.5748 -0.5522 -0.4614 -0.4211 -0.3614 -0.3422 -0.2564 -0.2490 -0.0338 -0.0282 0.0414 0.0421 0.2993 0.3009 0.5287 0.5383 0.5384 0.5532 0.8791 0.8801 1.3489 1.3508 1.4525 1.4529 3.9863 3.9867 6.0271 6.0293 6.0371 6.0391 6.6436 6.6440 6.8803 6.8806 8.0996 8.1010 8.8670 8.8679 k = 0.2074 0.2141 0.2212 ( 8264 PWs) bands (ev): -17.0248 -17.0247 -16.2216 -16.2214 -16.1796 -16.1794 -13.0122 -13.0120 -12.9386 -12.9384 -12.8931 -12.8931 -12.7990 -12.7990 -11.3583 -11.3579 -11.3433 -11.3429 -6.3378 -6.3329 -6.3104 -6.3054 -6.0651 -6.0649 -5.4697 -5.4696 -3.9834 -3.9729 -3.9680 -3.9578 -3.4538 -3.4538 -3.2025 -3.2023 -2.4122 -2.4109 -2.1832 -2.1733 -2.0405 -2.0126 -1.9957 -1.9940 -0.5716 -0.5493 -0.4656 -0.4259 -0.3646 -0.3450 -0.2617 -0.2544 -0.0386 -0.0322 0.0315 0.0321 0.3045 0.3061 0.5320 0.5409 0.5412 0.5554 0.8782 0.8794 1.3613 1.3632 1.4646 1.4650 3.9890 3.9893 6.0290 6.0299 6.0383 6.0404 6.6466 6.6471 6.8784 6.8787 8.0606 8.0619 8.8561 8.8570 k = 0.1965 0.2028 0.2095 ( 8282 PWs) bands (ev): -17.0273 -17.0273 -16.2196 -16.2194 -16.1784 -16.1783 -13.0106 -13.0104 -12.9384 -12.9382 -12.8913 -12.8912 -12.8013 -12.8013 -11.3594 -11.3590 -11.3447 -11.3443 -6.3371 -6.3322 -6.3101 -6.3052 -6.0662 -6.0660 -5.4711 -5.4711 -3.9834 -3.9729 -3.9683 -3.9581 -3.4320 -3.4320 -3.1986 -3.1983 -2.4219 -2.4209 -2.2016 -2.1928 -2.0417 -2.0147 -1.9976 -1.9940 -0.5679 -0.5460 -0.4697 -0.4305 -0.3679 -0.3477 -0.2677 -0.2606 -0.0442 -0.0368 0.0198 0.0205 0.3111 0.3125 0.5354 0.5435 0.5442 0.5577 0.8775 0.8786 1.3739 1.3757 1.4763 1.4766 3.9916 3.9919 6.0288 6.0327 6.0383 6.0430 6.6501 6.6505 6.8760 6.8763 8.0183 8.0195 8.8445 8.8454 k = 0.1856 0.1915 0.1979 ( 8270 PWs) bands (ev): -17.0298 -17.0298 -16.2175 -16.2174 -16.1774 -16.1772 -13.0088 -13.0086 -12.9384 -12.9383 -12.8894 -12.8894 -12.8035 -12.8035 -11.3604 -11.3600 -11.3461 -11.3457 -6.3363 -6.3314 -6.3099 -6.3050 -6.0672 -6.0670 -5.4724 -5.4724 -3.9833 -3.9728 -3.9686 -3.9585 -3.4114 -3.4113 -3.1942 -3.1940 -2.4310 -2.4301 -2.2205 -2.2125 -2.0421 -2.0156 -1.9990 -1.9930 -0.5637 -0.5422 -0.4735 -0.4349 -0.3712 -0.3503 -0.2742 -0.2675 -0.0508 -0.0422 0.0065 0.0074 0.3191 0.3205 0.5389 0.5462 0.5472 0.5599 0.8767 0.8778 1.3864 1.3881 1.4874 1.4877 3.9941 3.9944 6.0287 6.0353 6.0383 6.0455 6.6539 6.6543 6.8732 6.8736 7.9730 7.9742 8.8319 8.8327 k = 0.1747 0.1803 0.1862 ( 8270 PWs) bands (ev): -17.0322 -17.0322 -16.2154 -16.2153 -16.1765 -16.1764 -13.0069 -13.0067 -12.9387 -12.9385 -12.8876 -12.8876 -12.8056 -12.8056 -11.3613 -11.3609 -11.3475 -11.3470 -6.3354 -6.3306 -6.3098 -6.3048 -6.0681 -6.0680 -5.4737 -5.4737 -3.9832 -3.9727 -3.9690 -3.9589 -3.3921 -3.3920 -3.1894 -3.1892 -2.4393 -2.4385 -2.2396 -2.2322 -2.0419 -2.0155 -1.9997 -1.9914 -0.5590 -0.5380 -0.4772 -0.4391 -0.3746 -0.3529 -0.2812 -0.2749 -0.0586 -0.0484 -0.0082 -0.0067 0.3287 0.3299 0.5425 0.5490 0.5503 0.5622 0.8760 0.8771 1.3989 1.4005 1.4979 1.4982 3.9965 3.9967 6.0288 6.0377 6.0385 6.0478 6.6579 6.6583 6.8701 6.8704 7.9254 7.9265 8.8180 8.8188 k = 0.1638 0.1690 0.1746 ( 8264 PWs) bands (ev): -17.0345 -17.0345 -16.2132 -16.2131 -16.1758 -16.1756 -13.0049 -13.0047 -12.9391 -12.9390 -12.8859 -12.8859 -12.8077 -12.8077 -11.3621 -11.3617 -11.3489 -11.3484 -6.3346 -6.3297 -6.3098 -6.3048 -6.0690 -6.0689 -5.4749 -5.4749 -3.9831 -3.9726 -3.9694 -3.9593 -3.3743 -3.3742 -3.1840 -3.1838 -2.4468 -2.4461 -2.2585 -2.2516 -2.0412 -2.0147 -1.9999 -1.9893 -0.5537 -0.5333 -0.4805 -0.4431 -0.3782 -0.3555 -0.2885 -0.2827 -0.0677 -0.0555 -0.0243 -0.0218 0.3396 0.3407 0.5460 0.5518 0.5533 0.5644 0.8753 0.8764 1.4112 1.4128 1.5078 1.5080 3.9988 3.9990 6.0290 6.0387 6.0399 6.0500 6.6622 6.6626 6.8664 6.8668 7.8759 7.8769 8.8031 8.8039 k = 0.1528 0.1577 0.1630 ( 8276 PWs) bands (ev): -17.0367 -17.0367 -16.2111 -16.2109 -16.1752 -16.1750 -13.0027 -13.0026 -12.9398 -12.9396 -12.8842 -12.8842 -12.8097 -12.8097 -11.3629 -11.3625 -11.3502 -11.3498 -6.3336 -6.3287 -6.3098 -6.3048 -6.0699 -6.0698 -5.4761 -5.4761 -3.9830 -3.9725 -3.9699 -3.9598 -3.3583 -3.3581 -3.1779 -3.1777 -2.4536 -2.4529 -2.2771 -2.2705 -2.0401 -2.0134 -1.9996 -1.9869 -0.5479 -0.5281 -0.4836 -0.4467 -0.3819 -0.3580 -0.2961 -0.2909 -0.0782 -0.0634 -0.0415 -0.0373 0.3519 0.3529 0.5496 0.5548 0.5563 0.5666 0.8746 0.8756 1.4234 1.4249 1.5169 1.5171 4.0010 4.0012 6.0294 6.0392 6.0420 6.0520 6.6669 6.6671 6.8623 6.8627 7.8252 7.8261 8.7872 8.7879 k = 0.1419 0.1465 0.1513 ( 8276 PWs) bands (ev): -17.0388 -17.0388 -16.2088 -16.2087 -16.1748 -16.1746 -13.0004 -13.0003 -12.9406 -12.9404 -12.8826 -12.8826 -12.8116 -12.8116 -11.3636 -11.3632 -11.3516 -11.3511 -6.3326 -6.3278 -6.3099 -6.3049 -6.0707 -6.0705 -5.4772 -5.4772 -3.9828 -3.9723 -3.9704 -3.9602 -3.3441 -3.3439 -3.1710 -3.1709 -2.4596 -2.4588 -2.2952 -2.2889 -2.0385 -2.0117 -1.9987 -1.9843 -0.5415 -0.5225 -0.4864 -0.4500 -0.3858 -0.3604 -0.3036 -0.2993 -0.0905 -0.0719 -0.0598 -0.0528 0.3652 0.3661 0.5532 0.5578 0.5591 0.5687 0.8739 0.8750 1.4354 1.4368 1.5253 1.5254 4.0031 4.0032 6.0300 6.0398 6.0438 6.0538 6.6717 6.6719 6.8578 6.8581 7.7740 7.7748 8.7707 8.7714 k = 0.1310 0.1352 0.1397 ( 8288 PWs) bands (ev): -17.0408 -17.0408 -16.2066 -16.2065 -16.1745 -16.1743 -12.9981 -12.9979 -12.9416 -12.9415 -12.8811 -12.8811 -12.8134 -12.8134 -11.3642 -11.3638 -11.3529 -11.3525 -6.3316 -6.3267 -6.3101 -6.3051 -6.0714 -6.0713 -5.4783 -5.4783 -3.9826 -3.9722 -3.9709 -3.9608 -3.3318 -3.3316 -3.1635 -3.1634 -2.4647 -2.4639 -2.3127 -2.3067 -2.0366 -2.0097 -1.9974 -1.9816 -0.5346 -0.5165 -0.4888 -0.4530 -0.3898 -0.3628 -0.3110 -0.3077 -0.1046 -0.0810 -0.0789 -0.0676 0.3792 0.3800 0.5568 0.5609 0.5619 0.5708 0.8733 0.8743 1.4471 1.4484 1.5328 1.5329 4.0050 4.0051 6.0307 6.0405 6.0454 6.0553 6.6769 6.6770 6.8527 6.8530 7.7230 7.7237 8.7539 8.7545 k = 0.1201 0.1239 0.1280 ( 8288 PWs) bands (ev): -17.0427 -17.0427 -16.2044 -16.2042 -16.1743 -16.1742 -12.9956 -12.9955 -12.9428 -12.9427 -12.8796 -12.8796 -12.8151 -12.8151 -11.3648 -11.3643 -11.3542 -11.3538 -6.3305 -6.3257 -6.3104 -6.3054 -6.0720 -6.0719 -5.4793 -5.4792 -3.9824 -3.9719 -3.9715 -3.9613 -3.3213 -3.3212 -3.1553 -3.1553 -2.4690 -2.4681 -2.3295 -2.3237 -2.0343 -2.0077 -1.9957 -1.9790 -0.5271 -0.5101 -0.4907 -0.4555 -0.3940 -0.3651 -0.3180 -0.3160 -0.1207 -0.0986 -0.0905 -0.0815 0.3937 0.3945 0.5603 0.5640 0.5646 0.5727 0.8727 0.8737 1.4585 1.4597 1.5394 1.5396 4.0067 4.0068 6.0316 6.0414 6.0468 6.0566 6.6823 6.6824 6.8471 6.8474 7.6729 7.6735 8.7372 8.7378 k = 0.1092 0.1127 0.1164 ( 8255 PWs) bands (ev): -17.0444 -17.0444 -16.2022 -16.2020 -16.1744 -16.1742 -12.9931 -12.9929 -12.9442 -12.9441 -12.8782 -12.8782 -12.8167 -12.8167 -11.3652 -11.3648 -11.3554 -11.3550 -6.3294 -6.3246 -6.3107 -6.3058 -6.0726 -6.0726 -5.4802 -5.4801 -3.9821 -3.9720 -3.9717 -3.9619 -3.3127 -3.3125 -3.1467 -3.1467 -2.4725 -2.4713 -2.3455 -2.3399 -2.0317 -2.0057 -1.9937 -1.9765 -0.5192 -0.5034 -0.4923 -0.4576 -0.3983 -0.3674 -0.3244 -0.3238 -0.1384 -0.1188 -0.1001 -0.0943 0.4083 0.4090 0.5640 0.5671 0.5672 0.5745 0.8722 0.8731 1.4696 1.4707 1.5452 1.5454 4.0083 4.0084 6.0326 6.0424 6.0479 6.0577 6.6881 6.6881 6.8410 6.8413 7.6244 7.6249 8.7210 8.7215 k = 0.0983 0.1014 0.1048 ( 8255 PWs) bands (ev): -17.0460 -17.0460 -16.2000 -16.1998 -16.1745 -16.1744 -12.9905 -12.9903 -12.9458 -12.9456 -12.8770 -12.8769 -12.8182 -12.8182 -11.3655 -11.3651 -11.3566 -11.3562 -6.3283 -6.3234 -6.3112 -6.3062 -6.0732 -6.0731 -5.4810 -5.4809 -3.9818 -3.9726 -3.9714 -3.9625 -3.3056 -3.3054 -3.1380 -3.1379 -2.4750 -2.4737 -2.3607 -2.3553 -2.0288 -2.0039 -1.9914 -1.9741 -0.5110 -0.4965 -0.4933 -0.4592 -0.4026 -0.3695 -0.3309 -0.3301 -0.1574 -0.1393 -0.1097 -0.1061 0.4226 0.4232 0.5676 0.5694 0.5704 0.5761 0.8716 0.8725 1.4803 1.4813 1.5500 1.5502 4.0098 4.0098 6.0337 6.0435 6.0487 6.0585 6.6941 6.6941 6.8345 6.8348 7.5781 7.5786 8.7056 8.7060 k = 0.0873 0.0901 0.0931 ( 8261 PWs) bands (ev): -17.0475 -17.0475 -16.1978 -16.1976 -16.1749 -16.1747 -12.9878 -12.9877 -12.9475 -12.9474 -12.8758 -12.8758 -12.8195 -12.8195 -11.3658 -11.3654 -11.3578 -11.3574 -6.3272 -6.3223 -6.3117 -6.3067 -6.0737 -6.0736 -5.4817 -5.4817 -3.9815 -3.9732 -3.9711 -3.9631 -3.2999 -3.2997 -3.1293 -3.1293 -2.4767 -2.4751 -2.3751 -2.3699 -2.0258 -2.0022 -1.9888 -1.9721 -0.5027 -0.4939 -0.4897 -0.4603 -0.4067 -0.3715 -0.3370 -0.3348 -0.1770 -0.1600 -0.1190 -0.1169 0.4362 0.4368 0.5712 0.5716 0.5737 0.5775 0.8711 0.8719 1.4905 1.4914 1.5539 1.5540 4.0111 4.0111 6.0350 6.0447 6.0493 6.0590 6.7004 6.7005 6.8275 6.8277 7.5349 7.5353 8.6912 8.6917 k = 0.0764 0.0789 0.0815 ( 8261 PWs) bands (ev): -17.0488 -17.0488 -16.1957 -16.1955 -16.1754 -16.1752 -12.9851 -12.9850 -12.9494 -12.9492 -12.8747 -12.8747 -12.8208 -12.8208 -11.3660 -11.3655 -11.3589 -11.3585 -6.3260 -6.3211 -6.3123 -6.3073 -6.0741 -6.0740 -5.4824 -5.4823 -3.9812 -3.9738 -3.9708 -3.9637 -3.2954 -3.2952 -3.1209 -3.1209 -2.4774 -2.4757 -2.3886 -2.3835 -2.0226 -2.0009 -1.9861 -1.9703 -0.4946 -0.4940 -0.4833 -0.4608 -0.4102 -0.3735 -0.3417 -0.3384 -0.1970 -0.1805 -0.1278 -0.1268 0.4488 0.4494 0.5736 0.5748 0.5769 0.5788 0.8707 0.8714 1.5001 1.5010 1.5568 1.5569 4.0122 4.0122 6.0363 6.0460 6.0497 6.0593 6.7071 6.7071 6.8201 6.8203 7.4952 7.4955 8.6782 8.6786 k = 0.0655 0.0676 0.0698 ( 8234 PWs) bands (ev): -17.0499 -17.0499 -16.1936 -16.1934 -16.1760 -16.1758 -12.9824 -12.9822 -12.9514 -12.9513 -12.8737 -12.8737 -12.8219 -12.8219 -11.3661 -11.3656 -11.3599 -11.3595 -6.3249 -6.3200 -6.3129 -6.3080 -6.0745 -6.0744 -5.4829 -5.4829 -3.9808 -3.9745 -3.9704 -3.9643 -3.2919 -3.2917 -3.1132 -3.1132 -2.4772 -2.4753 -2.4011 -2.3963 -2.0194 -1.9999 -1.9834 -1.9689 -0.4936 -0.4873 -0.4775 -0.4608 -0.4127 -0.3755 -0.3446 -0.3409 -0.2169 -0.2009 -0.1360 -0.1356 0.4601 0.4607 0.5754 0.5784 0.5799 0.5801 0.8702 0.8709 1.5093 1.5100 1.5587 1.5588 4.0132 4.0132 6.0377 6.0474 6.0498 6.0594 6.7141 6.7142 6.8124 6.8126 7.4596 7.4598 8.6667 8.6670 k = 0.0546 0.0563 0.0582 ( 8264 PWs) bands (ev): -17.0509 -17.0509 -16.1916 -16.1914 -16.1768 -16.1766 -12.9796 -12.9795 -12.9536 -12.9534 -12.8729 -12.8729 -12.8228 -12.8228 -11.3660 -11.3656 -11.3609 -11.3605 -6.3237 -6.3188 -6.3137 -6.3087 -6.0748 -6.0747 -5.4834 -5.4834 -3.9804 -3.9751 -3.9701 -3.9649 -3.2892 -3.2891 -3.1063 -3.1063 -2.4761 -2.4739 -2.4127 -2.4081 -2.0162 -1.9993 -1.9807 -1.9680 -0.4926 -0.4814 -0.4728 -0.4603 -0.4135 -0.3774 -0.3452 -0.3420 -0.2365 -0.2208 -0.1434 -0.1433 0.4699 0.4705 0.5770 0.5808 0.5818 0.5832 0.8699 0.8704 1.5177 1.5184 1.5595 1.5597 4.0140 4.0140 6.0391 6.0488 6.0496 6.0592 6.7214 6.7215 6.8043 6.8045 7.4286 7.4288 8.6567 8.6569 k = 0.0437 0.0451 0.0466 ( 8279 PWs) bands (ev): -17.0517 -17.0517 -16.1896 -16.1895 -16.1777 -16.1775 -12.9768 -12.9767 -12.9558 -12.9557 -12.8722 -12.8722 -12.8236 -12.8236 -11.3659 -11.3655 -11.3618 -11.3613 -6.3226 -6.3177 -6.3145 -6.3095 -6.0750 -6.0750 -5.4838 -5.4838 -3.9800 -3.9757 -3.9697 -3.9655 -3.2871 -3.2870 -3.1004 -3.1004 -2.4741 -2.4716 -2.4234 -2.4190 -2.0131 -1.9991 -1.9781 -1.9674 -0.4912 -0.4778 -0.4692 -0.4595 -0.4119 -0.3795 -0.3431 -0.3416 -0.2555 -0.2401 -0.1498 -0.1495 0.4780 0.4785 0.5784 0.5814 0.5850 0.5860 0.8695 0.8700 1.5256 1.5262 1.5594 1.5596 4.0147 4.0147 6.0405 6.0492 6.0502 6.0588 6.7290 6.7291 6.7961 6.7961 7.4026 7.4028 8.6484 8.6486 k = 0.0328 0.0338 0.0349 ( 8291 PWs) bands (ev): -17.0523 -17.0523 -16.1878 -16.1876 -16.1788 -16.1786 -12.9740 -12.9739 -12.9582 -12.9581 -12.8716 -12.8716 -12.8243 -12.8243 -11.3657 -11.3653 -11.3626 -11.3622 -6.3215 -6.3165 -6.3153 -6.3104 -6.0752 -6.0752 -5.4842 -5.4841 -3.9795 -3.9763 -3.9692 -3.9661 -3.2857 -3.2856 -3.0956 -3.0956 -2.4711 -2.4684 -2.4331 -2.4289 -2.0102 -1.9994 -1.9756 -1.9673 -0.4893 -0.4764 -0.4664 -0.4589 -0.4081 -0.3819 -0.3394 -0.3382 -0.2736 -0.2587 -0.1549 -0.1546 0.4844 0.4847 0.5796 0.5818 0.5877 0.5885 0.8693 0.8696 1.5327 1.5333 1.5583 1.5586 4.0152 4.0152 6.0419 6.0486 6.0516 6.0582 6.7369 6.7370 6.7876 6.7877 7.3821 7.3822 8.6420 8.6421 k = 0.0218 0.0225 0.0233 ( 8288 PWs) bands (ev): -17.0528 -17.0528 -16.1860 -16.1858 -16.1800 -16.1798 -12.9713 -12.9711 -12.9607 -12.9605 -12.8712 -12.8712 -12.8247 -12.8247 -11.3654 -11.3650 -11.3633 -11.3629 -6.3203 -6.3162 -6.3154 -6.3113 -6.0754 -6.0754 -5.4844 -5.4844 -3.9790 -3.9769 -3.9688 -3.9666 -3.2847 -3.2846 -3.0922 -3.0922 -2.4672 -2.4642 -2.4419 -2.4379 -2.0075 -2.0002 -1.9733 -1.9677 -0.4869 -0.4771 -0.4642 -0.4589 -0.4029 -0.3846 -0.3349 -0.3303 -0.2902 -0.2762 -0.1586 -0.1583 0.4889 0.4892 0.5805 0.5820 0.5898 0.5903 0.8691 0.8694 1.5391 1.5396 1.5563 1.5566 4.0156 4.0156 6.0433 6.0479 6.0530 6.0575 6.7450 6.7451 6.7791 6.7791 7.3672 7.3673 8.6373 8.6374 k = 0.0109 0.0113 0.0116 ( 8283 PWs) bands (ev): -17.0531 -17.0531 -16.1843 -16.1842 -16.1813 -16.1811 -12.9686 -12.9684 -12.9632 -12.9631 -12.8710 -12.8710 -12.8250 -12.8250 -11.3650 -11.3646 -11.3640 -11.3636 -6.3193 -6.3172 -6.3143 -6.3123 -6.0755 -6.0755 -5.4845 -5.4845 -3.9785 -3.9775 -3.9683 -3.9672 -3.2841 -3.2840 -3.0901 -3.0901 -2.4623 -2.4591 -2.4496 -2.4459 -2.0051 -2.0014 -1.9714 -1.9685 -0.4843 -0.4790 -0.4623 -0.4595 -0.3973 -0.3880 -0.3277 -0.3198 -0.3051 -0.2924 -0.1608 -0.1607 0.4916 0.4918 0.5812 0.5820 0.5912 0.5915 0.8691 0.8692 1.5447 1.5451 1.5533 1.5536 4.0158 4.0158 6.0446 6.0469 6.0543 6.0565 6.7534 6.7534 6.7704 6.7705 7.3582 7.3582 8.6345 8.6346 k = 0.0000 0.0000 0.0000 ( 8271 PWs) bands (ev): -17.0532 -17.0532 -16.1828 -16.1828 -16.1826 -16.1826 -12.9659 -12.9659 -12.9657 -12.9657 -12.8709 -12.8709 -12.8251 -12.8251 -11.3646 -11.3646 -11.3641 -11.3641 -6.3182 -6.3182 -6.3133 -6.3133 -6.0755 -6.0755 -5.4846 -5.4846 -3.9780 -3.9780 -3.9677 -3.9677 -3.2839 -3.2839 -3.0893 -3.0893 -2.4565 -2.4565 -2.4530 -2.4530 -2.0030 -2.0030 -1.9697 -1.9697 -0.4816 -0.4816 -0.4607 -0.4607 -0.3922 -0.3922 -0.3178 -0.3178 -0.3070 -0.3070 -0.1615 -0.1615 0.4926 0.4926 0.5817 0.5817 0.5918 0.5918 0.8691 0.8691 1.5495 1.5495 1.5498 1.5498 4.0159 4.0159 6.0458 6.0458 6.0555 6.0555 6.7619 6.7619 6.7619 6.7619 7.3552 7.3552 8.6336 8.6336 k = 0.0000 0.0000 0.0000 ( 8271 PWs) bands (ev): -17.0532 -17.0532 -16.1828 -16.1828 -16.1826 -16.1826 -12.9659 -12.9659 -12.9657 -12.9657 -12.8709 -12.8709 -12.8251 -12.8251 -11.3646 -11.3646 -11.3641 -11.3641 -6.3182 -6.3182 -6.3133 -6.3133 -6.0755 -6.0755 -5.4846 -5.4846 -3.9780 -3.9780 -3.9677 -3.9677 -3.2839 -3.2839 -3.0893 -3.0893 -2.4565 -2.4565 -2.4530 -2.4530 -2.0030 -2.0030 -1.9697 -1.9697 -0.4816 -0.4816 -0.4607 -0.4607 -0.3922 -0.3922 -0.3178 -0.3178 -0.3070 -0.3070 -0.1615 -0.1615 0.4926 0.4926 0.5817 0.5817 0.5918 0.5918 0.8691 0.8691 1.5495 1.5495 1.5498 1.5498 4.0159 4.0159 6.0458 6.0458 6.0555 6.0555 6.7619 6.7619 6.7619 6.7619 7.3552 7.3552 8.6336 8.6336 k = 0.0139-0.0135 0.0000 ( 8274 PWs) bands (ev): -17.0530 -17.0530 -16.1829 -16.1829 -16.1827 -16.1827 -12.9666 -12.9666 -12.9658 -12.9658 -12.8707 -12.8707 -12.8241 -12.8241 -11.3650 -11.3650 -11.3643 -11.3643 -6.3185 -6.3184 -6.3135 -6.3135 -6.0741 -6.0741 -5.4846 -5.4846 -3.9789 -3.9789 -3.9686 -3.9685 -3.2841 -3.2835 -3.0897 -3.0893 -2.4556 -2.4555 -2.4519 -2.4515 -2.0029 -2.0029 -1.9697 -1.9696 -0.4896 -0.4772 -0.4623 -0.4612 -0.4014 -0.3796 -0.3235 -0.3126 -0.3071 -0.3065 -0.1615 -0.1590 0.4910 0.4939 0.5795 0.5800 0.5890 0.5926 0.8709 0.8718 1.5484 1.5484 1.5491 1.5493 4.0182 4.0183 6.0444 6.0446 6.0544 6.0546 6.7605 6.7606 6.7620 6.7620 7.3576 7.3578 8.6358 8.6359 k = 0.0278-0.0269 0.0000 ( 8280 PWs) bands (ev): -17.0526 -17.0526 -16.1835 -16.1835 -16.1828 -16.1828 -12.9689 -12.9689 -12.9657 -12.9657 -12.8700 -12.8700 -12.8210 -12.8210 -11.3666 -11.3666 -11.3645 -11.3645 -6.3193 -6.3192 -6.3142 -6.3141 -6.0701 -6.0700 -5.4849 -5.4848 -3.9820 -3.9819 -3.9704 -3.9702 -3.2843 -3.2831 -3.0903 -3.0894 -2.4543 -2.4538 -2.4473 -2.4462 -2.0030 -2.0027 -1.9693 -1.9689 -0.5008 -0.4758 -0.4686 -0.4618 -0.4050 -0.3665 -0.3292 -0.3120 -0.3068 -0.3012 -0.1592 -0.1544 0.4889 0.4947 0.5718 0.5747 0.5856 0.5920 0.8771 0.8786 1.5448 1.5449 1.5475 1.5478 4.0252 4.0254 6.0383 6.0390 6.0532 6.0539 6.7565 6.7567 6.7624 6.7624 7.3650 7.3653 8.6423 8.6424 k = 0.0417-0.0404 0.0000 ( 8284 PWs) bands (ev): -17.0519 -17.0519 -16.1844 -16.1844 -16.1829 -16.1829 -12.9725 -12.9724 -12.9656 -12.9656 -12.8690 -12.8690 -12.8162 -12.8162 -11.3693 -11.3693 -11.3647 -11.3647 -6.3209 -6.3207 -6.3150 -6.3149 -6.0634 -6.0633 -5.4853 -5.4852 -3.9884 -3.9881 -3.9722 -3.9719 -3.2848 -3.2830 -3.0905 -3.0892 -2.4529 -2.4521 -2.4386 -2.4369 -2.0039 -2.0029 -1.9681 -1.9670 -0.5140 -0.4813 -0.4748 -0.4622 -0.4045 -0.3562 -0.3346 -0.3142 -0.3034 -0.2923 -0.1549 -0.1481 0.4859 0.4945 0.5596 0.5659 0.5820 0.5910 0.8868 0.8889 1.5388 1.5390 1.5449 1.5453 4.0369 4.0371 6.0262 6.0275 6.0535 6.0548 6.7500 6.7503 6.7630 6.7631 7.3772 7.3776 8.6530 8.6532 k = 0.0556-0.0538 0.0000 ( 8278 PWs) bands (ev): -17.0509 -17.0509 -16.1858 -16.1858 -16.1832 -16.1831 -12.9770 -12.9770 -12.9654 -12.9654 -12.8676 -12.8676 -12.8099 -12.8099 -11.3731 -11.3730 -11.3650 -11.3649 -6.3234 -6.3230 -6.3160 -6.3156 -6.0542 -6.0541 -5.4858 -5.4857 -3.9981 -3.9975 -3.9737 -3.9734 -3.2861 -3.2837 -3.0899 -3.0881 -2.4512 -2.4501 -2.4264 -2.4242 -2.0064 -2.0044 -1.9654 -1.9633 -0.5283 -0.4953 -0.4764 -0.4627 -0.4027 -0.3508 -0.3400 -0.3169 -0.2944 -0.2815 -0.1494 -0.1407 0.4814 0.4921 0.5453 0.5551 0.5782 0.5899 0.8993 0.9016 1.5306 1.5308 1.5413 1.5418 4.0529 4.0532 6.0088 6.0106 6.0550 6.0568 6.7412 6.7416 6.7639 6.7640 7.3941 7.3946 8.6676 8.6678 k = 0.0694-0.0673 0.0000 ( 8280 PWs) bands (ev): -17.0497 -17.0497 -16.1875 -16.1874 -16.1834 -16.1834 -12.9823 -12.9823 -12.9652 -12.9652 -12.8659 -12.8659 -12.8024 -12.8023 -11.3777 -11.3777 -11.3653 -11.3653 -6.3265 -6.3260 -6.3169 -6.3164 -6.0427 -6.0426 -5.4864 -5.4864 -4.0106 -4.0099 -3.9751 -3.9747 -3.2888 -3.2859 -3.0876 -3.0853 -2.4491 -2.4477 -2.4111 -2.4085 -2.0109 -2.0078 -1.9608 -1.9574 -0.5430 -0.5108 -0.4787 -0.4639 -0.4015 -0.3497 -0.3449 -0.3196 -0.2804 -0.2689 -0.1432 -0.1328 0.4741 0.4852 0.5320 0.5448 0.5741 0.5887 0.9135 0.9159 1.5202 1.5205 1.5367 1.5374 4.0732 4.0736 5.9867 5.9889 6.0573 6.0596 6.7305 6.7310 6.7650 6.7651 7.4154 7.4161 8.6856 8.6859 k = 0.0833-0.0807 0.0000 ( 8274 PWs) bands (ev): -17.0482 -17.0482 -16.1895 -16.1894 -16.1838 -16.1837 -12.9881 -12.9881 -12.9649 -12.9649 -12.8641 -12.8640 -12.7939 -12.7939 -11.3832 -11.3831 -11.3658 -11.3657 -6.3303 -6.3296 -6.3179 -6.3172 -6.0290 -6.0289 -5.4872 -5.4871 -4.0256 -4.0247 -3.9766 -3.9760 -3.2934 -3.2902 -3.0828 -3.0801 -2.4466 -2.4450 -2.3932 -2.3901 -2.0175 -2.0132 -1.9540 -1.9495 -0.5578 -0.5266 -0.4819 -0.4660 -0.4012 -0.3517 -0.3475 -0.3218 -0.2636 -0.2549 -0.1369 -0.1249 0.4629 0.4719 0.5218 0.5373 0.5701 0.5877 0.9287 0.9311 1.5078 1.5081 1.5311 1.5320 4.0974 4.0979 5.9603 5.9628 6.0602 6.0630 6.7182 6.7188 6.7663 6.7664 7.4409 7.4417 8.7066 8.7069 k = 0.0972-0.0942 0.0000 ( 8280 PWs) bands (ev): -17.0465 -17.0465 -16.1917 -16.1917 -16.1842 -16.1841 -12.9941 -12.9941 -12.9646 -12.9646 -12.8620 -12.8620 -12.7848 -12.7848 -11.3893 -11.3892 -11.3662 -11.3661 -6.3345 -6.3336 -6.3190 -6.3181 -6.0135 -6.0132 -5.4882 -5.4880 -4.0427 -4.0415 -3.9782 -3.9775 -3.3004 -3.2968 -3.0751 -3.0721 -2.4438 -2.4420 -2.3730 -2.3694 -2.0260 -2.0206 -1.9456 -1.9398 -0.5724 -0.5423 -0.4857 -0.4693 -0.4014 -0.3558 -0.3475 -0.3234 -0.2457 -0.2397 -0.1310 -0.1173 0.4476 0.4533 0.5146 0.5328 0.5667 0.5870 0.9443 0.9466 1.4935 1.4939 1.5246 1.5256 4.1252 4.1258 5.9299 5.9329 6.0637 6.0669 6.7047 6.7054 6.7678 6.7680 7.4703 7.4712 8.7300 8.7304 k = 0.1111-0.1077 0.0000 ( 8284 PWs) bands (ev): -17.0446 -17.0446 -16.1943 -16.1942 -16.1846 -16.1846 -13.0002 -13.0001 -12.9643 -12.9642 -12.8599 -12.8599 -12.7753 -12.7753 -11.3959 -11.3958 -11.3668 -11.3667 -6.3390 -6.3379 -6.3202 -6.3191 -5.9963 -5.9960 -5.4892 -5.4889 -4.0615 -4.0600 -3.9799 -3.9791 -3.3097 -3.3059 -3.0643 -3.0611 -2.4408 -2.4388 -2.3509 -2.3468 -2.0362 -2.0298 -1.9357 -1.9288 -0.5867 -0.5576 -0.4901 -0.4736 -0.4016 -0.3596 -0.3464 -0.3243 -0.2278 -0.2233 -0.1258 -0.1104 0.4291 0.4321 0.5091 0.5298 0.5644 0.5866 0.9599 0.9620 1.4775 1.4780 1.5171 1.5184 4.1562 4.1570 5.8961 5.8994 6.0678 6.0714 6.6903 6.6910 6.7694 6.7697 7.5033 7.5043 8.7553 8.7557 k = 0.1250-0.1211 0.0000 ( 8276 PWs) bands (ev): -17.0425 -17.0425 -16.1970 -16.1970 -16.1851 -16.1851 -13.0061 -13.0061 -12.9639 -12.9639 -12.8577 -12.8577 -12.7655 -12.7655 -11.4029 -11.4028 -11.3674 -11.3673 -6.3437 -6.3424 -6.3215 -6.3202 -5.9777 -5.9773 -5.4902 -5.4899 -4.0816 -4.0799 -3.9819 -3.9810 -3.3211 -3.3173 -3.0505 -3.0472 -2.4377 -2.4353 -2.3273 -2.3226 -2.0479 -2.0407 -1.9247 -1.9168 -0.6003 -0.5722 -0.4947 -0.4788 -0.4015 -0.3629 -0.3446 -0.3243 -0.2109 -0.2057 -0.1216 -0.1044 0.4086 0.4107 0.5043 0.5264 0.5637 0.5868 0.9751 0.9770 1.4601 1.4606 1.5088 1.5102 4.1900 4.1911 5.8593 5.8628 6.0722 6.0763 6.6755 6.6762 6.7713 6.7715 7.5397 7.5407 8.7817 8.7822 k = 0.1389-0.1346 0.0000 ( 8272 PWs) bands (ev): -17.0402 -17.0402 -16.2000 -16.1999 -16.1857 -16.1856 -13.0120 -13.0119 -12.9635 -12.9635 -12.8555 -12.8555 -12.7556 -12.7556 -11.4101 -11.4099 -11.3681 -11.3679 -6.3484 -6.3469 -6.3230 -6.3215 -5.9582 -5.9577 -5.4913 -5.4909 -4.1027 -4.1006 -3.9841 -3.9830 -3.3345 -3.3307 -3.0340 -3.0306 -2.4345 -2.4318 -2.3025 -2.2972 -2.0611 -2.0530 -1.9129 -1.9040 -0.6134 -0.5862 -0.4991 -0.4842 -0.4011 -0.3657 -0.3422 -0.3235 -0.1947 -0.1876 -0.1185 -0.0993 0.3871 0.3903 0.4996 0.5219 0.5648 0.5876 0.9896 0.9914 1.4414 1.4420 1.4995 1.5012 4.2262 4.2275 5.8198 5.8235 6.0771 6.0816 6.6605 6.6613 6.7732 6.7735 7.5792 7.5803 8.8087 8.8092 k = 0.1528-0.1480 0.0000 ( 8274 PWs) bands (ev): -17.0378 -17.0378 -16.2030 -16.2030 -16.1863 -16.1862 -13.0175 -13.0175 -12.9631 -12.9631 -12.8535 -12.8535 -12.7458 -12.7458 -11.4173 -11.4171 -11.3688 -11.3686 -6.3530 -6.3513 -6.3246 -6.3229 -5.9380 -5.9374 -5.4923 -5.4918 -4.1243 -4.1218 -3.9865 -3.9852 -3.3494 -3.3457 -3.0154 -3.0120 -2.4312 -2.4281 -2.2770 -2.2709 -2.0756 -2.0665 -1.9007 -1.8908 -0.6257 -0.5994 -0.5030 -0.4893 -0.4003 -0.3680 -0.3393 -0.3220 -0.1794 -0.1701 -0.1165 -0.0953 0.3666 0.3711 0.4947 0.5164 0.5671 0.5887 1.0032 1.0050 1.4218 1.4225 1.4895 1.4914 4.2642 4.2659 5.7783 5.7822 6.0822 6.0872 6.6457 6.6466 6.7752 6.7755 7.6215 7.6227 8.8355 8.8362 k = 0.1667-0.1615 0.0000 ( 8274 PWs) bands (ev): -17.0353 -17.0352 -16.2062 -16.2061 -16.1870 -16.1869 -13.0228 -13.0227 -12.9627 -12.9627 -12.8516 -12.8516 -12.7363 -12.7363 -11.4243 -11.4241 -11.3695 -11.3693 -6.3575 -6.3555 -6.3264 -6.3244 -5.9176 -5.9168 -5.4932 -5.4926 -4.1460 -4.1432 -3.9891 -3.9877 -3.3653 -3.3618 -2.9952 -2.9917 -2.4280 -2.4244 -2.2511 -2.2440 -2.0909 -2.0811 -1.8883 -1.8773 -0.6371 -0.6117 -0.5060 -0.4936 -0.3993 -0.3700 -0.3363 -0.3199 -0.1655 -0.1539 -0.1149 -0.0920 0.3479 0.3537 0.4895 0.5100 0.5701 0.5902 1.0158 1.0176 1.4016 1.4024 1.4787 1.4809 4.3036 4.3057 5.7352 5.7392 6.0874 6.0928 6.6314 6.6323 6.7773 6.7777 7.6664 7.6677 8.8616 8.8623 k = 0.1806-0.1750 0.0000 ( 8282 PWs) bands (ev): -17.0326 -17.0326 -16.2094 -16.2093 -16.1877 -16.1876 -13.0277 -13.0276 -12.9624 -12.9623 -12.8499 -12.8499 -12.7271 -12.7270 -11.4311 -11.4308 -11.3702 -11.3700 -6.3617 -6.3595 -6.3283 -6.3260 -5.8974 -5.8963 -5.4940 -5.4932 -4.1674 -4.1643 -3.9919 -3.9903 -3.3821 -3.3788 -2.9738 -2.9702 -2.4248 -2.4208 -2.2258 -2.2170 -2.1064 -2.0959 -1.8760 -1.8640 -0.6477 -0.6232 -0.5077 -0.4967 -0.3981 -0.3717 -0.3333 -0.3173 -0.1539 -0.1413 -0.1117 -0.0888 0.3317 0.3384 0.4839 0.5031 0.5733 0.5917 1.0272 1.0292 1.3810 1.3820 1.4672 1.4696 4.3438 4.3463 5.6912 5.6953 6.0927 6.0985 6.6179 6.6189 6.7795 6.7799 7.7138 7.7152 8.8862 8.8871 k = 0.1944-0.1884 0.0000 ( 8286 PWs) bands (ev): -17.0299 -17.0299 -16.2126 -16.2125 -16.1885 -16.1884 -13.0322 -13.0321 -12.9620 -12.9620 -12.8485 -12.8485 -12.7183 -12.7183 -11.4374 -11.4371 -11.3709 -11.3707 -6.3656 -6.3631 -6.3303 -6.3277 -5.8777 -5.8763 -5.4945 -5.4936 -4.1882 -4.1847 -3.9948 -3.9930 -3.3994 -3.3962 -2.9518 -2.9480 -2.4218 -2.4172 -2.2029 -2.1909 -2.1208 -2.1096 -1.8640 -1.8511 -0.6574 -0.6337 -0.5079 -0.4982 -0.3967 -0.3732 -0.3305 -0.3147 -0.1464 -0.1349 -0.1032 -0.0846 0.3184 0.3259 0.4779 0.4958 0.5762 0.5930 1.0372 1.0396 1.3605 1.3618 1.4551 1.4578 4.3842 4.3872 5.6468 5.6509 6.0980 6.1041 6.6054 6.6064 6.7817 6.7821 7.7634 7.7649 8.9088 8.9098 k = 0.2083-0.2019 0.0000 ( 8282 PWs) bands (ev): -17.0271 -17.0271 -16.2157 -16.2156 -16.1893 -16.1893 -13.0362 -13.0361 -12.9618 -12.9617 -12.8473 -12.8473 -12.7101 -12.7101 -11.4431 -11.4428 -11.3716 -11.3713 -6.3691 -6.3663 -6.3324 -6.3295 -5.8589 -5.8573 -5.4947 -5.4936 -4.2079 -4.2040 -3.9979 -3.9959 -3.4169 -3.4139 -2.9298 -2.9258 -2.4188 -2.4136 -2.1877 -2.1699 -2.1293 -2.1170 -1.8526 -1.8387 -0.6662 -0.6433 -0.5064 -0.4981 -0.3953 -0.3744 -0.3282 -0.3124 -0.1450 -0.1329 -0.0905 -0.0781 0.3083 0.3164 0.4715 0.4882 0.5785 0.5938 1.0460 1.0488 1.3402 1.3420 1.4425 1.4455 4.4240 4.4276 5.6029 5.6069 6.1030 6.1095 6.5940 6.5950 6.7840 6.7844 7.8151 7.8167 8.9287 8.9298 k = 0.2222-0.2153 0.0000 ( 8270 PWs) bands (ev): -17.0244 -17.0243 -16.2188 -16.2187 -16.1902 -16.1901 -13.0399 -13.0398 -12.9616 -12.9615 -12.8463 -12.8463 -12.7026 -12.7025 -11.4481 -11.4478 -11.3722 -11.3719 -6.3722 -6.3691 -6.3345 -6.3313 -5.8415 -5.8395 -5.4947 -5.4933 -4.2262 -4.2218 -4.0011 -3.9989 -3.4344 -3.4317 -2.9082 -2.9040 -2.4160 -2.4102 -2.1880 -2.1673 -2.1195 -2.1092 -1.8421 -1.8273 -0.6739 -0.6520 -0.5030 -0.4961 -0.3939 -0.3755 -0.3266 -0.3107 -0.1483 -0.1332 -0.0766 -0.0689 0.3015 0.3099 0.4648 0.4804 0.5799 0.5938 1.0533 1.0567 1.3208 1.3230 1.4294 1.4328 4.4626 4.4669 5.5602 5.5641 6.1076 6.1145 6.5839 6.5849 6.7863 6.7867 7.8687 7.8704 8.9453 8.9465 k = 0.2361-0.2288 0.0000 ( 8264 PWs) bands (ev): -17.0216 -17.0216 -16.2217 -16.2217 -16.1912 -16.1911 -13.0431 -13.0430 -12.9614 -12.9614 -12.8457 -12.8457 -12.6958 -12.6957 -11.4524 -11.4521 -11.3727 -11.3724 -6.3749 -6.3715 -6.3366 -6.3331 -5.8256 -5.8234 -5.4942 -5.4926 -4.2427 -4.2380 -4.0043 -4.0019 -3.4518 -3.4493 -2.8878 -2.8832 -2.4134 -2.4070 -2.1994 -2.1791 -2.0963 -2.0888 -1.8325 -1.8168 -0.6806 -0.6596 -0.4978 -0.4921 -0.3929 -0.3767 -0.3257 -0.3098 -0.1534 -0.1352 -0.0632 -0.0576 0.2979 0.3064 0.4576 0.4723 0.5802 0.5928 1.0593 1.0633 1.3023 1.3052 1.4159 1.4197 4.4991 4.5040 5.5197 5.5234 6.1118 6.1190 6.5751 6.5762 6.7886 6.7891 7.9240 7.9258 8.9582 8.9595 k = 0.2500-0.2422 0.0000 ( 8268 PWs) bands (ev): -17.0188 -17.0188 -16.2246 -16.2245 -16.1921 -16.1921 -13.0460 -13.0459 -12.9614 -12.9613 -12.8453 -12.8453 -12.6897 -12.6897 -11.4559 -11.4556 -11.3730 -11.3727 -6.3772 -6.3735 -6.3387 -6.3348 -5.8117 -5.8091 -5.4934 -5.4916 -4.2572 -4.2521 -4.0075 -4.0049 -3.4689 -3.4666 -2.8691 -2.8641 -2.4111 -2.4040 -2.2142 -2.1937 -2.0704 -2.0640 -1.8240 -1.8076 -0.6863 -0.6662 -0.4908 -0.4862 -0.3926 -0.3784 -0.3252 -0.3097 -0.1585 -0.1382 -0.0507 -0.0450 0.2972 0.3057 0.4500 0.4638 0.5791 0.5905 1.0639 1.0686 1.2852 1.2890 1.4023 1.4065 4.5325 4.5381 5.4824 5.4858 6.1154 6.1229 6.5678 6.5689 6.7910 6.7915 7.9810 7.9830 8.9669 8.9684 k = 0.2639-0.2557 0.0000 ( 8274 PWs) bands (ev): -17.0161 -17.0161 -16.2272 -16.2271 -16.1932 -16.1931 -13.0484 -13.0483 -12.9614 -12.9614 -12.8452 -12.8452 -12.6845 -12.6845 -11.4587 -11.4583 -11.3732 -11.3728 -6.3792 -6.3752 -6.3405 -6.3364 -5.7999 -5.7969 -5.4923 -5.4903 -4.2695 -4.2640 -4.0105 -4.0077 -3.4856 -3.4835 -2.8526 -2.8472 -2.4092 -2.4016 -2.2289 -2.2078 -2.0440 -2.0379 -1.8168 -1.7997 -0.6908 -0.6718 -0.4823 -0.4785 -0.3937 -0.3810 -0.3246 -0.3100 -0.1627 -0.1411 -0.0390 -0.0324 0.2990 0.3076 0.4418 0.4550 0.5764 0.5869 1.0671 1.0726 1.2698 1.2745 1.3885 1.3932 4.5619 4.5682 5.4492 5.4524 6.1184 6.1261 6.5618 6.5629 6.7934 6.7939 8.0394 8.0416 8.9712 8.9728 k = 0.2778-0.2692 0.0000 ( 8272 PWs) bands (ev): -17.0135 -17.0135 -16.2296 -16.2295 -16.1942 -16.1941 -13.0505 -13.0504 -12.9616 -12.9615 -12.8454 -12.8454 -12.6801 -12.6801 -11.4607 -11.4603 -11.3731 -11.3727 -6.3809 -6.3766 -6.3422 -6.3377 -5.7901 -5.7869 -5.4910 -5.4887 -4.2794 -4.2736 -4.0133 -4.0104 -3.5017 -3.4998 -2.8389 -2.8331 -2.4078 -2.3999 -2.2421 -2.2201 -2.0178 -2.0117 -1.8108 -1.7932 -0.6943 -0.6763 -0.4725 -0.4693 -0.3969 -0.3850 -0.3229 -0.3101 -0.1654 -0.1431 -0.0279 -0.0203 0.3030 0.3117 0.4331 0.4458 0.5722 0.5817 1.0692 1.0754 1.2562 1.2620 1.3748 1.3801 4.5862 4.5932 5.4215 5.4243 6.1206 6.1285 6.5572 6.5583 6.7958 6.7964 8.0992 8.1015 8.9710 8.9727 k = 0.2917-0.2826 0.0000 ( 8258 PWs) bands (ev): -17.0110 -17.0110 -16.2318 -16.2318 -16.1953 -16.1952 -13.0523 -13.0521 -12.9618 -12.9617 -12.8457 -12.8457 -12.6765 -12.6765 -11.4620 -11.4616 -11.3727 -11.3723 -6.3824 -6.3780 -6.3435 -6.3388 -5.7825 -5.7791 -5.4896 -5.4871 -4.2870 -4.2809 -4.0158 -4.0127 -3.5172 -3.5156 -2.8284 -2.8222 -2.4073 -2.3991 -2.2525 -2.2298 -1.9923 -1.9860 -1.8061 -1.7881 -0.6967 -0.6797 -0.4621 -0.4591 -0.4022 -0.3906 -0.3195 -0.3091 -0.1666 -0.1441 -0.0176 -0.0089 0.3085 0.3176 0.4237 0.4362 0.5664 0.5751 1.0701 1.0771 1.2444 1.2514 1.3614 1.3672 4.6046 4.6121 5.4001 5.4026 6.1219 6.1301 6.5540 6.5550 6.7983 6.7989 8.1601 8.1627 8.9663 8.9681 k = 0.3056-0.2961 0.0000 ( 8262 PWs) bands (ev): -17.0086 -17.0086 -16.2338 -16.2337 -16.1964 -16.1963 -13.0537 -13.0536 -12.9621 -12.9621 -12.8463 -12.8463 -12.6737 -12.6737 -11.4627 -11.4623 -11.3720 -11.3716 -6.3839 -6.3793 -6.3443 -6.3395 -5.7769 -5.7733 -5.4881 -5.4855 -4.2921 -4.2859 -4.0178 -4.0146 -3.5321 -3.5306 -2.8215 -2.8151 -2.4078 -2.3995 -2.2594 -2.2362 -1.9675 -1.9610 -1.8025 -1.7844 -0.6981 -0.6821 -0.4526 -0.4492 -0.4085 -0.3964 -0.3140 -0.3064 -0.1664 -0.1439 -0.0080 0.0016 0.3149 0.3248 0.4136 0.4263 0.5592 0.5671 1.0701 1.0777 1.2345 1.2427 1.3483 1.3547 4.6163 4.6242 5.3858 5.3881 6.1225 6.1307 6.5519 6.5529 6.8010 6.8015 8.2220 8.2248 8.9576 8.9593 k = 0.3194-0.3095 0.0000 ( 8264 PWs) bands (ev): -17.0064 -17.0063 -16.2356 -16.2355 -16.1975 -16.1975 -13.0549 -13.0548 -12.9625 -12.9624 -12.8470 -12.8469 -12.6717 -12.6716 -11.4630 -11.4626 -11.3709 -11.3705 -6.3853 -6.3807 -6.3446 -6.3398 -5.7732 -5.7695 -5.4867 -5.4841 -4.2952 -4.2887 -4.0193 -4.0159 -3.5461 -3.5448 -2.8182 -2.8117 -2.4095 -2.4012 -2.2625 -2.2390 -1.9439 -1.9370 -1.7999 -1.7818 -0.6985 -0.6836 -0.4480 -0.4421 -0.4125 -0.3988 -0.3066 -0.3017 -0.1651 -0.1426 0.0007 0.0112 0.3213 0.3329 0.4031 0.4165 0.5507 0.5578 1.0693 1.0774 1.2264 1.2358 1.3359 1.3429 4.6211 4.6293 5.3789 5.3811 6.1221 6.1304 6.5508 6.5518 6.8037 6.8043 8.2846 8.2876 8.9453 8.9470 k = 0.3333-0.3230 0.0000 ( 8260 PWs) bands (ev): -17.0042 -17.0042 -16.2371 -16.2370 -16.1987 -16.1986 -13.0559 -13.0558 -12.9629 -12.9628 -12.8478 -12.8478 -12.6703 -12.6702 -11.4629 -11.4625 -11.3695 -11.3691 -6.3868 -6.3824 -6.3443 -6.3396 -5.7711 -5.7674 -5.4856 -5.4829 -4.2963 -4.2898 -4.0201 -4.0166 -3.5593 -3.5582 -2.8184 -2.8120 -2.4121 -2.4040 -2.2618 -2.2385 -1.9216 -1.9142 -1.7981 -1.7803 -0.6980 -0.6843 -0.4519 -0.4436 -0.4085 -0.3934 -0.2975 -0.2951 -0.1628 -0.1403 0.0085 0.0200 0.3262 0.3407 0.3927 0.4080 0.5412 0.5477 1.0678 1.0763 1.2198 1.2302 1.3243 1.3318 4.6194 4.6277 5.3791 5.3813 6.1209 6.1292 6.5508 6.5517 6.8065 6.8071 8.3475 8.3509 8.9303 8.9319 k = 0.3472-0.3365 0.0000 ( 8258 PWs) bands (ev): -17.0023 -17.0022 -16.2383 -16.2383 -16.1998 -16.1997 -13.0568 -13.0567 -12.9633 -12.9632 -12.8487 -12.8486 -12.6695 -12.6694 -11.4625 -11.4622 -11.3676 -11.3672 -6.3884 -6.3842 -6.3434 -6.3390 -5.7704 -5.7667 -5.4846 -5.4819 -4.2957 -4.2894 -4.0200 -4.0166 -3.5716 -3.5706 -2.8219 -2.8157 -2.4155 -2.4076 -2.2579 -2.2350 -1.9010 -1.8930 -1.7967 -1.7796 -0.6968 -0.6843 -0.4612 -0.4525 -0.3979 -0.3823 -0.2881 -0.2860 -0.1599 -0.1371 0.0155 0.0279 0.3278 0.3456 0.3845 0.4023 0.5309 0.5370 1.0659 1.0745 1.2144 1.2256 1.3138 1.3218 4.6120 4.6202 5.3857 5.3879 6.1189 6.1271 6.5515 6.5524 6.8094 6.8100 8.4103 8.4140 8.9136 8.9152 k = 0.3611-0.3499 0.0000 ( 8258 PWs) bands (ev): -17.0004 -17.0004 -16.2394 -16.2393 -16.2009 -16.2009 -13.0575 -13.0574 -12.9636 -12.9636 -12.8496 -12.8496 -12.6691 -12.6691 -11.4621 -11.4617 -11.3654 -11.3650 -6.3901 -6.3863 -6.3420 -6.3380 -5.7708 -5.7672 -5.4839 -5.4813 -4.2940 -4.2878 -4.0191 -4.0157 -3.5829 -3.5822 -2.8282 -2.8224 -2.4192 -2.4116 -2.2514 -2.2293 -1.8825 -1.8737 -1.7952 -1.7792 -0.6951 -0.6837 -0.4725 -0.4640 -0.3851 -0.3690 -0.2785 -0.2747 -0.1565 -0.1331 0.0218 0.0350 0.3241 0.3429 0.3829 0.4013 0.5203 0.5262 1.0637 1.0722 1.2099 1.2217 1.3047 1.3130 4.6002 4.6080 5.3974 5.3998 6.1161 6.1242 6.5528 6.5536 6.8125 6.8130 8.4723 8.4762 8.8965 8.8980 k = 0.3750-0.3634 0.0000 ( 8250 PWs) bands (ev): -16.9988 -16.9988 -16.2402 -16.2401 -16.2020 -16.2019 -13.0581 -13.0580 -12.9639 -12.9639 -12.8505 -12.8505 -12.6692 -12.6692 -11.4616 -11.4612 -11.3629 -11.3625 -6.3918 -6.3884 -6.3403 -6.3367 -5.7721 -5.7687 -5.4835 -5.4810 -4.2914 -4.2855 -4.0173 -4.0140 -3.5933 -3.5927 -2.8366 -2.8313 -2.4230 -2.4158 -2.2432 -2.2221 -1.8667 -1.8569 -1.7930 -1.7788 -0.6930 -0.6827 -0.4839 -0.4758 -0.3719 -0.3552 -0.2683 -0.2626 -0.1525 -0.1282 0.0273 0.0413 0.3151 0.3318 0.3882 0.4050 0.5094 0.5157 1.0613 1.0695 1.2061 1.2180 1.2972 1.3055 4.5852 4.5926 5.4129 5.4154 6.1128 6.1205 6.5545 6.5553 6.8156 6.8161 8.5322 8.5364 8.8808 8.8822 k = 0.3889-0.3768 0.0000 ( 8246 PWs) bands (ev): -16.9973 -16.9973 -16.2408 -16.2408 -16.2031 -16.2030 -13.0587 -13.0586 -12.9642 -12.9641 -12.8515 -12.8515 -12.6697 -12.6696 -11.4611 -11.4608 -11.3602 -11.3598 -6.3936 -6.3906 -6.3383 -6.3352 -5.7740 -5.7708 -5.4833 -5.4810 -4.2883 -4.2828 -4.0147 -4.0116 -3.6027 -3.6022 -2.8464 -2.8417 -2.4265 -2.4199 -2.2340 -2.2142 -1.8540 -1.8430 -1.7894 -1.7775 -0.6907 -0.6816 -0.4947 -0.4870 -0.3588 -0.3420 -0.2577 -0.2506 -0.1478 -0.1226 0.0324 0.0471 0.3022 0.3164 0.3961 0.4117 0.4988 0.5059 1.0587 1.0665 1.2026 1.2141 1.2915 1.2995 4.5686 4.5753 5.4308 5.4334 6.1089 6.1163 6.5566 6.5573 6.8187 6.8192 8.5880 8.5923 8.8689 8.8702 k = 0.4028-0.3903 0.0000 ( 8248 PWs) bands (ev): -16.9960 -16.9960 -16.2413 -16.2412 -16.2041 -16.2040 -13.0593 -13.0592 -12.9643 -12.9643 -12.8524 -12.8524 -12.6703 -12.6702 -11.4607 -11.4604 -11.3573 -11.3570 -6.3954 -6.3928 -6.3362 -6.3335 -5.7763 -5.7733 -5.4833 -5.4812 -4.2851 -4.2801 -4.0114 -4.0085 -3.6111 -3.6107 -2.8570 -2.8530 -2.4297 -2.4237 -2.2244 -2.2063 -1.8449 -1.8330 -1.7838 -1.7748 -0.6884 -0.6805 -0.5043 -0.4972 -0.3463 -0.3297 -0.2474 -0.2394 -0.1422 -0.1163 0.0372 0.0524 0.2870 0.2991 0.4042 0.4196 0.4886 0.4972 1.0562 1.0634 1.1993 1.2101 1.2874 1.2948 4.5513 4.5574 5.4499 5.4525 6.1046 6.1116 6.5587 6.5594 6.8218 6.8223 8.6361 8.6402 8.8646 8.8659 k = 0.4167-0.4037 0.0000 ( 8254 PWs) bands (ev): -16.9949 -16.9949 -16.2416 -16.2416 -16.2050 -16.2049 -13.0598 -13.0597 -12.9644 -12.9644 -12.8533 -12.8532 -12.6710 -12.6710 -11.4604 -11.4601 -11.3545 -11.3543 -6.3970 -6.3949 -6.3341 -6.3318 -5.7786 -5.7761 -5.4833 -5.4815 -4.2819 -4.2775 -4.0076 -4.0050 -3.6184 -3.6181 -2.8678 -2.8643 -2.4325 -2.4272 -2.2150 -2.1987 -1.8391 -1.8269 -1.7766 -1.7702 -0.6864 -0.6796 -0.5126 -0.5061 -0.3344 -0.3187 -0.2380 -0.2296 -0.1356 -0.1095 0.0420 0.0574 0.2708 0.2810 0.4115 0.4276 0.4795 0.4901 1.0538 1.0603 1.1963 1.2059 1.2849 1.2914 4.5346 4.5399 5.4689 5.4715 6.1003 6.1066 6.5609 6.5614 6.8248 6.8253 8.6712 8.6747 8.8729 8.8744 k = 0.4306-0.4172 0.0000 ( 8254 PWs) bands (ev): -16.9939 -16.9939 -16.2418 -16.2418 -16.2058 -16.2058 -13.0602 -13.0602 -12.9644 -12.9644 -12.8540 -12.8540 -12.6718 -12.6718 -11.4601 -11.4599 -11.3519 -11.3516 -6.3986 -6.3968 -6.3321 -6.3303 -5.7810 -5.7788 -5.4835 -5.4819 -4.2791 -4.2753 -4.0035 -4.0013 -3.6246 -3.6244 -2.8779 -2.8751 -2.4348 -2.4303 -2.2062 -2.1921 -1.8357 -1.8241 -1.7687 -1.7644 -0.6846 -0.6790 -0.5192 -0.5135 -0.3235 -0.3091 -0.2301 -0.2218 -0.1278 -0.1026 0.0472 0.0623 0.2542 0.2627 0.4173 0.4342 0.4722 0.4846 1.0516 1.0572 1.1934 1.2016 1.2836 1.2891 4.5192 4.5238 5.4868 5.4893 6.0961 6.1016 6.5629 6.5634 6.8276 6.8280 8.6902 8.6928 8.8964 8.8986 k = 0.4444-0.4307 0.0000 ( 8236 PWs) bands (ev): -16.9931 -16.9931 -16.2419 -16.2419 -16.2065 -16.2065 -13.0606 -13.0606 -12.9644 -12.9643 -12.8547 -12.8547 -12.6726 -12.6726 -11.4599 -11.4597 -11.3495 -11.3493 -6.3998 -6.3985 -6.3303 -6.3289 -5.7831 -5.7813 -5.4836 -5.4823 -4.2766 -4.2735 -3.9995 -3.9977 -3.6297 -3.6296 -2.8870 -2.8848 -2.4366 -2.4330 -2.1983 -2.1866 -1.8336 -1.8235 -1.7611 -1.7583 -0.6831 -0.6786 -0.5243 -0.5195 -0.3137 -0.3011 -0.2239 -0.2162 -0.1191 -0.0963 0.0531 0.0670 0.2383 0.2450 0.4215 0.4380 0.4680 0.4809 1.0498 1.0544 1.1910 1.1976 1.2832 1.2876 4.5059 4.5096 5.5029 5.5051 6.0922 6.0969 6.5647 6.5651 6.8301 6.8304 8.6964 8.6982 8.9307 8.9335 k = 0.4583-0.4441 0.0000 ( 8236 PWs) bands (ev): -16.9925 -16.9925 -16.2420 -16.2420 -16.2071 -16.2071 -13.0610 -13.0609 -12.9643 -12.9643 -12.8552 -12.8552 -12.6733 -12.6732 -11.4598 -11.4597 -11.3475 -11.3474 -6.4009 -6.3999 -6.3288 -6.3277 -5.7848 -5.7835 -5.4837 -5.4827 -4.2746 -4.2722 -3.9959 -3.9946 -3.6337 -3.6336 -2.8945 -2.8929 -2.4380 -2.4352 -2.1916 -2.1826 -1.8322 -1.8241 -1.7546 -1.7528 -0.6819 -0.6786 -0.5279 -0.5242 -0.3052 -0.2950 -0.2192 -0.2128 -0.1102 -0.0914 0.0596 0.0714 0.2239 0.2288 0.4243 0.4380 0.4677 0.4788 1.0484 1.0519 1.1890 1.1941 1.2834 1.2866 4.4951 4.4979 5.5163 5.5181 6.0890 6.0927 6.5662 6.5665 6.8322 6.8324 8.6960 8.6972 8.9679 8.9707 k = 0.4722-0.4576 0.0000 ( 8240 PWs) bands (ev): -16.9921 -16.9921 -16.2420 -16.2420 -16.2075 -16.2075 -13.0612 -13.0612 -12.9642 -12.9642 -12.8556 -12.8556 -12.6738 -12.6738 -11.4597 -11.4596 -11.3460 -11.3459 -6.4016 -6.4009 -6.3277 -6.3269 -5.7861 -5.7852 -5.4838 -5.4831 -4.2730 -4.2714 -3.9931 -3.9921 -3.6366 -3.6365 -2.9001 -2.8990 -2.4388 -2.4369 -2.1862 -2.1800 -1.8309 -1.8254 -1.7497 -1.7487 -0.6810 -0.6788 -0.5302 -0.5276 -0.2982 -0.2910 -0.2158 -0.2112 -0.1020 -0.0885 0.0663 0.0750 0.2121 0.2152 0.4262 0.4356 0.4699 0.4775 1.0475 1.0499 1.1878 1.1912 1.2838 1.2859 4.4873 4.4892 5.5264 5.5277 6.0867 6.0892 6.5673 6.5675 6.8337 6.8339 8.6936 8.6943 9.0008 9.0032 k = 0.4861-0.4710 0.0000 ( 8238 PWs) bands (ev): -16.9919 -16.9919 -16.2420 -16.2420 -16.2078 -16.2078 -13.0614 -13.0614 -12.9642 -12.9641 -12.8559 -12.8559 -12.6741 -12.6741 -11.4596 -11.4596 -11.3450 -11.3450 -6.4020 -6.4017 -6.3269 -6.3265 -5.7868 -5.7863 -5.4838 -5.4834 -4.2719 -4.2711 -3.9911 -3.9907 -3.6383 -3.6383 -2.9034 -2.9029 -2.4391 -2.4382 -2.1822 -2.1791 -1.8297 -1.8268 -1.7466 -1.7461 -0.6802 -0.6791 -0.5312 -0.5299 -0.2930 -0.2893 -0.2134 -0.2110 -0.0952 -0.0882 0.0723 0.0769 0.2043 0.2058 0.4279 0.4326 0.4725 0.4763 1.0472 1.0484 1.1873 1.1890 1.2843 1.2854 4.4827 4.4836 5.5328 5.5335 6.0855 6.0868 6.5680 6.5681 6.8347 6.8348 8.6915 8.6918 9.0238 9.0252 k = 0.5000-0.4845 0.0000 ( 8240 PWs) bands (ev): -16.9918 -16.9918 -16.2420 -16.2420 -16.2079 -16.2079 -13.0614 -13.0614 -12.9641 -12.9641 -12.8559 -12.8559 -12.6742 -12.6742 -11.4596 -11.4596 -11.3447 -11.3447 -6.4020 -6.4020 -6.3265 -6.3265 -5.7869 -5.7869 -5.4836 -5.4836 -4.2713 -4.2713 -3.9903 -3.9903 -3.6389 -3.6389 -2.9044 -2.9044 -2.4389 -2.4389 -2.1799 -2.1799 -1.8283 -1.8283 -1.7454 -1.7454 -0.6796 -0.6796 -0.5310 -0.5310 -0.2900 -0.2900 -0.2118 -0.2118 -0.0904 -0.0904 0.0761 0.0761 0.2020 0.2020 0.4300 0.4300 0.4748 0.4748 1.0475 1.0475 1.1877 1.1877 1.2849 1.2849 4.4814 4.4814 5.5352 5.5352 6.0855 6.0855 6.5683 6.5683 6.8351 6.8351 8.6908 8.6908 9.0325 9.0325 k = 0.5000-0.4845 0.0000 ( 8240 PWs) bands (ev): -16.9918 -16.9918 -16.2420 -16.2420 -16.2079 -16.2079 -13.0614 -13.0614 -12.9641 -12.9641 -12.8559 -12.8559 -12.6742 -12.6742 -11.4596 -11.4596 -11.3447 -11.3447 -6.4020 -6.4020 -6.3265 -6.3265 -5.7869 -5.7869 -5.4836 -5.4836 -4.2713 -4.2713 -3.9903 -3.9903 -3.6389 -3.6389 -2.9044 -2.9044 -2.4389 -2.4389 -2.1799 -2.1799 -1.8283 -1.8283 -1.7454 -1.7454 -0.6796 -0.6796 -0.5310 -0.5310 -0.2900 -0.2900 -0.2118 -0.2118 -0.0904 -0.0904 0.0761 0.0761 0.2020 0.2020 0.4300 0.4300 0.4748 0.4748 1.0475 1.0475 1.1877 1.1877 1.2849 1.2849 4.4814 4.4814 5.5352 5.5352 6.0855 6.0855 6.5683 6.5683 6.8351 6.8351 8.6908 8.6908 9.0325 9.0325 k = 0.5006-0.4839-0.0194 ( 8238 PWs) bands (ev): -16.9917 -16.9917 -16.2420 -16.2420 -16.2079 -16.2079 -13.0613 -13.0613 -12.9642 -12.9642 -12.8562 -12.8562 -12.6745 -12.6745 -11.4591 -11.4591 -11.3446 -11.3446 -6.4018 -6.4017 -6.3265 -6.3264 -5.7880 -5.7880 -5.4835 -5.4834 -4.2701 -4.2699 -3.9903 -3.9902 -3.6404 -3.6401 -2.9064 -2.9062 -2.4376 -2.4366 -2.1786 -2.1778 -1.8306 -1.8290 -1.7457 -1.7441 -0.6800 -0.6780 -0.5319 -0.5295 -0.2910 -0.2890 -0.2137 -0.2098 -0.0910 -0.0894 0.0741 0.0774 0.2018 0.2038 0.4295 0.4303 0.4745 0.4750 1.0468 1.0474 1.1872 1.1878 1.2845 1.2847 4.4784 4.4785 5.5380 5.5381 6.0852 6.0852 6.5688 6.5689 6.8350 6.8351 8.6878 8.6882 9.0338 9.0344 k = 0.5012-0.4832-0.0387 ( 8235 PWs) bands (ev): -16.9915 -16.9915 -16.2419 -16.2419 -16.2081 -16.2081 -13.0607 -13.0607 -12.9646 -12.9645 -12.8569 -12.8569 -12.6754 -12.6754 -11.4575 -11.4575 -11.3444 -11.3444 -6.4010 -6.4009 -6.3265 -6.3264 -5.7915 -5.7914 -5.4829 -5.4829 -4.2662 -4.2659 -3.9902 -3.9901 -3.6447 -3.6440 -2.9122 -2.9119 -2.4327 -2.4308 -2.1739 -2.1725 -1.8356 -1.8327 -1.7452 -1.7422 -0.6792 -0.6752 -0.5320 -0.5272 -0.2918 -0.2880 -0.2154 -0.2078 -0.0912 -0.0879 0.0716 0.0782 0.2031 0.2070 0.4289 0.4304 0.4742 0.4753 1.0453 1.0466 1.1862 1.1875 1.2834 1.2838 4.4695 4.4696 5.5461 5.5464 6.0841 6.0842 6.5705 6.5708 6.8347 6.8349 8.6797 8.6805 9.0381 9.0392 k = 0.5018-0.4826-0.0581 ( 8232 PWs) bands (ev): -16.9913 -16.9913 -16.2419 -16.2418 -16.2084 -16.2083 -13.0598 -13.0598 -12.9651 -12.9651 -12.8582 -12.8582 -12.6770 -12.6770 -11.4548 -11.4548 -11.3441 -11.3441 -6.3998 -6.3996 -6.3266 -6.3264 -5.7971 -5.7970 -5.4821 -5.4820 -4.2599 -4.2595 -3.9899 -3.9898 -3.6515 -3.6505 -2.9215 -2.9210 -2.4244 -2.4217 -2.1662 -2.1642 -1.8430 -1.8391 -1.7438 -1.7399 -0.6772 -0.6712 -0.5315 -0.5243 -0.2924 -0.2870 -0.2169 -0.2057 -0.0910 -0.0859 0.0688 0.0783 0.2060 0.2116 0.4282 0.4304 0.4740 0.4755 1.0431 1.0450 1.1849 1.1868 1.2817 1.2823 4.4551 4.4553 5.5594 5.5597 6.0824 6.0825 6.5734 6.5738 6.8343 6.8346 8.6669 8.6680 9.0448 9.0465 k = 0.5024-0.4820-0.0775 ( 8239 PWs) bands (ev): -16.9909 -16.9909 -16.2417 -16.2417 -16.2087 -16.2087 -13.0585 -13.0585 -12.9658 -12.9658 -12.8599 -12.8599 -12.6791 -12.6791 -11.4511 -11.4511 -11.3436 -11.3436 -6.3980 -6.3978 -6.3266 -6.3263 -5.8048 -5.8047 -5.4808 -5.4807 -4.2512 -4.2506 -3.9896 -3.9894 -3.6607 -3.6593 -2.9340 -2.9334 -2.4130 -2.4095 -2.1557 -2.1532 -1.8524 -1.8477 -1.7421 -1.7375 -0.6741 -0.6661 -0.5302 -0.5207 -0.2929 -0.2861 -0.2183 -0.2038 -0.0906 -0.0836 0.0656 0.0777 0.2105 0.2174 0.4271 0.4302 0.4738 0.4759 1.0401 1.0425 1.1832 1.1857 1.2794 1.2802 4.4358 4.4360 5.5771 5.5775 6.0800 6.0801 6.5775 6.5780 6.8338 6.8342 8.6501 8.6515 9.0535 9.0557 k = 0.5031-0.4813-0.0968 ( 8237 PWs) bands (ev): -16.9904 -16.9904 -16.2416 -16.2415 -16.2092 -16.2092 -13.0569 -13.0569 -12.9667 -12.9667 -12.8621 -12.8620 -12.6817 -12.6817 -11.4466 -11.4466 -11.3430 -11.3430 -6.3958 -6.3955 -6.3267 -6.3263 -5.8144 -5.8143 -5.4793 -5.4792 -4.2404 -4.2397 -3.9891 -3.9889 -3.6719 -3.6703 -2.9492 -2.9486 -2.3987 -2.3946 -2.1426 -2.1399 -1.8634 -1.8582 -1.7401 -1.7352 -0.6698 -0.6600 -0.5281 -0.5163 -0.2930 -0.2851 -0.2195 -0.2021 -0.0899 -0.0811 0.0621 0.0766 0.2166 0.2244 0.4257 0.4296 0.4736 0.4763 1.0364 1.0393 1.1814 1.1843 1.2766 1.2775 4.4122 4.4125 5.5985 5.5991 6.0771 6.0772 6.5826 6.5832 6.8331 6.8336 8.6301 8.6318 9.0635 9.0660 k = 0.5037-0.4807-0.1162 ( 8243 PWs) bands (ev): -16.9898 -16.9898 -16.2414 -16.2413 -16.2098 -16.2097 -13.0549 -13.0549 -12.9678 -12.9677 -12.8646 -12.8646 -12.6848 -12.6848 -11.4411 -11.4411 -11.3423 -11.3423 -6.3931 -6.3927 -6.3267 -6.3263 -5.8257 -5.8255 -5.4775 -5.4773 -4.2276 -4.2267 -3.9886 -3.9883 -3.6850 -3.6831 -2.9668 -2.9661 -2.3821 -2.3774 -2.1275 -2.1247 -1.8756 -1.8702 -1.7382 -1.7331 -0.6645 -0.6529 -0.5253 -0.5113 -0.2929 -0.2842 -0.2206 -0.2007 -0.0892 -0.0784 0.0584 0.0749 0.2240 0.2324 0.4238 0.4286 0.4737 0.4770 1.0320 1.0352 1.1794 1.1827 1.2733 1.2743 4.3853 4.3856 5.6231 5.6238 6.0737 6.0738 6.5887 6.5894 6.8323 6.8329 8.6078 8.6096 9.0742 9.0771 k = 0.5043-0.4801-0.1356 ( 8235 PWs) bands (ev): -16.9891 -16.9891 -16.2411 -16.2411 -16.2104 -16.2104 -13.0527 -13.0526 -12.9690 -12.9689 -12.8676 -12.8676 -12.6884 -12.6884 -11.4350 -11.4349 -11.3415 -11.3415 -6.3901 -6.3896 -6.3268 -6.3263 -5.8383 -5.8381 -5.4754 -5.4752 -4.2131 -4.2121 -3.9879 -3.9876 -3.6996 -3.6974 -2.9861 -2.9854 -2.3636 -2.3585 -2.1107 -2.1080 -1.8888 -1.8831 -1.7364 -1.7312 -0.6582 -0.6448 -0.5217 -0.5056 -0.2924 -0.2833 -0.2216 -0.1996 -0.0884 -0.0758 0.0545 0.0727 0.2327 0.2412 0.4215 0.4271 0.4742 0.4779 1.0268 1.0304 1.1775 1.1811 1.2694 1.2706 4.3556 4.3559 5.6499 5.6507 6.0698 6.0700 6.5957 6.5965 6.8315 6.8321 8.5836 8.5856 9.0853 9.0885 k = 0.5049-0.4794-0.1550 ( 8239 PWs) bands (ev): -16.9884 -16.9884 -16.2408 -16.2408 -16.2112 -16.2111 -13.0501 -13.0501 -12.9703 -12.9703 -12.8710 -12.8710 -12.6923 -12.6923 -11.4281 -11.4281 -11.3406 -11.3406 -6.3867 -6.3861 -6.3268 -6.3262 -5.8521 -5.8519 -5.4731 -5.4729 -4.1973 -4.1961 -3.9871 -3.9867 -3.7153 -3.7129 -3.0068 -3.0061 -2.3437 -2.3383 -2.0929 -2.0901 -1.9025 -1.8965 -1.7347 -1.7297 -0.6510 -0.6360 -0.5173 -0.4992 -0.2916 -0.2824 -0.2224 -0.1989 -0.0879 -0.0734 0.0505 0.0700 0.2423 0.2506 0.4188 0.4251 0.4750 0.4791 1.0209 1.0246 1.1757 1.1795 1.2652 1.2665 4.3240 4.3243 5.6784 5.6793 6.0656 6.0658 6.6035 6.6043 6.8305 6.8312 8.5582 8.5603 9.0964 9.0998 k = 0.5055-0.4788-0.1743 ( 8241 PWs) bands (ev): -16.9876 -16.9876 -16.2405 -16.2405 -16.2120 -16.2119 -13.0473 -13.0472 -12.9717 -12.9717 -12.8746 -12.8746 -12.6966 -12.6966 -11.4208 -11.4208 -11.3397 -11.3397 -6.3830 -6.3823 -6.3269 -6.3262 -5.8668 -5.8666 -5.4706 -5.4704 -4.1803 -4.1790 -3.9863 -3.9858 -3.7319 -3.7293 -3.0285 -3.0278 -2.3230 -2.3173 -2.0748 -2.0713 -1.9164 -1.9098 -1.7333 -1.7285 -0.6430 -0.6264 -0.5123 -0.4921 -0.2906 -0.2815 -0.2229 -0.1985 -0.0876 -0.0714 0.0463 0.0669 0.2525 0.2603 0.4158 0.4228 0.4763 0.4807 1.0142 1.0181 1.1741 1.1780 1.2606 1.2620 4.2910 4.2914 5.7078 5.7088 6.0612 6.0613 6.6121 6.6129 6.8295 6.8302 8.5320 8.5343 9.1074 9.1109 k = 0.5061-0.4782-0.1937 ( 8247 PWs) bands (ev): -16.9867 -16.9867 -16.2402 -16.2401 -16.2129 -16.2128 -13.0442 -13.0441 -12.9732 -12.9731 -12.8786 -12.8786 -12.7011 -12.7011 -11.4130 -11.4130 -11.3387 -11.3386 -6.3790 -6.3782 -6.3270 -6.3262 -5.8821 -5.8819 -5.4680 -5.4678 -4.1626 -4.1611 -3.9853 -3.9848 -3.7490 -3.7462 -3.0507 -3.0500 -2.3020 -2.2960 -2.0575 -2.0521 -1.9299 -1.9220 -1.7321 -1.7275 -0.6342 -0.6162 -0.5065 -0.4845 -0.2892 -0.2804 -0.2233 -0.1983 -0.0876 -0.0699 0.0420 0.0633 0.2629 0.2698 0.4128 0.4203 0.4781 0.4827 1.0069 1.0107 1.1728 1.1767 1.2557 1.2571 4.2574 4.2577 5.7376 5.7387 6.0566 6.0567 6.6212 6.6221 6.8284 6.8292 8.5055 8.5078 9.1179 9.1215 k = 0.5067-0.4776-0.2131 ( 8238 PWs) bands (ev): -16.9858 -16.9858 -16.2399 -16.2398 -16.2138 -16.2137 -13.0409 -13.0408 -12.9747 -12.9746 -12.8827 -12.8827 -12.7059 -12.7058 -11.4050 -11.4049 -11.3376 -11.3376 -6.3748 -6.3740 -6.3271 -6.3262 -5.8978 -5.8976 -5.4653 -5.4651 -4.1443 -4.1426 -3.9842 -3.9836 -3.7664 -3.7633 -3.0731 -3.0724 -2.2813 -2.2749 -2.0428 -2.0333 -1.9420 -1.9313 -1.7311 -1.7267 -0.6249 -0.6054 -0.5002 -0.4763 -0.2878 -0.2791 -0.2233 -0.1983 -0.0881 -0.0693 0.0376 0.0592 0.2726 0.2784 0.4103 0.4184 0.4805 0.4850 0.9988 1.0026 1.1719 1.1758 1.2505 1.2520 4.2236 4.2240 5.7673 5.7685 6.0519 6.0520 6.6309 6.6318 6.8272 6.8280 8.4790 8.4813 9.1278 9.1315 k = 0.5073-0.4769-0.2324 ( 8246 PWs) bands (ev): -16.9849 -16.9849 -16.2395 -16.2394 -16.2148 -16.2147 -13.0374 -13.0373 -12.9762 -12.9762 -12.8870 -12.8870 -12.7107 -12.7107 -11.3968 -11.3967 -11.3365 -11.3365 -6.3706 -6.3696 -6.3273 -6.3262 -5.9135 -5.9133 -5.4626 -5.4624 -4.1258 -4.1240 -3.9831 -3.9824 -3.7838 -3.7805 -3.0953 -3.0947 -2.2612 -2.2545 -2.0332 -2.0180 -1.9500 -1.9349 -1.7302 -1.7261 -0.6150 -0.5942 -0.4934 -0.4676 -0.2863 -0.2775 -0.2229 -0.1983 -0.0891 -0.0695 0.0329 0.0546 0.2807 0.2853 0.4091 0.4179 0.4833 0.4878 0.9902 0.9938 1.1713 1.1752 1.2452 1.2468 4.1901 4.1905 5.7964 5.7977 6.0471 6.0474 6.6409 6.6418 6.8260 6.8267 8.4529 8.4552 9.1368 9.1404 k = 0.5079-0.4763-0.2518 ( 8248 PWs) bands (ev): -16.9839 -16.9839 -16.2391 -16.2390 -16.2159 -16.2157 -13.0338 -13.0337 -12.9777 -12.9777 -12.8915 -12.8915 -12.7156 -12.7156 -11.3886 -11.3885 -11.3354 -11.3354 -6.3662 -6.3651 -6.3274 -6.3263 -5.9290 -5.9289 -5.4598 -5.4597 -4.1073 -4.1053 -3.9818 -3.9811 -3.8009 -3.7975 -3.1171 -3.1165 -2.2422 -2.2349 -2.0311 -2.0113 -1.9486 -1.9304 -1.7295 -1.7257 -0.6048 -0.5827 -0.4862 -0.4587 -0.2850 -0.2753 -0.2220 -0.1983 -0.0907 -0.0707 0.0281 0.0494 0.2859 0.2899 0.4102 0.4196 0.4866 0.4908 0.9809 0.9844 1.1712 1.1749 1.2398 1.2414 4.1574 4.1578 5.8246 5.8260 6.0425 6.0428 6.6512 6.6520 6.8246 6.8254 8.4274 8.4297 9.1448 9.1483 k = 0.5086-0.4757-0.2712 ( 8240 PWs) bands (ev): -16.9829 -16.9829 -16.2387 -16.2385 -16.2169 -16.2168 -13.0301 -13.0300 -12.9792 -12.9791 -12.8960 -12.8959 -12.7205 -12.7204 -11.3804 -11.3804 -11.3343 -11.3343 -6.3619 -6.3606 -6.3276 -6.3263 -5.9442 -5.9440 -5.4572 -5.4570 -4.0892 -4.0871 -3.9806 -3.9797 -3.8175 -3.8139 -3.1382 -3.1377 -2.2247 -2.2167 -2.0358 -2.0153 -1.9358 -1.9183 -1.7289 -1.7254 -0.5942 -0.5710 -0.4789 -0.4496 -0.2838 -0.2727 -0.2207 -0.1981 -0.0928 -0.0729 0.0229 0.0436 0.2874 0.2916 0.4143 0.4242 0.4902 0.4942 0.9712 0.9744 1.1715 1.1750 1.2344 1.2360 4.1259 4.1262 5.8516 5.8531 6.0379 6.0384 6.6616 6.6624 6.8232 6.8239 8.4029 8.4051 9.1515 9.1549 k = 0.5092-0.4750-0.2905 ( 8247 PWs) bands (ev): -16.9820 -16.9820 -16.2382 -16.2381 -16.2180 -16.2179 -13.0263 -13.0262 -12.9806 -12.9805 -12.9004 -12.9004 -12.7252 -12.7252 -11.3726 -11.3725 -11.3333 -11.3332 -6.3577 -6.3562 -6.3278 -6.3263 -5.9587 -5.9585 -5.4546 -5.4544 -4.0716 -4.0693 -3.9792 -3.9783 -3.8336 -3.8298 -3.1584 -3.1579 -2.2087 -2.1998 -2.0447 -2.0248 -1.9169 -1.9015 -1.7284 -1.7251 -0.5834 -0.5591 -0.4716 -0.4405 -0.2826 -0.2695 -0.2188 -0.1976 -0.0955 -0.0760 0.0175 0.0370 0.2853 0.2900 0.4217 0.4317 0.4940 0.4977 0.9611 0.9640 1.1721 1.1755 1.2290 1.2307 4.0959 4.0962 5.8770 5.8786 6.0336 6.0343 6.6721 6.6728 6.8216 6.8222 8.3796 8.3817 9.1568 9.1600 k = 0.5098-0.4744-0.3099 ( 8247 PWs) bands (ev): -16.9810 -16.9810 -16.2377 -16.2376 -16.2191 -16.2190 -13.0226 -13.0225 -12.9819 -12.9818 -12.9048 -12.9048 -12.7298 -12.7298 -11.3650 -11.3650 -11.3322 -11.3322 -6.3536 -6.3519 -6.3280 -6.3263 -5.9724 -5.9722 -5.4521 -5.4520 -4.0549 -4.0524 -3.9779 -3.9768 -3.8487 -3.8448 -3.1774 -3.1770 -2.1946 -2.1845 -2.0555 -2.0359 -1.8958 -1.8825 -1.7281 -1.7249 -0.5726 -0.5472 -0.4647 -0.4317 -0.2811 -0.2658 -0.2165 -0.1968 -0.0986 -0.0800 0.0116 0.0296 0.2803 0.2854 0.4319 0.4417 0.4980 0.5013 0.9508 0.9534 1.1730 1.1762 1.2238 1.2255 4.0677 4.0681 5.9005 5.9024 6.0295 6.0305 6.6824 6.6830 6.8198 6.8204 8.3578 8.3598 9.1608 9.1638 k = 0.5104-0.4738-0.3293 ( 8253 PWs) bands (ev): -16.9802 -16.9801 -16.2373 -16.2371 -16.2202 -16.2201 -13.0189 -13.0188 -12.9831 -12.9830 -12.9091 -12.9091 -12.7342 -12.7342 -11.3579 -11.3579 -11.3313 -11.3312 -6.3498 -6.3478 -6.3283 -6.3263 -5.9851 -5.9849 -5.4498 -5.4497 -4.0392 -4.0366 -3.9765 -3.9753 -3.8629 -3.8588 -3.1950 -3.1947 -2.1823 -2.1708 -2.0667 -2.0470 -1.8745 -1.8627 -1.7278 -1.7248 -0.5618 -0.5353 -0.4583 -0.4236 -0.2790 -0.2616 -0.2137 -0.1956 -0.1022 -0.0846 0.0054 0.0215 0.2733 0.2785 0.4440 0.4532 0.5021 0.5050 0.9404 0.9427 1.1741 1.1771 1.2188 1.2205 4.0417 4.0420 5.9220 5.9241 6.0257 6.0270 6.6926 6.6931 6.8178 6.8183 8.3376 8.3395 9.1635 9.1662 k = 0.5110-0.4731-0.3486 ( 8243 PWs) bands (ev): -16.9793 -16.9793 -16.2367 -16.2366 -16.2213 -16.2212 -13.0153 -13.0152 -12.9842 -12.9841 -12.9132 -12.9131 -12.7383 -12.7383 -11.3514 -11.3514 -11.3304 -11.3303 -6.3463 -6.3440 -6.3285 -6.3262 -5.9966 -5.9965 -5.4477 -5.4476 -4.0247 -4.0221 -3.9752 -3.9739 -3.8760 -3.8718 -3.2111 -3.2108 -2.1719 -2.1587 -2.0776 -2.0573 -1.8537 -1.8432 -1.7275 -1.7246 -0.5510 -0.5236 -0.4529 -0.4164 -0.2763 -0.2571 -0.2106 -0.1942 -0.1060 -0.0897 -0.0013 0.0126 0.2654 0.2703 0.4570 0.4655 0.5061 0.5086 0.9302 0.9321 1.1753 1.1781 1.2140 1.2158 4.0181 4.0184 5.9412 5.9437 6.0222 6.0240 6.7024 6.7029 6.8155 6.8160 8.3193 8.3210 9.1651 9.1675 k = 0.5116-0.4725-0.3680 ( 8228 PWs) bands (ev): -16.9785 -16.9785 -16.2362 -16.2361 -16.2224 -16.2222 -13.0120 -13.0118 -12.9852 -12.9851 -12.9169 -12.9169 -12.7420 -12.7420 -11.3456 -11.3455 -11.3295 -11.3294 -6.3431 -6.3406 -6.3288 -6.3262 -6.0068 -6.0067 -5.4459 -5.4458 -4.0117 -4.0090 -3.9739 -3.9724 -3.8879 -3.8835 -3.2255 -3.2252 -2.1633 -2.1482 -2.0877 -2.0665 -1.8342 -1.8246 -1.7274 -1.7243 -0.5405 -0.5122 -0.4486 -0.4107 -0.2726 -0.2522 -0.2073 -0.1927 -0.1098 -0.0946 -0.0085 0.0031 0.2572 0.2617 0.4702 0.4778 0.5100 0.5120 0.9203 0.9219 1.1765 1.1792 1.2095 1.2114 3.9971 3.9974 5.9580 5.9609 6.0192 6.0216 6.7119 6.7123 6.8130 6.8134 8.3031 8.3046 9.1658 9.1680 k = 0.5122-0.4719-0.3874 ( 8230 PWs) bands (ev): -16.9778 -16.9778 -16.2357 -16.2355 -16.2234 -16.2233 -13.0088 -13.0087 -12.9861 -12.9859 -12.9204 -12.9204 -12.7452 -12.7452 -11.3405 -11.3404 -11.3288 -11.3287 -6.3405 -6.3375 -6.3290 -6.3261 -6.0157 -6.0156 -5.4442 -5.4441 -4.0004 -3.9978 -3.9726 -3.9708 -3.8984 -3.8940 -3.2380 -3.2378 -2.1565 -2.1393 -2.0967 -2.0742 -1.8164 -1.8074 -1.7275 -1.7241 -0.5303 -0.5010 -0.4458 -0.4067 -0.2678 -0.2471 -0.2042 -0.1914 -0.1133 -0.0991 -0.0160 -0.0070 0.2493 0.2532 0.4826 0.4892 0.5137 0.5153 0.9111 0.9124 1.1777 1.1803 1.2054 1.2073 3.9790 3.9793 5.9720 5.9757 6.0165 6.0197 6.7210 6.7213 6.8101 6.8105 8.2891 8.2904 9.1660 9.1679 k = 0.5128-0.4713-0.4068 ( 8226 PWs) bands (ev): -16.9772 -16.9772 -16.2351 -16.2349 -16.2245 -16.2243 -13.0060 -13.0058 -12.9869 -12.9868 -12.9234 -12.9234 -12.7479 -12.7479 -11.3363 -11.3361 -11.3282 -11.3280 -6.3383 -6.3349 -6.3293 -6.3259 -6.0230 -6.0229 -5.4428 -5.4428 -3.9909 -3.9885 -3.9714 -3.9692 -3.9075 -3.9031 -3.2485 -3.2483 -2.1513 -2.1318 -2.1044 -2.0805 -1.8006 -1.7921 -1.7277 -1.7240 -0.5205 -0.4902 -0.4446 -0.4047 -0.2622 -0.2418 -0.2018 -0.1906 -0.1157 -0.1024 -0.0239 -0.0174 0.2422 0.2455 0.4937 0.4992 0.5171 0.5185 0.9029 0.9040 1.1788 1.1813 1.2018 1.2037 3.9639 3.9642 5.9833 5.9880 6.0143 6.0186 6.7295 6.7298 6.8068 6.8071 8.2774 8.2785 9.1660 9.1675 k = 0.5134-0.4706-0.4261 ( 8224 PWs) bands (ev): -16.9767 -16.9766 -16.2345 -16.2343 -16.2255 -16.2254 -13.0035 -13.0033 -12.9877 -12.9876 -12.9259 -12.9259 -12.7501 -12.7501 -11.3329 -11.3327 -11.3277 -11.3274 -6.3365 -6.3328 -6.3296 -6.3258 -6.0287 -6.0286 -5.4417 -5.4417 -3.9836 -3.9814 -3.9703 -3.9674 -3.9149 -3.9109 -3.2569 -3.2567 -2.1473 -2.1261 -2.1102 -2.0854 -1.7870 -1.7789 -1.7282 -1.7241 -0.5112 -0.4800 -0.4451 -0.4048 -0.2559 -0.2365 -0.2009 -0.1910 -0.1161 -0.1042 -0.0319 -0.0277 0.2364 0.2389 0.5027 0.5069 0.5202 0.5218 0.8961 0.8968 1.1798 1.1823 1.1985 1.2005 3.9520 3.9522 5.9916 5.9976 6.0125 6.0182 6.7375 6.7378 6.8030 6.8033 8.2682 8.2690 9.1659 9.1670 k = 0.5140-0.4700-0.4455 ( 8219 PWs) bands (ev): -16.9762 -16.9762 -16.2338 -16.2337 -16.2265 -16.2263 -13.0014 -13.0012 -12.9886 -12.9884 -12.9278 -12.9278 -12.7516 -12.7516 -11.3305 -11.3302 -11.3272 -11.3269 -6.3352 -6.3313 -6.3297 -6.3258 -6.0328 -6.0328 -5.4409 -5.4409 -3.9787 -3.9766 -3.9689 -3.9657 -3.9204 -3.9172 -3.2630 -3.2629 -2.1441 -2.1233 -2.1129 -2.0891 -1.7757 -1.7680 -1.7293 -1.7247 -0.5026 -0.4703 -0.4472 -0.4070 -0.2494 -0.2316 -0.2021 -0.1930 -0.1133 -0.1041 -0.0399 -0.0375 0.2320 0.2337 0.5091 0.5121 0.5231 0.5250 0.8909 0.8914 1.1807 1.1831 1.1956 1.1976 3.9434 3.9435 5.9971 6.0045 6.0111 6.0183 6.7450 6.7452 6.7986 6.7989 8.2615 8.2621 9.1661 9.1668 k = 0.5147-0.4694-0.4649 ( 8211 PWs) bands (ev): -16.9759 -16.9759 -16.2332 -16.2330 -16.2274 -16.2273 -12.9996 -12.9994 -12.9897 -12.9895 -12.9291 -12.9291 -12.7525 -12.7525 -11.3291 -11.3287 -11.3269 -11.3265 -6.3343 -6.3309 -6.3294 -6.3259 -6.0352 -6.0352 -5.4404 -5.4403 -3.9761 -3.9741 -3.9672 -3.9647 -3.9239 -3.9221 -3.2667 -3.2667 -2.1414 -2.1243 -2.1115 -2.0921 -1.7666 -1.7592 -1.7311 -1.7261 -0.4947 -0.4614 -0.4509 -0.4111 -0.2433 -0.2272 -0.2057 -0.1967 -0.1072 -0.1019 -0.0478 -0.0462 0.2293 0.2303 0.5128 0.5146 0.5255 0.5274 0.8877 0.8879 1.1816 1.1839 1.1930 1.1951 3.9381 3.9382 6.0003 6.0087 6.0103 6.0184 6.7519 6.7521 6.7937 6.7940 8.2574 8.2577 9.1666 9.1670 k = 0.5153-0.4687-0.4842 ( 8204 PWs) bands (ev): -16.9757 -16.9757 -16.2324 -16.2323 -16.2284 -16.2282 -12.9981 -12.9979 -12.9910 -12.9908 -12.9295 -12.9295 -12.7527 -12.7527 -11.3284 -11.3280 -11.3269 -11.3265 -6.3337 -6.3312 -6.3288 -6.3263 -6.0360 -6.0359 -5.4401 -5.4401 -3.9752 -3.9736 -3.9661 -3.9647 -3.9254 -3.9253 -3.2681 -3.2681 -2.1386 -2.1264 -2.1084 -2.0945 -1.7595 -1.7525 -1.7340 -1.7288 -0.4876 -0.4561 -0.4534 -0.4170 -0.2381 -0.2235 -0.2114 -0.2017 -0.0987 -0.0973 -0.0550 -0.0535 0.2283 0.2287 0.5141 0.5152 0.5267 0.5281 0.8866 0.8867 1.1825 1.1848 1.1907 1.1928 3.9362 3.9363 6.0021 6.0085 6.0114 6.0177 6.7582 6.7584 6.7882 6.7885 8.2558 8.2559 9.1676 9.1677 k = 0.5153-0.4687-0.4842 ( 8204 PWs) bands (ev): -16.9757 -16.9757 -16.2324 -16.2323 -16.2284 -16.2282 -12.9981 -12.9979 -12.9910 -12.9908 -12.9295 -12.9295 -12.7527 -12.7527 -11.3284 -11.3280 -11.3269 -11.3265 -6.3337 -6.3312 -6.3288 -6.3263 -6.0360 -6.0359 -5.4401 -5.4401 -3.9752 -3.9736 -3.9661 -3.9647 -3.9254 -3.9253 -3.2681 -3.2681 -2.1386 -2.1264 -2.1084 -2.0945 -1.7595 -1.7525 -1.7340 -1.7288 -0.4876 -0.4561 -0.4534 -0.4170 -0.2381 -0.2235 -0.2114 -0.2017 -0.0987 -0.0973 -0.0550 -0.0535 0.2283 0.2287 0.5141 0.5152 0.5267 0.5281 0.8866 0.8867 1.1825 1.1848 1.1907 1.1928 3.9362 3.9363 6.0021 6.0085 6.0114 6.0177 6.7582 6.7584 6.7882 6.7885 8.2558 8.2559 9.1676 9.1677 k = 0.5229-0.4608-0.4761 ( 8210 PWs) bands (ev): -16.9759 -16.9759 -16.2333 -16.2332 -16.2272 -16.2270 -12.9998 -12.9996 -12.9891 -12.9889 -12.9294 -12.9294 -12.7529 -12.7529 -11.3289 -11.3285 -11.3266 -11.3262 -6.3343 -6.3306 -6.3294 -6.3257 -6.0362 -6.0361 -5.4403 -5.4402 -3.9755 -3.9732 -3.9664 -3.9642 -3.9232 -3.9231 -3.2678 -3.2678 -2.1424 -2.1239 -2.1127 -2.0918 -1.7677 -1.7601 -1.7299 -1.7249 -0.4959 -0.4628 -0.4491 -0.4088 -0.2433 -0.2273 -0.2032 -0.1943 -0.1085 -0.1071 -0.0467 -0.0451 0.2288 0.2294 0.5138 0.5154 0.5263 0.5283 0.8866 0.8867 1.1815 1.1838 1.1937 1.1958 3.9365 3.9366 6.0006 6.0100 6.0102 6.0194 6.7506 6.7508 6.7955 6.7958 8.2563 8.2565 9.1658 9.1660 k = 0.5305-0.4530-0.4680 ( 8210 PWs) bands (ev): -16.9762 -16.9762 -16.2342 -16.2340 -16.2260 -16.2258 -13.0014 -13.0012 -12.9872 -12.9870 -12.9291 -12.9291 -12.7532 -12.7532 -11.3295 -11.3290 -11.3264 -11.3260 -6.3348 -6.3300 -6.3299 -6.3250 -6.0364 -6.0364 -5.4405 -5.4404 -3.9759 -3.9728 -3.9666 -3.9638 -3.9201 -3.9200 -3.2673 -3.2672 -2.1464 -2.1216 -2.1173 -2.0892 -1.7765 -1.7683 -1.7267 -1.7221 -0.5040 -0.4720 -0.4426 -0.4013 -0.2480 -0.2304 -0.1946 -0.1859 -0.1183 -0.1174 -0.0385 -0.0369 0.2295 0.2302 0.5134 0.5156 0.5259 0.5286 0.8867 0.8868 1.1809 1.1832 1.1972 1.1992 3.9368 3.9370 5.9993 6.0087 6.0119 6.0210 6.7430 6.7432 6.8026 6.8029 8.2570 8.2572 9.1633 9.1635 k = 0.5305-0.4530-0.4680 ( 8210 PWs) bands (ev): -16.9762 -16.9762 -16.2342 -16.2340 -16.2260 -16.2258 -13.0014 -13.0012 -12.9872 -12.9870 -12.9291 -12.9291 -12.7532 -12.7532 -11.3295 -11.3290 -11.3264 -11.3260 -6.3348 -6.3300 -6.3299 -6.3250 -6.0364 -6.0364 -5.4405 -5.4404 -3.9759 -3.9728 -3.9666 -3.9638 -3.9201 -3.9200 -3.2673 -3.2672 -2.1464 -2.1216 -2.1173 -2.0892 -1.7765 -1.7683 -1.7267 -1.7221 -0.5040 -0.4720 -0.4426 -0.4013 -0.2480 -0.2304 -0.1946 -0.1859 -0.1183 -0.1174 -0.0385 -0.0369 0.2295 0.2302 0.5134 0.5156 0.5259 0.5286 0.8867 0.8868 1.1809 1.1832 1.1972 1.1992 3.9368 3.9370 5.9993 6.0087 6.0119 6.0210 6.7430 6.7432 6.8026 6.8029 8.2570 8.2572 9.1633 9.1635 k = 0.5297-0.4396-0.4541 ( 8208 PWs) bands (ev): -16.9767 -16.9767 -16.2350 -16.2349 -16.2246 -16.2244 -13.0033 -13.0031 -12.9851 -12.9850 -12.9286 -12.9286 -12.7535 -12.7535 -11.3302 -11.3298 -11.3263 -11.3259 -6.3355 -6.3307 -6.3292 -6.3243 -6.0364 -6.0363 -5.4408 -5.4408 -3.9767 -3.9728 -3.9673 -3.9635 -3.9157 -3.9145 -3.2660 -3.2659 -2.1511 -2.1230 -2.1191 -2.0866 -1.7874 -1.7784 -1.7247 -1.7203 -0.5133 -0.4825 -0.4361 -0.3939 -0.2531 -0.2337 -0.1854 -0.1760 -0.1306 -0.1259 -0.0295 -0.0278 0.2310 0.2321 0.5124 0.5154 0.5249 0.5284 0.8873 0.8875 1.1806 1.1830 1.2015 1.2035 3.9382 3.9384 5.9976 6.0070 6.0136 6.0226 6.7344 6.7345 6.8102 6.8105 8.2587 8.2590 9.1598 9.1602 k = 0.5288-0.4262-0.4403 ( 8208 PWs) bands (ev): -16.9773 -16.9773 -16.2358 -16.2357 -16.2231 -16.2230 -13.0052 -13.0050 -12.9832 -12.9831 -12.9276 -12.9276 -12.7535 -12.7535 -11.3313 -11.3309 -11.3266 -11.3261 -6.3363 -6.3315 -6.3286 -6.3238 -6.0355 -6.0354 -5.4414 -5.4414 -3.9782 -3.9738 -3.9683 -3.9638 -3.9094 -3.9074 -3.2633 -3.2632 -2.1561 -2.1289 -2.1166 -2.0840 -1.7994 -1.7897 -1.7244 -1.7202 -0.5227 -0.4931 -0.4310 -0.3883 -0.2588 -0.2373 -0.1793 -0.1672 -0.1404 -0.1297 -0.0209 -0.0188 0.2336 0.2351 0.5103 0.5142 0.5230 0.5274 0.8890 0.8894 1.1808 1.1833 1.2063 1.2082 3.9413 3.9416 5.9953 6.0045 6.0150 6.0237 6.7255 6.7257 6.8173 6.8176 8.2618 8.2624 9.1556 9.1563 k = 0.5279-0.4128-0.4264 ( 8212 PWs) bands (ev): -16.9781 -16.9781 -16.2365 -16.2364 -16.2216 -16.2214 -13.0071 -13.0069 -12.9815 -12.9813 -12.9262 -12.9262 -12.7532 -12.7532 -11.3328 -11.3324 -11.3271 -11.3267 -6.3373 -6.3325 -6.3282 -6.3233 -6.0338 -6.0337 -5.4422 -5.4421 -3.9806 -3.9762 -3.9691 -3.9647 -3.9012 -3.8987 -3.2594 -3.2592 -2.1614 -2.1352 -2.1141 -2.0815 -1.8124 -1.8018 -1.7259 -1.7219 -0.5321 -0.5036 -0.4272 -0.3843 -0.2652 -0.2413 -0.1780 -0.1648 -0.1415 -0.1275 -0.0129 -0.0102 0.2373 0.2392 0.5070 0.5118 0.5205 0.5258 0.8919 0.8923 1.1815 1.1840 1.2115 1.2134 3.9464 3.9467 5.9923 6.0008 6.0165 6.0245 6.7165 6.7167 6.8238 6.8242 8.2665 8.2672 9.1507 9.1516 k = 0.5271-0.3994-0.4126 ( 8223 PWs) bands (ev): -16.9790 -16.9790 -16.2372 -16.2370 -16.2200 -16.2199 -13.0091 -13.0089 -12.9800 -12.9798 -12.9244 -12.9244 -12.7527 -12.7527 -11.3346 -11.3342 -11.3279 -11.3275 -6.3384 -6.3336 -6.3278 -6.3230 -6.0313 -6.0312 -5.4432 -5.4431 -3.9842 -3.9800 -3.9697 -3.9657 -3.8913 -3.8885 -3.2541 -3.2539 -2.1669 -2.1420 -2.1117 -2.0792 -1.8262 -1.8146 -1.7291 -1.7253 -0.5414 -0.5139 -0.4248 -0.3820 -0.2724 -0.2459 -0.1811 -0.1695 -0.1330 -0.1200 -0.0054 -0.0020 0.2420 0.2442 0.5025 0.5079 0.5180 0.5238 0.8957 0.8963 1.1825 1.1852 1.2171 1.2190 3.9532 3.9536 5.9882 5.9959 6.0181 6.0252 6.7074 6.7077 6.8297 6.8300 8.2725 8.2734 9.1448 9.1459 k = 0.5262-0.3860-0.3988 ( 8225 PWs) bands (ev): -16.9800 -16.9800 -16.2377 -16.2376 -16.2184 -16.2182 -13.0111 -13.0109 -12.9786 -12.9784 -12.9223 -12.9222 -12.7519 -12.7519 -11.3368 -11.3364 -11.3289 -11.3285 -6.3396 -6.3349 -6.3275 -6.3228 -6.0281 -6.0280 -5.4443 -5.4442 -3.9888 -3.9850 -3.9701 -3.9668 -3.8797 -3.8769 -3.2476 -3.2474 -2.1729 -2.1494 -2.1094 -2.0771 -1.8404 -1.8278 -1.7339 -1.7302 -0.5507 -0.5241 -0.4236 -0.3813 -0.2803 -0.2512 -0.1861 -0.1747 -0.1219 -0.1096 0.0016 0.0056 0.2476 0.2502 0.4967 0.5023 0.5157 0.5217 0.9004 0.9011 1.1840 1.1869 1.2230 1.2250 3.9618 3.9622 5.9829 5.9896 6.0201 6.0261 6.6982 6.6986 6.8350 6.8353 8.2799 8.2810 9.1377 9.1390 k = 0.5253-0.3726-0.3849 ( 8232 PWs) bands (ev): -16.9811 -16.9811 -16.2382 -16.2381 -16.2167 -16.2166 -13.0131 -13.0129 -12.9773 -12.9771 -12.9198 -12.9198 -12.7509 -12.7508 -11.3394 -11.3390 -11.3301 -11.3297 -6.3409 -6.3364 -6.3272 -6.3227 -6.0241 -6.0239 -5.4456 -5.4455 -3.9947 -3.9912 -3.9706 -3.9678 -3.8667 -3.8638 -3.2399 -3.2396 -2.1794 -2.1574 -2.1072 -2.0754 -1.8546 -1.8410 -1.7403 -1.7366 -0.5598 -0.5341 -0.4237 -0.3821 -0.2887 -0.2572 -0.1912 -0.1789 -0.1104 -0.0981 0.0080 0.0127 0.2540 0.2568 0.4898 0.4954 0.5135 0.5195 0.9059 0.9066 1.1859 1.1889 1.2294 1.2314 3.9721 3.9726 5.9761 5.9818 6.0223 6.0273 6.6890 6.6894 6.8396 6.8399 8.2886 8.2899 9.1290 9.1305 k = 0.5244-0.3592-0.3711 ( 8238 PWs) bands (ev): -16.9823 -16.9823 -16.2387 -16.2385 -16.2150 -16.2149 -13.0151 -13.0149 -12.9762 -12.9760 -12.9170 -12.9170 -12.7495 -12.7495 -11.3424 -11.3420 -11.3314 -11.3311 -6.3423 -6.3380 -6.3271 -6.3226 -6.0193 -6.0191 -5.4471 -5.4470 -4.0017 -3.9984 -3.9710 -3.9687 -3.8523 -3.8494 -3.2310 -3.2307 -2.1866 -2.1663 -2.1053 -2.0740 -1.8685 -1.8539 -1.7480 -1.7444 -0.5687 -0.5438 -0.4249 -0.3843 -0.2972 -0.2639 -0.1953 -0.1821 -0.0994 -0.0864 0.0140 0.0193 0.2610 0.2638 0.4820 0.4875 0.5114 0.5174 0.9121 0.9128 1.1882 1.1913 1.2361 1.2383 3.9841 3.9846 5.9679 5.9727 6.0249 6.0289 6.6797 6.6802 6.8436 6.8439 8.2985 8.2999 9.1186 9.1203 k = 0.5236-0.3458-0.3573 ( 8239 PWs) bands (ev): -16.9837 -16.9837 -16.2391 -16.2389 -16.2132 -16.2131 -13.0170 -13.0169 -12.9752 -12.9750 -12.9141 -12.9140 -12.7480 -12.7480 -11.3457 -11.3455 -11.3328 -11.3325 -6.3439 -6.3397 -6.3269 -6.3226 -6.0138 -6.0136 -5.4488 -5.4487 -4.0097 -4.0066 -3.9715 -3.9695 -3.8366 -3.8338 -3.2211 -3.2207 -2.1947 -2.1761 -2.1037 -2.0732 -1.8817 -1.8662 -1.7571 -1.7534 -0.5774 -0.5533 -0.4272 -0.3878 -0.3055 -0.2708 -0.1984 -0.1845 -0.0890 -0.0753 0.0196 0.0256 0.2683 0.2711 0.4735 0.4788 0.5093 0.5152 0.9187 0.9195 1.1908 1.1941 1.2433 1.2456 3.9978 3.9983 5.9581 5.9622 6.0277 6.0310 6.6705 6.6711 6.8469 6.8473 8.3094 8.3109 9.1062 9.1080 k = 0.5227-0.3324-0.3434 ( 8249 PWs) bands (ev): -16.9851 -16.9851 -16.2394 -16.2392 -16.2115 -16.2113 -13.0190 -13.0188 -12.9742 -12.9741 -12.9109 -12.9109 -12.7462 -12.7462 -11.3495 -11.3493 -11.3344 -11.3341 -6.3456 -6.3416 -6.3268 -6.3227 -6.0076 -6.0074 -5.4506 -5.4505 -4.0187 -4.0157 -3.9719 -3.9702 -3.8198 -3.8171 -3.2101 -3.2096 -2.2037 -2.1870 -2.1027 -2.0732 -1.8936 -1.8774 -1.7674 -1.7636 -0.5860 -0.5626 -0.4305 -0.3925 -0.3134 -0.2779 -0.2005 -0.1863 -0.0797 -0.0651 0.0249 0.0314 0.2757 0.2784 0.4646 0.4697 0.5073 0.5131 0.9258 0.9267 1.1937 1.1972 1.2508 1.2532 4.0130 4.0135 5.9469 5.9504 6.0309 6.0334 6.6613 6.6620 6.8496 6.8500 8.3210 8.3227 9.0918 9.0937 k = 0.5218-0.3190-0.3296 ( 8250 PWs) bands (ev): -16.9866 -16.9866 -16.2397 -16.2395 -16.2097 -16.2095 -13.0208 -13.0207 -12.9734 -12.9732 -12.9076 -12.9075 -12.7442 -12.7442 -11.3537 -11.3534 -11.3360 -11.3358 -6.3474 -6.3435 -6.3268 -6.3228 -6.0007 -6.0006 -5.4526 -5.4524 -4.0285 -4.0257 -3.9724 -3.9709 -3.8019 -3.7993 -3.1981 -3.1976 -2.2138 -2.1991 -2.1022 -2.0741 -1.9038 -1.8872 -1.7786 -1.7747 -0.5944 -0.5717 -0.4347 -0.3982 -0.3209 -0.2848 -0.2018 -0.1876 -0.0715 -0.0562 0.0300 0.0370 0.2828 0.2854 0.4557 0.4603 0.5055 0.5111 0.9332 0.9342 1.1968 1.2006 1.2587 1.2613 4.0297 4.0302 5.9343 5.9373 6.0343 6.0363 6.6522 6.6530 6.8518 6.8522 8.3333 8.3351 9.0753 9.0773 k = 0.5209-0.3057-0.3158 ( 8245 PWs) bands (ev): -16.9882 -16.9882 -16.2399 -16.2398 -16.2078 -16.2077 -13.0227 -13.0225 -12.9726 -12.9725 -12.9041 -12.9041 -12.7421 -12.7421 -11.3581 -11.3579 -11.3378 -11.3375 -6.3493 -6.3456 -6.3268 -6.3229 -5.9933 -5.9931 -5.4546 -5.4545 -4.0391 -4.0365 -3.9729 -3.9715 -3.7831 -3.7805 -3.1853 -3.1847 -2.2252 -2.2124 -2.1023 -2.0760 -1.9119 -1.8952 -1.7908 -1.7868 -0.6025 -0.5804 -0.4397 -0.4048 -0.3278 -0.2915 -0.2026 -0.1885 -0.0645 -0.0485 0.0348 0.0422 0.2893 0.2918 0.4470 0.4512 0.5037 0.5093 0.9408 0.9419 1.2001 1.2041 1.2670 1.2697 4.0478 4.0484 5.9204 5.9229 6.0379 6.0395 6.6432 6.6441 6.8533 6.8538 8.3460 8.3479 9.0570 9.0591 k = 0.5201-0.2923-0.3019 ( 8251 PWs) bands (ev): -16.9898 -16.9898 -16.2401 -16.2400 -16.2060 -16.2058 -13.0244 -13.0243 -12.9719 -12.9717 -12.9005 -12.9005 -12.7397 -12.7397 -11.3629 -11.3627 -11.3396 -11.3394 -6.3513 -6.3477 -6.3268 -6.3231 -5.9852 -5.9850 -5.4568 -5.4567 -4.0505 -4.0480 -3.9733 -3.9721 -3.7634 -3.7609 -3.1716 -3.1710 -2.2378 -2.2269 -2.1033 -2.0790 -1.9177 -1.9013 -1.8037 -1.7996 -0.6104 -0.5889 -0.4453 -0.4122 -0.3342 -0.2980 -0.2028 -0.1889 -0.0587 -0.0422 0.0391 0.0470 0.2946 0.2973 0.4391 0.4425 0.5022 0.5078 0.9485 0.9498 1.2036 1.2076 1.2757 1.2786 4.0672 4.0678 5.9051 5.9073 6.0418 6.0430 6.6344 6.6354 6.8544 6.8548 8.3586 8.3607 9.0370 9.0392 k = 0.5192-0.2789-0.2881 ( 8245 PWs) bands (ev): -16.9915 -16.9915 -16.2403 -16.2401 -16.2041 -16.2040 -13.0261 -13.0260 -12.9711 -12.9710 -12.8969 -12.8969 -12.7372 -12.7372 -11.3679 -11.3677 -11.3414 -11.3412 -6.3533 -6.3499 -6.3268 -6.3233 -5.9766 -5.9764 -5.4591 -5.4590 -4.0624 -4.0600 -3.9738 -3.9727 -3.7430 -3.7407 -3.1572 -3.1565 -2.2519 -2.2427 -2.1050 -2.0829 -1.9212 -1.9054 -1.8172 -1.8129 -0.6180 -0.5970 -0.4514 -0.4201 -0.3403 -0.3044 -0.2026 -0.1890 -0.0540 -0.0372 0.0428 0.0512 0.2981 0.3016 0.4323 0.4350 0.5010 0.5065 0.9563 0.9578 1.2070 1.2112 1.2848 1.2878 4.0879 4.0885 5.8887 5.8905 6.0458 6.0468 6.6258 6.6269 6.8549 6.8554 8.3710 8.3731 9.0159 9.0181 k = 0.5183-0.2655-0.2743 ( 8254 PWs) bands (ev): -16.9932 -16.9932 -16.2404 -16.2403 -16.2023 -16.2021 -13.0278 -13.0277 -12.9705 -12.9703 -12.8933 -12.8933 -12.7346 -12.7346 -11.3731 -11.3729 -11.3433 -11.3431 -6.3553 -6.3521 -6.3268 -6.3235 -5.9676 -5.9674 -5.4615 -5.4613 -4.0749 -4.0727 -3.9742 -3.9732 -3.7221 -3.7199 -3.1422 -3.1413 -2.2672 -2.2596 -2.1074 -2.0876 -1.9225 -1.9074 -1.8311 -1.8268 -0.6253 -0.6048 -0.4579 -0.4285 -0.3461 -0.3106 -0.2021 -0.1888 -0.0502 -0.0332 0.0457 0.0547 0.2996 0.3041 0.4270 0.4293 0.4999 0.5057 0.9641 0.9658 1.2103 1.2146 1.2944 1.2974 4.1096 4.1103 5.8710 5.8727 6.0499 6.0509 6.6175 6.6187 6.8550 6.8555 8.3827 8.3849 8.9943 8.9964 k = 0.5175-0.2521-0.2604 ( 8251 PWs) bands (ev): -16.9949 -16.9949 -16.2405 -16.2404 -16.2004 -16.2003 -13.0294 -13.0293 -12.9698 -12.9697 -12.8896 -12.8896 -12.7319 -12.7319 -11.3785 -11.3784 -11.3452 -11.3451 -6.3574 -6.3543 -6.3269 -6.3237 -5.9581 -5.9579 -5.4639 -5.4638 -4.0879 -4.0857 -3.9746 -3.9736 -3.7008 -3.6986 -3.1266 -3.1256 -2.2836 -2.2774 -2.1105 -2.0929 -1.9220 -1.9076 -1.8451 -1.8409 -0.6321 -0.6121 -0.4648 -0.4371 -0.3518 -0.3169 -0.2013 -0.1883 -0.0472 -0.0302 0.0477 0.0574 0.2985 0.3043 0.4234 0.4261 0.4991 0.5053 0.9718 0.9738 1.2135 1.2179 1.3043 1.3074 4.1325 4.1332 5.8523 5.8538 6.0542 6.0551 6.6096 6.6107 6.8547 6.8553 8.3932 8.3955 8.9726 8.9747 k = 0.5166-0.2387-0.2466 ( 8264 PWs) bands (ev): -16.9967 -16.9967 -16.2406 -16.2404 -16.1986 -16.1985 -13.0309 -13.0308 -12.9692 -12.9691 -12.8860 -12.8860 -12.7291 -12.7290 -11.3841 -11.3839 -11.3472 -11.3470 -6.3595 -6.3565 -6.3270 -6.3240 -5.9483 -5.9481 -5.4663 -5.4662 -4.1012 -4.0992 -3.9750 -3.9741 -3.6792 -3.6771 -3.1104 -3.1094 -2.3010 -2.2960 -2.1142 -2.0986 -1.9202 -1.9061 -1.8589 -1.8551 -0.6385 -0.6189 -0.4718 -0.4458 -0.3575 -0.3234 -0.2003 -0.1875 -0.0450 -0.0279 0.0487 0.0591 0.2950 0.3019 0.4218 0.4255 0.4986 0.5054 0.9795 0.9816 1.2164 1.2208 1.3145 1.3177 4.1562 4.1569 5.8326 5.8339 6.0586 6.0596 6.6019 6.6031 6.8540 6.8546 8.4023 8.4047 8.9517 8.9537 k = 0.5157-0.2253-0.2328 ( 8265 PWs) bands (ev): -16.9985 -16.9984 -16.2406 -16.2405 -16.1968 -16.1967 -13.0323 -13.0322 -12.9686 -12.9685 -12.8823 -12.8823 -12.7262 -12.7262 -11.3897 -11.3896 -11.3491 -11.3490 -6.3615 -6.3587 -6.3271 -6.3242 -5.9382 -5.9380 -5.4688 -5.4687 -4.1147 -4.1129 -3.9753 -3.9744 -3.6575 -3.6555 -3.0939 -3.0928 -2.3191 -2.3151 -2.1184 -2.1045 -1.9177 -1.9035 -1.8720 -1.8689 -0.6444 -0.6250 -0.4789 -0.4546 -0.3634 -0.3300 -0.1991 -0.1865 -0.0433 -0.0264 0.0486 0.0600 0.2893 0.2970 0.4223 0.4274 0.4983 0.5060 0.9870 0.9894 1.2189 1.2233 1.3251 1.3282 4.1807 4.1814 5.8120 5.8132 6.0632 6.0642 6.5947 6.5959 6.8530 6.8536 8.4096 8.4120 8.9322 8.9341 k = 0.5148-0.2119-0.2189 ( 8257 PWs) bands (ev): -17.0002 -17.0002 -16.2406 -16.2405 -16.1950 -16.1949 -13.0337 -13.0336 -12.9680 -12.9679 -12.8788 -12.8788 -12.7233 -12.7233 -11.3954 -11.3953 -11.3510 -11.3509 -6.3635 -6.3609 -6.3272 -6.3245 -5.9280 -5.9277 -5.4713 -5.4712 -4.1285 -4.1267 -3.9756 -3.9747 -3.6358 -3.6339 -3.0771 -3.0759 -2.3377 -2.3346 -2.1230 -2.1106 -1.9164 -1.9006 -1.8837 -1.8808 -0.6496 -0.6305 -0.4861 -0.4634 -0.3695 -0.3371 -0.1977 -0.1853 -0.0421 -0.0255 0.0477 0.0598 0.2818 0.2899 0.4246 0.4311 0.4982 0.5073 0.9944 0.9969 1.2210 1.2253 1.3359 1.3390 4.2058 4.2066 5.7906 5.7917 6.0678 6.0688 6.5879 6.5891 6.8518 6.8524 8.4146 8.4170 8.9147 8.9164 k = 0.5140-0.1985-0.2051 ( 8252 PWs) bands (ev): -17.0019 -17.0019 -16.2406 -16.2406 -16.1933 -16.1932 -13.0350 -13.0349 -12.9675 -12.9674 -12.8753 -12.8753 -12.7204 -12.7204 -11.4011 -11.4010 -11.3529 -11.3528 -6.3655 -6.3630 -6.3274 -6.3248 -5.9175 -5.9173 -5.4738 -5.4737 -4.1423 -4.1407 -3.9759 -3.9750 -3.6143 -3.6125 -3.0601 -3.0588 -2.3565 -2.3541 -2.1281 -2.1168 -1.9192 -1.9029 -1.8900 -1.8861 -0.6542 -0.6353 -0.4933 -0.4721 -0.3759 -0.3445 -0.1962 -0.1840 -0.0413 -0.0253 0.0460 0.0589 0.2731 0.2813 0.4282 0.4364 0.4985 0.5090 1.0015 1.0042 1.2226 1.2269 1.3468 1.3498 4.2315 4.2323 5.7685 5.7696 6.0725 6.0736 6.5815 6.5828 6.8503 6.8509 8.4172 8.4196 8.8995 8.9011 k = 0.5131-0.1851-0.1912 ( 8252 PWs) bands (ev): -17.0036 -17.0036 -16.2406 -16.2406 -16.1916 -16.1915 -13.0362 -13.0361 -12.9669 -12.9668 -12.8719 -12.8719 -12.7175 -12.7175 -11.4068 -11.4067 -11.3548 -11.3547 -6.3674 -6.3650 -6.3275 -6.3251 -5.9071 -5.9069 -5.4763 -5.4762 -4.1561 -4.1546 -3.9761 -3.9752 -3.5932 -3.5915 -3.0430 -3.0416 -2.3753 -2.3734 -2.1336 -2.1232 -1.9274 -1.9140 -1.8875 -1.8838 -0.6581 -0.6392 -0.5003 -0.4806 -0.3828 -0.3525 -0.1946 -0.1826 -0.0410 -0.0256 0.0437 0.0572 0.2635 0.2716 0.4327 0.4426 0.4991 0.5114 1.0084 1.0113 1.2236 1.2279 1.3578 1.3607 4.2575 4.2583 5.7459 5.7469 6.0772 6.0783 6.5756 6.5769 6.8486 6.8493 8.4173 8.4198 8.8869 8.8883 k = 0.5122-0.1717-0.1774 ( 8254 PWs) bands (ev): -17.0052 -17.0052 -16.2406 -16.2406 -16.1899 -16.1898 -13.0373 -13.0372 -12.9664 -12.9663 -12.8686 -12.8686 -12.7147 -12.7147 -11.4123 -11.4122 -11.3566 -11.3565 -6.3692 -6.3670 -6.3277 -6.3254 -5.8967 -5.8965 -5.4787 -5.4786 -4.1697 -4.1683 -3.9762 -3.9754 -3.5726 -3.5710 -3.0259 -3.0244 -2.3939 -2.3923 -2.1396 -2.1298 -1.9380 -1.9263 -1.8823 -1.8783 -0.6612 -0.6423 -0.5072 -0.4889 -0.3902 -0.3610 -0.1930 -0.1813 -0.0411 -0.0266 0.0411 0.0549 0.2535 0.2614 0.4376 0.4494 0.5002 0.5143 1.0150 1.0181 1.2241 1.2283 1.3688 1.3716 4.2837 4.2845 5.7229 5.7238 6.0820 6.0831 6.5702 6.5714 6.8468 6.8475 8.4152 8.4176 8.8769 8.8782 k = 0.5113-0.1583-0.1636 ( 8258 PWs) bands (ev): -17.0068 -17.0068 -16.2406 -16.2405 -16.1884 -16.1883 -13.0383 -13.0382 -12.9659 -12.9658 -12.8654 -12.8654 -12.7119 -12.7119 -11.4178 -11.4177 -11.3584 -11.3583 -6.3709 -6.3688 -6.3278 -6.3257 -5.8864 -5.8863 -5.4810 -5.4809 -4.1831 -4.1817 -3.9763 -3.9755 -3.5526 -3.5511 -3.0089 -3.0073 -2.4120 -2.4105 -2.1460 -2.1367 -1.9489 -1.9381 -1.8759 -1.8718 -0.6634 -0.6444 -0.5140 -0.4969 -0.3981 -0.3702 -0.1915 -0.1800 -0.0415 -0.0283 0.0385 0.0524 0.2434 0.2509 0.4426 0.4562 0.5019 0.5178 1.0213 1.0245 1.2241 1.2282 1.3796 1.3823 4.3099 4.3106 5.6997 5.7005 6.0867 6.0877 6.5652 6.5664 6.8448 6.8455 8.4110 8.4133 8.8693 8.8705 k = 0.5105-0.1449-0.1497 ( 8258 PWs) bands (ev): -17.0083 -17.0083 -16.2406 -16.2405 -16.1869 -16.1868 -13.0393 -13.0392 -12.9654 -12.9653 -12.8624 -12.8624 -12.7093 -12.7093 -11.4230 -11.4229 -11.3600 -11.3600 -6.3725 -6.3706 -6.3280 -6.3260 -5.8764 -5.8762 -5.4832 -5.4832 -4.1960 -4.1948 -3.9764 -3.9756 -3.5335 -3.5321 -2.9921 -2.9905 -2.4296 -2.4281 -2.1528 -2.1438 -1.9593 -1.9491 -1.8690 -1.8650 -0.6648 -0.6456 -0.5204 -0.5045 -0.4065 -0.3800 -0.1901 -0.1788 -0.0422 -0.0305 0.0361 0.0496 0.2334 0.2404 0.4475 0.4627 0.5044 0.5217 1.0273 1.0306 1.2235 1.2275 1.3902 1.3927 4.3358 4.3366 5.6765 5.6773 6.0913 6.0923 6.5607 6.5619 6.8429 6.8436 8.4053 8.4075 8.8638 8.8648 k = 0.5096-0.1316-0.1359 ( 8257 PWs) bands (ev): -17.0097 -17.0097 -16.2406 -16.2405 -16.1855 -16.1854 -13.0402 -13.0401 -12.9649 -12.9649 -12.8596 -12.8596 -12.7067 -12.7067 -11.4280 -11.4280 -11.3616 -11.3615 -6.3740 -6.3722 -6.3281 -6.3263 -5.8667 -5.8666 -5.4854 -5.4853 -4.2085 -4.2074 -3.9764 -3.9757 -3.5153 -3.5140 -2.9758 -2.9741 -2.4463 -2.4447 -2.1600 -2.1514 -1.9687 -1.9591 -1.8619 -1.8581 -0.6652 -0.6458 -0.5266 -0.5117 -0.4155 -0.3904 -0.1889 -0.1779 -0.0432 -0.0332 0.0339 0.0469 0.2237 0.2302 0.4522 0.4683 0.5080 0.5261 1.0329 1.0363 1.2225 1.2263 1.4004 1.4027 4.3614 4.3621 5.6535 5.6542 6.0958 6.0968 6.5567 6.5579 6.8409 6.8416 8.3984 8.4006 8.8599 8.8608 k = 0.5087-0.1182-0.1221 ( 8255 PWs) bands (ev): -17.0110 -17.0110 -16.2405 -16.2405 -16.1841 -16.1841 -13.0410 -13.0409 -12.9645 -12.9645 -12.8569 -12.8569 -12.7043 -12.7043 -11.4328 -11.4327 -11.3631 -11.3630 -6.3753 -6.3737 -6.3283 -6.3266 -5.8575 -5.8573 -5.4874 -5.4873 -4.2204 -4.2194 -3.9764 -3.9757 -3.4982 -3.4970 -2.9599 -2.9582 -2.4621 -2.4603 -2.1675 -2.1593 -1.9771 -1.9680 -1.8548 -1.8512 -0.6647 -0.6449 -0.5324 -0.5183 -0.4251 -0.4016 -0.1879 -0.1774 -0.0444 -0.0362 0.0322 0.0442 0.2145 0.2205 0.4564 0.4728 0.5126 0.5309 1.0382 1.0416 1.2210 1.2247 1.4101 1.4122 4.3862 4.3869 5.6308 5.6315 6.1001 6.1011 6.5532 6.5542 6.8389 6.8396 8.3910 8.3930 8.8571 8.8581 k = 0.5079-0.1048-0.1082 ( 8261 PWs) bands (ev): -17.0123 -17.0123 -16.2405 -16.2405 -16.1829 -16.1829 -13.0417 -13.0417 -12.9641 -12.9641 -12.8545 -12.8545 -12.7021 -12.7021 -11.4372 -11.4372 -11.3645 -11.3644 -6.3766 -6.3751 -6.3284 -6.3269 -5.8487 -5.8486 -5.4892 -5.4892 -4.2316 -4.2307 -3.9764 -3.9758 -3.4823 -3.4812 -2.9447 -2.9430 -2.4767 -2.4748 -2.1751 -2.1674 -1.9842 -1.9758 -1.8480 -1.8447 -0.6633 -0.6431 -0.5379 -0.5243 -0.4351 -0.4133 -0.1872 -0.1772 -0.0456 -0.0393 0.0309 0.0419 0.2058 0.2113 0.4603 0.4761 0.5183 0.5359 1.0430 1.0464 1.2192 1.2227 1.4192 1.4212 4.4102 4.4108 5.6089 5.6096 6.1042 6.1051 6.5501 6.5510 6.8370 6.8377 8.3835 8.3854 8.8552 8.8561 k = 0.5070-0.0914-0.0944 ( 8275 PWs) bands (ev): -17.0134 -17.0134 -16.2405 -16.2404 -16.1818 -16.1818 -13.0424 -13.0423 -12.9637 -12.9637 -12.8523 -12.8523 -12.7000 -12.7000 -11.4413 -11.4413 -11.3657 -11.3657 -6.3777 -6.3764 -6.3285 -6.3272 -5.8406 -5.8405 -5.4909 -5.4909 -4.2419 -4.2411 -3.9764 -3.9758 -3.4678 -3.4669 -2.9304 -2.9287 -2.4901 -2.4881 -2.1828 -2.1757 -1.9902 -1.9825 -1.8415 -1.8385 -0.6610 -0.6404 -0.5430 -0.5295 -0.4455 -0.4256 -0.1866 -0.1773 -0.0469 -0.0422 0.0299 0.0398 0.1979 0.2027 0.4637 0.4784 0.5247 0.5409 1.0474 1.0507 1.2171 1.2205 1.4277 1.4294 4.4329 4.4335 5.5880 5.5886 6.1081 6.1089 6.5474 6.5482 6.8352 6.8358 8.3763 8.3779 8.8537 8.8545 k = 0.5061-0.0780-0.0806 ( 8279 PWs) bands (ev): -17.0144 -17.0144 -16.2405 -16.2404 -16.1808 -16.1808 -13.0430 -13.0429 -12.9634 -12.9634 -12.8503 -12.8503 -12.6981 -12.6981 -11.4450 -11.4450 -11.3668 -11.3668 -6.3787 -6.3775 -6.3286 -6.3274 -5.8332 -5.8331 -5.4925 -5.4924 -4.2513 -4.2506 -3.9763 -3.9758 -3.4547 -3.4539 -2.9170 -2.9154 -2.5021 -2.5002 -2.1904 -2.1839 -1.9950 -1.9881 -1.8355 -1.8328 -0.6578 -0.6370 -0.5475 -0.5338 -0.4561 -0.4383 -0.1864 -0.1778 -0.0481 -0.0448 0.0293 0.0379 0.1907 0.1950 0.4667 0.4798 0.5314 0.5459 1.0514 1.0545 1.2150 1.2180 1.4354 1.4369 4.4541 4.4546 5.5684 5.5689 6.1116 6.1123 6.5450 6.5458 6.8336 6.8341 8.3695 8.3710 8.8524 8.8532 k = 0.5052-0.0646-0.0667 ( 8279 PWs) bands (ev): -17.0153 -17.0153 -16.2404 -16.2404 -16.1799 -16.1799 -13.0435 -13.0434 -12.9631 -12.9631 -12.8485 -12.8485 -12.6964 -12.6964 -11.4483 -11.4483 -11.3678 -11.3678 -6.3795 -6.3785 -6.3287 -6.3277 -5.8266 -5.8265 -5.4938 -5.4938 -4.2596 -4.2590 -3.9762 -3.9758 -3.4432 -3.4425 -2.9049 -2.9033 -2.5127 -2.5108 -2.1975 -2.1917 -1.9988 -1.9928 -1.8300 -1.8276 -0.6538 -0.6330 -0.5514 -0.5373 -0.4667 -0.4512 -0.1862 -0.1787 -0.0491 -0.0470 0.0290 0.0364 0.1843 0.1880 0.4694 0.4807 0.5380 0.5505 1.0549 1.0578 1.2128 1.2156 1.4422 1.4436 4.4734 4.4739 5.5504 5.5509 6.1148 6.1154 6.5431 6.5438 6.8320 6.8325 8.3636 8.3649 8.8513 8.8521 k = 0.5044-0.0512-0.0529 ( 8281 PWs) bands (ev): -17.0161 -17.0161 -16.2404 -16.2404 -16.1792 -16.1791 -13.0439 -13.0438 -12.9629 -12.9628 -12.8470 -12.8470 -12.6950 -12.6950 -11.4511 -11.4511 -11.3687 -11.3687 -6.3802 -6.3794 -6.3288 -6.3279 -5.8208 -5.8208 -5.4950 -5.4949 -4.2669 -4.2664 -3.9762 -3.9758 -3.4333 -3.4327 -2.8941 -2.8927 -2.5217 -2.5200 -2.2040 -2.1991 -2.0017 -1.9966 -1.8252 -1.8232 -0.6492 -0.6289 -0.5543 -0.5398 -0.4772 -0.4641 -0.1862 -0.1797 -0.0500 -0.0487 0.0289 0.0350 0.1789 0.1820 0.4717 0.4811 0.5442 0.5547 1.0580 1.0605 1.2107 1.2132 1.4482 1.4493 4.4905 4.4910 5.5344 5.5348 6.1176 6.1181 6.5415 6.5421 6.8307 6.8312 8.3585 8.3596 8.8503 8.8509 k = 0.5035-0.0378-0.0391 ( 8275 PWs) bands (ev): -17.0167 -17.0167 -16.2404 -16.2403 -16.1786 -16.1785 -13.0442 -13.0442 -12.9626 -12.9626 -12.8458 -12.8458 -12.6938 -12.6938 -11.4535 -11.4535 -11.3694 -11.3694 -6.3807 -6.3801 -6.3288 -6.3281 -5.8160 -5.8160 -5.4959 -5.4959 -4.2729 -4.2725 -3.9761 -3.9758 -3.4251 -3.4247 -2.8850 -2.8837 -2.5292 -2.5277 -2.2096 -2.2056 -2.0037 -1.9996 -1.8211 -1.8195 -0.6441 -0.6251 -0.5559 -0.5415 -0.4870 -0.4767 -0.1862 -0.1809 -0.0507 -0.0500 0.0289 0.0339 0.1744 0.1769 0.4736 0.4812 0.5498 0.5582 1.0606 1.0627 1.2089 1.2110 1.4532 1.4541 4.5052 4.5055 5.5207 5.5211 6.1200 6.1204 6.5403 6.5408 6.8296 6.8300 8.3543 8.3552 8.8493 8.8499 k = 0.5026-0.0244-0.0252 ( 8269 PWs) bands (ev): -17.0172 -17.0172 -16.2404 -16.2403 -16.1781 -16.1780 -13.0445 -13.0445 -12.9625 -12.9625 -12.8448 -12.8448 -12.6928 -12.6928 -11.4553 -11.4553 -11.3699 -11.3699 -6.3811 -6.3806 -6.3288 -6.3283 -5.8122 -5.8122 -5.4967 -5.4967 -4.2776 -4.2773 -3.9760 -3.9758 -3.4187 -3.4183 -2.8775 -2.8766 -2.5350 -2.5338 -2.2141 -2.2110 -2.0051 -2.0020 -1.8178 -1.8166 -0.6387 -0.6224 -0.5558 -0.5424 -0.4960 -0.4885 -0.1861 -0.1821 -0.0512 -0.0509 0.0292 0.0329 0.1710 0.1728 0.4753 0.4810 0.5545 0.5608 1.0627 1.0644 1.2074 1.2090 1.4571 1.4578 4.5169 4.5172 5.5097 5.5100 6.1218 6.1222 6.5393 6.5397 6.8288 6.8290 8.3511 8.3518 8.8485 8.8489 k = 0.5017-0.0110-0.0114 ( 8271 PWs) bands (ev): -17.0176 -17.0176 -16.2403 -16.2403 -16.1777 -16.1777 -13.0447 -13.0447 -12.9624 -12.9623 -12.8441 -12.8441 -12.6922 -12.6922 -11.4567 -11.4567 -11.3703 -11.3703 -6.3814 -6.3811 -6.3288 -6.3285 -5.8095 -5.8094 -5.4972 -5.4972 -4.2811 -4.2809 -3.9759 -3.9758 -3.4141 -3.4138 -2.8720 -2.8714 -2.5391 -2.5382 -2.2174 -2.2153 -2.0058 -2.0037 -1.8154 -1.8145 -0.6335 -0.6213 -0.5537 -0.5430 -0.5033 -0.4987 -0.1860 -0.1832 -0.0516 -0.0514 0.0295 0.0320 0.1685 0.1698 0.4768 0.4805 0.5584 0.5625 1.0643 1.0654 1.2064 1.2075 1.4600 1.4604 4.5256 4.5258 5.5016 5.5018 6.1232 6.1234 6.5387 6.5389 6.8281 6.8283 8.3489 8.3494 8.8479 8.8482 k = 0.5009 0.0024 0.0024 ( 8281 PWs) bands (ev): -17.0178 -17.0178 -16.2403 -16.2403 -16.1775 -16.1775 -13.0448 -13.0448 -12.9623 -12.9623 -12.8437 -12.8437 -12.6918 -12.6918 -11.4575 -11.4575 -11.3706 -11.3706 -6.3815 -6.3814 -6.3288 -6.3286 -5.8078 -5.8078 -5.4975 -5.4975 -4.2831 -4.2830 -3.9759 -3.9758 -3.4112 -3.4111 -2.8686 -2.8683 -2.5415 -2.5410 -2.2191 -2.2181 -2.0060 -2.0050 -1.8138 -1.8134 -0.6287 -0.6221 -0.5503 -0.5440 -0.5083 -0.5061 -0.1856 -0.1842 -0.0518 -0.0518 0.0300 0.0313 0.1672 0.1678 0.4780 0.4799 0.5611 0.5632 1.0654 1.0660 1.2059 1.2064 1.4618 1.4620 4.5309 4.5310 5.4967 5.4968 6.1241 6.1242 6.5383 6.5385 6.8278 6.8279 8.3476 8.3478 8.8475 8.8476 k = 0.5000 0.0158 0.0163 ( 8278 PWs) bands (ev): -17.0179 -17.0179 -16.2403 -16.2403 -16.1774 -16.1774 -13.0448 -13.0448 -12.9623 -12.9623 -12.8435 -12.8435 -12.6916 -12.6916 -11.4578 -11.4578 -11.3706 -11.3706 -6.3815 -6.3815 -6.3287 -6.3287 -5.8072 -5.8072 -5.4976 -5.4976 -4.2838 -4.2838 -3.9758 -3.9758 -3.4103 -3.4103 -2.8674 -2.8674 -2.5421 -2.5421 -2.2194 -2.2194 -2.0057 -2.0057 -1.8132 -1.8132 -0.6247 -0.6247 -0.5465 -0.5465 -0.5095 -0.5095 -0.1850 -0.1850 -0.0519 -0.0519 0.0306 0.0306 0.1670 0.1670 0.4791 0.4791 0.5627 0.5627 1.0659 1.0659 1.2059 1.2059 1.4624 1.4624 4.5327 4.5327 5.4951 5.4951 6.1244 6.1244 6.5383 6.5383 6.8277 6.8277 8.3473 8.3473 8.8474 8.8474 k = 0.5000 0.0158 0.0163 ( 8278 PWs) bands (ev): -17.0179 -17.0179 -16.2403 -16.2403 -16.1774 -16.1774 -13.0448 -13.0448 -12.9623 -12.9623 -12.8435 -12.8435 -12.6916 -12.6916 -11.4578 -11.4578 -11.3706 -11.3706 -6.3815 -6.3815 -6.3287 -6.3287 -5.8072 -5.8072 -5.4976 -5.4976 -4.2838 -4.2838 -3.9758 -3.9758 -3.4103 -3.4103 -2.8674 -2.8674 -2.5421 -2.5421 -2.2194 -2.2194 -2.0057 -2.0057 -1.8132 -1.8132 -0.6247 -0.6247 -0.5465 -0.5465 -0.5095 -0.5095 -0.1850 -0.1850 -0.0519 -0.0519 0.0306 0.0306 0.1670 0.1670 0.4791 0.4791 0.5627 0.5627 1.0659 1.0659 1.2059 1.2059 1.4624 1.4624 4.5327 4.5327 5.4951 5.4951 6.1244 6.1244 6.5383 6.5383 6.8277 6.8277 8.3473 8.3473 8.8474 8.8474 k = 0.5000 0.0019 0.0297 ( 8274 PWs) bands (ev): -17.0178 -17.0178 -16.2403 -16.2403 -16.1776 -16.1776 -13.0450 -13.0450 -12.9622 -12.9622 -12.8436 -12.8436 -12.6914 -12.6913 -11.4578 -11.4578 -11.3708 -11.3707 -6.3817 -6.3813 -6.3292 -6.3287 -5.8070 -5.8065 -5.4977 -5.4973 -4.2842 -4.2835 -3.9766 -3.9764 -3.4121 -3.4116 -2.8667 -2.8660 -2.5406 -2.5401 -2.2218 -2.2183 -2.0059 -2.0048 -1.8142 -1.8116 -0.6248 -0.6238 -0.5476 -0.5459 -0.5090 -0.5075 -0.1874 -0.1868 -0.0541 -0.0531 0.0300 0.0316 0.1686 0.1707 0.4770 0.4798 0.5610 0.5639 1.0655 1.0667 1.2053 1.2065 1.4613 1.4614 4.5337 4.5346 5.4930 5.4936 6.1239 6.1252 6.5386 6.5387 6.8272 6.8273 8.3494 8.3497 8.8468 8.8470 k = 0.5000-0.0120 0.0432 ( 8274 PWs) bands (ev): -17.0174 -17.0174 -16.2403 -16.2402 -16.1781 -16.1781 -13.0454 -13.0454 -12.9620 -12.9620 -12.8438 -12.8438 -12.6906 -12.6905 -11.4580 -11.4579 -11.3710 -11.3709 -6.3819 -6.3809 -6.3301 -6.3291 -5.8057 -5.8048 -5.4974 -5.4967 -4.2848 -4.2834 -3.9787 -3.9782 -3.4170 -3.4161 -2.8641 -2.8628 -2.5355 -2.5346 -2.2253 -2.2185 -2.0053 -2.0031 -1.8148 -1.8096 -0.6241 -0.6220 -0.5490 -0.5458 -0.5060 -0.5032 -0.1939 -0.1927 -0.0592 -0.0574 0.0300 0.0330 0.1754 0.1793 0.4738 0.4792 0.5588 0.5645 1.0654 1.0678 1.2048 1.2071 1.4580 1.4582 4.5374 4.5394 5.4876 5.4887 6.1237 6.1263 6.5398 6.5399 6.8258 6.8259 8.3560 8.3566 8.8451 8.8455 k = 0.5000-0.0259 0.0566 ( 8274 PWs) bands (ev): -17.0169 -17.0169 -16.2402 -16.2401 -16.1790 -16.1789 -13.0461 -13.0461 -12.9617 -12.9617 -12.8440 -12.8440 -12.6893 -12.6892 -11.4583 -11.4582 -11.3715 -11.3713 -6.3820 -6.3805 -6.3315 -6.3300 -5.8036 -5.8023 -5.4968 -5.4958 -4.2856 -4.2835 -3.9819 -3.9811 -3.4248 -3.4236 -2.8597 -2.8578 -2.5272 -2.5257 -2.2299 -2.2199 -2.0039 -2.0007 -1.8148 -1.8072 -0.6227 -0.6194 -0.5505 -0.5461 -0.5006 -0.4969 -0.2042 -0.2026 -0.0665 -0.0640 0.0306 0.0347 0.1862 0.1915 0.4694 0.4771 0.5565 0.5645 1.0656 1.0691 1.2044 1.2078 1.4525 1.4529 4.5438 4.5467 5.4790 5.4806 6.1238 6.1275 6.5418 6.5420 6.8235 6.8237 8.3671 8.3680 8.8424 8.8430 k = 0.5000-0.0398 0.0701 ( 8280 PWs) bands (ev): -17.0161 -17.0161 -16.2400 -16.2400 -16.1801 -16.1801 -13.0470 -13.0470 -12.9614 -12.9614 -12.8443 -12.8443 -12.6876 -12.6875 -11.4587 -11.4585 -11.3719 -11.3717 -6.3820 -6.3801 -6.3332 -6.3311 -5.8007 -5.7989 -5.4960 -5.4947 -4.2866 -4.2838 -3.9860 -3.9850 -3.4355 -3.4339 -2.8539 -2.8512 -2.5158 -2.5137 -2.2353 -2.2224 -2.0017 -1.9978 -1.8143 -1.8044 -0.6206 -0.6161 -0.5519 -0.5465 -0.4930 -0.4887 -0.2177 -0.2159 -0.0750 -0.0720 0.0317 0.0368 0.1998 0.2062 0.4640 0.4734 0.5541 0.5640 1.0661 1.0706 1.2040 1.2084 1.4451 1.4456 4.5526 4.5564 5.4677 5.4697 6.1241 6.1289 6.5445 6.5447 6.8204 6.8207 8.3823 8.3835 8.8388 8.8395 k = 0.5000-0.0537 0.0835 ( 8276 PWs) bands (ev): -17.0152 -17.0152 -16.2399 -16.2399 -16.1816 -16.1816 -13.0481 -13.0481 -12.9611 -12.9611 -12.8447 -12.8447 -12.6855 -12.6855 -11.4593 -11.4590 -11.3724 -11.3721 -6.3822 -6.3797 -6.3351 -6.3325 -5.7971 -5.7949 -5.4949 -5.4934 -4.2878 -4.2843 -3.9907 -3.9894 -3.4486 -3.4467 -2.8468 -2.8436 -2.5017 -2.4989 -2.2413 -2.2258 -1.9988 -1.9943 -1.8133 -1.8014 -0.6179 -0.6121 -0.5531 -0.5469 -0.4834 -0.4786 -0.2340 -0.2320 -0.0839 -0.0806 0.0332 0.0391 0.2150 0.2223 0.4575 0.4681 0.5520 0.5630 1.0667 1.0723 1.2036 1.2089 1.4357 1.4364 4.5632 4.5679 5.4543 5.4566 6.1245 6.1302 6.5479 6.5482 6.8166 6.8170 8.4016 8.4031 8.8343 8.8351 k = 0.5000-0.0676 0.0970 ( 8280 PWs) bands (ev): -17.0140 -17.0140 -16.2397 -16.2397 -16.1834 -16.1833 -13.0494 -13.0493 -12.9609 -12.9608 -12.8450 -12.8450 -12.6832 -12.6831 -11.4599 -11.4596 -11.3728 -11.3725 -6.3824 -6.3794 -6.3371 -6.3340 -5.7930 -5.7904 -5.4937 -5.4919 -4.2892 -4.2850 -3.9957 -3.9942 -3.4639 -3.4617 -2.8392 -2.8353 -2.4855 -2.4817 -2.2474 -2.2296 -1.9951 -1.9903 -1.8119 -1.7983 -0.6148 -0.6075 -0.5540 -0.5470 -0.4719 -0.4668 -0.2521 -0.2501 -0.0928 -0.0894 0.0349 0.0416 0.2310 0.2390 0.4502 0.4613 0.5502 0.5617 1.0674 1.0739 1.2032 1.2093 1.4245 1.4255 4.5752 4.5807 5.4394 5.4418 6.1249 6.1314 6.5520 6.5524 6.8124 6.8129 8.4246 8.4264 8.8289 8.8299 k = 0.5000-0.0815 0.1104 ( 8276 PWs) bands (ev): -17.0127 -17.0127 -16.2395 -16.2394 -16.1854 -16.1853 -13.0506 -13.0505 -12.9607 -12.9607 -12.8454 -12.8454 -12.6807 -12.6807 -11.4606 -11.4603 -11.3730 -11.3726 -6.3828 -6.3793 -6.3390 -6.3354 -5.7886 -5.7857 -5.4923 -5.4903 -4.2907 -4.2860 -4.0007 -3.9989 -3.4810 -3.4786 -2.8314 -2.8269 -2.4675 -2.4626 -2.2530 -2.2335 -1.9907 -1.9859 -1.8102 -1.7951 -0.6114 -0.6026 -0.5546 -0.5466 -0.4588 -0.4534 -0.2714 -0.2694 -0.1017 -0.0981 0.0366 0.0441 0.2470 0.2557 0.4421 0.4533 0.5486 0.5601 1.0682 1.0755 1.2027 1.2094 1.4118 1.4130 4.5877 4.5939 5.4239 5.4264 6.1251 6.1323 6.5567 6.5571 6.8078 6.8083 8.4509 8.4530 8.8229 8.8240 k = 0.5000-0.0954 0.1239 ( 8272 PWs) bands (ev): -17.0113 -17.0112 -16.2392 -16.2392 -16.1876 -16.1875 -13.0519 -13.0518 -12.9608 -12.9607 -12.8458 -12.8458 -12.6782 -12.6781 -11.4614 -11.4610 -11.3729 -11.3725 -6.3833 -6.3795 -6.3408 -6.3368 -5.7841 -5.7810 -5.4909 -5.4886 -4.2922 -4.2870 -4.0054 -4.0033 -3.4996 -3.4970 -2.8241 -2.8190 -2.4485 -2.4422 -2.2574 -2.2365 -1.9859 -1.9811 -1.8083 -1.7921 -0.6079 -0.5974 -0.5547 -0.5457 -0.4442 -0.4387 -0.2910 -0.2888 -0.1103 -0.1065 0.0382 0.0464 0.2625 0.2720 0.4334 0.4444 0.5472 0.5583 1.0689 1.0769 1.2020 1.2092 1.3978 1.3992 4.5997 4.6067 5.4088 5.4113 6.1252 6.1328 6.5620 6.5624 6.8029 6.8036 8.4800 8.4824 8.8163 8.8175 k = 0.5000-0.1093 0.1373 ( 8274 PWs) bands (ev): -17.0096 -17.0096 -16.2389 -16.2389 -16.1899 -16.1899 -13.0531 -13.0530 -12.9610 -12.9609 -12.8462 -12.8461 -12.6758 -12.6757 -11.4621 -11.4617 -11.3725 -11.3722 -6.3841 -6.3799 -6.3422 -6.3378 -5.7799 -5.7765 -5.4894 -5.4870 -4.2936 -4.2880 -4.0094 -4.0071 -3.5196 -3.5168 -2.8181 -2.8125 -2.4292 -2.4210 -2.2597 -2.2379 -1.9806 -1.9761 -1.8064 -1.7893 -0.6045 -0.5922 -0.5542 -0.5443 -0.4286 -0.4228 -0.3100 -0.3074 -0.1187 -0.1147 0.0395 0.0486 0.2771 0.2875 0.4243 0.4350 0.5459 0.5562 1.0694 1.0781 1.2011 1.2085 1.3827 1.3845 4.6103 4.6178 5.3954 5.3978 6.1248 6.1329 6.5677 6.5682 6.7981 6.7988 8.5114 8.5141 8.8094 8.8107 k = 0.5000-0.1232 0.1508 ( 8276 PWs) bands (ev): -17.0079 -17.0079 -16.2386 -16.2386 -16.1925 -16.1924 -13.0542 -13.0541 -12.9615 -12.9614 -12.8466 -12.8466 -12.6735 -12.6735 -11.4626 -11.4622 -11.3719 -11.3715 -6.3850 -6.3807 -6.3432 -6.3386 -5.7761 -5.7725 -5.4880 -5.4854 -4.2947 -4.2886 -4.0127 -4.0101 -3.5404 -3.5375 -2.8140 -2.8080 -2.4104 -2.3998 -2.2586 -2.2366 -1.9751 -1.9708 -1.8046 -1.7869 -0.6011 -0.5873 -0.5529 -0.5422 -0.4128 -0.4067 -0.3270 -0.3238 -0.1268 -0.1225 0.0406 0.0504 0.2905 0.3021 0.4149 0.4255 0.5445 0.5539 1.0697 1.0788 1.1999 1.2073 1.3667 1.3690 4.6181 4.6261 5.3850 5.3872 6.1241 6.1324 6.5738 6.5744 6.7933 6.7941 8.5441 8.5471 8.8028 8.8041 k = 0.5000-0.1371 0.1642 ( 8276 PWs) bands (ev): -17.0061 -17.0061 -16.2383 -16.2382 -16.1951 -16.1950 -13.0552 -13.0551 -12.9622 -12.9621 -12.8471 -12.8471 -12.6716 -12.6715 -11.4629 -11.4625 -11.3709 -11.3705 -6.3861 -6.3817 -6.3437 -6.3391 -5.7730 -5.7693 -5.4867 -5.4840 -4.2950 -4.2887 -4.0150 -4.0123 -3.5620 -3.5589 -2.8126 -2.8064 -2.3927 -2.3797 -2.2532 -2.2314 -1.9695 -1.9653 -1.8031 -1.7850 -0.5978 -0.5828 -0.5511 -0.5399 -0.3987 -0.3925 -0.3395 -0.3355 -0.1346 -0.1299 0.0412 0.0518 0.3024 0.3154 0.4056 0.4167 0.5428 0.5512 1.0697 1.0791 1.1982 1.2056 1.3504 1.3532 4.6219 4.6302 5.3787 5.3809 6.1228 6.1312 6.5803 6.5810 6.7888 6.7896 8.5770 8.5803 8.7972 8.7986 k = 0.5000-0.1510 0.1777 ( 8280 PWs) bands (ev): -17.0042 -17.0042 -16.2379 -16.2379 -16.1978 -16.1977 -13.0559 -13.0558 -12.9631 -12.9631 -12.8478 -12.8478 -12.6700 -12.6700 -11.4628 -11.4624 -11.3695 -11.3691 -6.3872 -6.3829 -6.3437 -6.3392 -5.7710 -5.7673 -5.4855 -5.4828 -4.2943 -4.2879 -4.0164 -4.0136 -3.5840 -3.5808 -2.8144 -2.8082 -2.3767 -2.3612 -2.2425 -2.2215 -1.9641 -1.9599 -1.8019 -1.7838 -0.5946 -0.5788 -0.5487 -0.5375 -0.3912 -0.3862 -0.3410 -0.3372 -0.1420 -0.1369 0.0413 0.0529 0.3124 0.3272 0.3967 0.4090 0.5406 0.5481 1.0692 1.0788 1.1962 1.2031 1.3339 1.3375 4.6206 4.6289 5.3778 5.3799 6.1210 6.1294 6.5872 6.5879 6.7846 6.7855 8.6077 8.6112 8.7945 8.7959 k = 0.5000-0.1649 0.1911 ( 8276 PWs) bands (ev): -17.0022 -17.0022 -16.2376 -16.2375 -16.2006 -16.2005 -13.0563 -13.0562 -12.9643 -12.9642 -12.8487 -12.8487 -12.6690 -12.6689 -11.4621 -11.4617 -11.3679 -11.3675 -6.3883 -6.3841 -6.3434 -6.3391 -5.7704 -5.7666 -5.4845 -5.4818 -4.2923 -4.2858 -4.0168 -4.0141 -3.6063 -3.6030 -2.8199 -2.8139 -2.3621 -2.3446 -2.2264 -2.2067 -1.9589 -1.9545 -1.8012 -1.7833 -0.5914 -0.5750 -0.5462 -0.5356 -0.3927 -0.3897 -0.3292 -0.3262 -0.1489 -0.1434 0.0409 0.0535 0.3200 0.3370 0.3892 0.4031 0.5377 0.5444 1.0682 1.0779 1.1935 1.2000 1.3177 1.3221 4.6132 4.6215 5.3830 5.3852 6.1185 6.1268 6.5943 6.5951 6.7808 6.7818 8.6326 8.6364 8.7977 8.7994 k = 0.5000-0.1788 0.2046 ( 8262 PWs) bands (ev): -17.0002 -17.0002 -16.2372 -16.2371 -16.2033 -16.2032 -13.0565 -13.0564 -12.9657 -12.9656 -12.8499 -12.8499 -12.6685 -12.6684 -11.4608 -11.4604 -11.3660 -11.3656 -6.3891 -6.3852 -6.3428 -6.3387 -5.7713 -5.7677 -5.4835 -5.4809 -4.2886 -4.2822 -4.0165 -4.0137 -3.6286 -3.6252 -2.8294 -2.8237 -2.3482 -2.3296 -2.2057 -2.1873 -1.9544 -1.9495 -1.8010 -1.7835 -0.5881 -0.5715 -0.5440 -0.5344 -0.3981 -0.3951 -0.3111 -0.3082 -0.1553 -0.1493 0.0401 0.0537 0.3248 0.3439 0.3841 0.3997 0.5339 0.5400 1.0665 1.0763 1.1902 1.1963 1.3022 1.3075 4.5995 4.6074 5.3949 5.3972 6.1155 6.1236 6.6017 6.6025 6.7776 6.7786 8.6475 8.6512 8.8108 8.8128 k = 0.5000-0.1927 0.2180 ( 8256 PWs) bands (ev): -16.9982 -16.9982 -16.2368 -16.2367 -16.2060 -16.2059 -13.0563 -13.0561 -12.9672 -12.9671 -12.8514 -12.8514 -12.6686 -12.6686 -11.4587 -11.4583 -11.3639 -11.3635 -6.3896 -6.3859 -6.3420 -6.3381 -5.7741 -5.7706 -5.4825 -5.4801 -4.2830 -4.2767 -4.0153 -4.0126 -3.6509 -3.6474 -2.8428 -2.8376 -2.3343 -2.3154 -2.1816 -2.1645 -1.9507 -1.9451 -1.8011 -1.7843 -0.5848 -0.5681 -0.5423 -0.5340 -0.4026 -0.3986 -0.2907 -0.2877 -0.1609 -0.1545 0.0388 0.0535 0.3268 0.3467 0.3829 0.3991 0.5289 0.5347 1.0642 1.0738 1.1862 1.1919 1.2877 1.2940 4.5794 4.5868 5.4132 5.4158 6.1117 6.1197 6.6093 6.6103 6.7749 6.7760 8.6505 8.6540 8.8353 8.8377 k = 0.5000-0.2066 0.2315 ( 8258 PWs) bands (ev): -16.9963 -16.9962 -16.2364 -16.2364 -16.2086 -16.2085 -13.0557 -13.0556 -12.9689 -12.9688 -12.8532 -12.8532 -12.6695 -12.6694 -11.4557 -11.4554 -11.3616 -11.3612 -6.3898 -6.3863 -6.3410 -6.3374 -5.7789 -5.7757 -5.4815 -5.4792 -4.2754 -4.2693 -4.0136 -4.0109 -3.6729 -3.6693 -2.8598 -2.8551 -2.3200 -2.3013 -2.1550 -2.1391 -1.9481 -1.9416 -1.8015 -1.7855 -0.5815 -0.5646 -0.5410 -0.5342 -0.4045 -0.3993 -0.2699 -0.2668 -0.1653 -0.1586 0.0369 0.0529 0.3264 0.3458 0.3857 0.4010 0.5226 0.5285 1.0612 1.0706 1.1816 1.1870 1.2745 1.2817 4.5534 4.5603 5.4374 5.4402 6.1073 6.1150 6.6172 6.6182 6.7727 6.7739 8.6436 8.6469 8.8684 8.8712 k = 0.5000-0.2205 0.2449 ( 8254 PWs) bands (ev): -16.9943 -16.9943 -16.2360 -16.2359 -16.2111 -16.2110 -13.0547 -13.0546 -12.9707 -12.9706 -12.8555 -12.8555 -12.6710 -12.6710 -11.4519 -11.4515 -11.3591 -11.3588 -6.3894 -6.3862 -6.3399 -6.3366 -5.7860 -5.7830 -5.4803 -5.4782 -4.2655 -4.2596 -4.0113 -4.0088 -3.6946 -3.6909 -2.8800 -2.8760 -2.3049 -2.2869 -2.1271 -2.1121 -1.9469 -1.9394 -1.8017 -1.7868 -0.5787 -0.5613 -0.5400 -0.5339 -0.4036 -0.3973 -0.2499 -0.2468 -0.1680 -0.1614 0.0346 0.0520 0.3246 0.3432 0.3903 0.4046 0.5150 0.5213 1.0573 1.0665 1.1765 1.1819 1.2628 1.2707 4.5224 4.5286 5.4668 5.4698 6.1024 6.1098 6.6254 6.6264 6.7711 6.7723 8.6301 8.6333 8.9065 8.9096 k = 0.5000-0.2344 0.2584 ( 8266 PWs) bands (ev): -16.9924 -16.9924 -16.2356 -16.2355 -16.2135 -16.2134 -13.0533 -13.0532 -12.9725 -12.9725 -12.8583 -12.8582 -12.6733 -12.6732 -11.4471 -11.4468 -11.3566 -11.3563 -6.3885 -6.3856 -6.3388 -6.3358 -5.7952 -5.7926 -5.4788 -5.4770 -4.2534 -4.2479 -4.0086 -4.0063 -3.7157 -3.7119 -2.9030 -2.8995 -2.2894 -2.2722 -2.0986 -2.0842 -1.9474 -1.9387 -1.8016 -1.7879 -0.5763 -0.5581 -0.5392 -0.5320 -0.4003 -0.3928 -0.2325 -0.2293 -0.1675 -0.1618 0.0319 0.0508 0.3226 0.3408 0.3951 0.4091 0.5060 0.5133 1.0526 1.0615 1.1714 1.1768 1.2525 1.2610 4.4872 4.4927 5.5002 5.5035 6.0969 6.1039 6.6339 6.6349 6.7700 6.7711 8.6122 8.6152 8.9469 8.9502 k = 0.5000-0.2483 0.2718 ( 8268 PWs) bands (ev): -16.9906 -16.9905 -16.2352 -16.2351 -16.2157 -16.2156 -13.0515 -13.0514 -12.9745 -12.9744 -12.8614 -12.8614 -12.6762 -12.6762 -11.4414 -11.4411 -11.3541 -11.3538 -6.3870 -6.3844 -6.3378 -6.3349 -5.8067 -5.8044 -5.4771 -5.4754 -4.2393 -4.2340 -4.0057 -4.0035 -3.7362 -3.7324 -2.9281 -2.9252 -2.2734 -2.2573 -2.0703 -2.0562 -1.9497 -1.9398 -1.8008 -1.7885 -0.5743 -0.5554 -0.5374 -0.5282 -0.3950 -0.3864 -0.2203 -0.2160 -0.1619 -0.1584 0.0287 0.0493 0.3212 0.3394 0.3991 0.4137 0.4960 0.5047 1.0470 1.0555 1.1666 1.1719 1.2437 1.2524 4.4487 4.4536 5.5368 5.5403 6.0909 6.0976 6.6427 6.6437 6.7692 6.7704 8.5912 8.5942 8.9878 8.9912 k = 0.5000-0.2622 0.2853 ( 8266 PWs) bands (ev): -16.9888 -16.9888 -16.2348 -16.2347 -16.2178 -16.2177 -13.0493 -13.0492 -12.9764 -12.9763 -12.8650 -12.8650 -12.6799 -12.6798 -11.4348 -11.4345 -11.3515 -11.3512 -6.3850 -6.3825 -6.3367 -6.3341 -5.8202 -5.8183 -5.4749 -5.4736 -4.2232 -4.2182 -4.0026 -4.0005 -3.7561 -3.7521 -2.9549 -2.9524 -2.2574 -2.2423 -2.0429 -2.0288 -1.9534 -1.9423 -1.7992 -1.7882 -0.5724 -0.5531 -0.5337 -0.5231 -0.3882 -0.3786 -0.2143 -0.2081 -0.1515 -0.1496 0.0251 0.0474 0.3211 0.3394 0.4014 0.4174 0.4855 0.4962 1.0405 1.0486 1.1625 1.1675 1.2362 1.2447 4.4079 4.4121 5.5757 5.5792 6.0845 6.0908 6.6517 6.6528 6.7689 6.7701 8.5679 8.5708 9.0277 9.0312 k = 0.5000-0.2761 0.2987 ( 8266 PWs) bands (ev): -16.9871 -16.9871 -16.2344 -16.2343 -16.2197 -16.2196 -13.0466 -13.0465 -12.9783 -12.9783 -12.8691 -12.8690 -12.6841 -12.6841 -11.4274 -11.4272 -11.3490 -11.3487 -6.3823 -6.3801 -6.3357 -6.3333 -5.8355 -5.8339 -5.4725 -5.4713 -4.2055 -4.2007 -3.9995 -3.9975 -3.7752 -3.7711 -2.9827 -2.9806 -2.2416 -2.2275 -2.0184 -2.0042 -1.9567 -1.9447 -1.7966 -1.7869 -0.5700 -0.5508 -0.5282 -0.5171 -0.3803 -0.3696 -0.2128 -0.2047 -0.1395 -0.1356 0.0211 0.0453 0.3227 0.3412 0.4012 0.4188 0.4762 0.4888 1.0331 1.0407 1.1594 1.1640 1.2296 1.2378 4.3655 4.3691 5.6158 5.6195 6.0779 6.0838 6.6611 6.6622 6.7688 6.7700 8.5429 8.5458 9.0654 9.0689 k = 0.5000-0.2899 0.3122 ( 8266 PWs) bands (ev): -16.9856 -16.9855 -16.2340 -16.2339 -16.2214 -16.2213 -13.0436 -13.0435 -12.9802 -12.9802 -12.8735 -12.8735 -12.6889 -12.6889 -11.4194 -11.4191 -11.3465 -11.3463 -6.3792 -6.3771 -6.3348 -6.3326 -5.8523 -5.8510 -5.4697 -5.4688 -4.1864 -4.1819 -3.9963 -3.9945 -3.7934 -3.7892 -3.0111 -3.0094 -2.2262 -2.2133 -2.0012 -1.9898 -1.9521 -1.9430 -1.7931 -1.7847 -0.5667 -0.5477 -0.5215 -0.5104 -0.3717 -0.3599 -0.2133 -0.2039 -0.1270 -0.1205 0.0167 0.0427 0.3262 0.3444 0.3979 0.4159 0.4702 0.4837 1.0248 1.0318 1.1574 1.1616 1.2238 1.2314 4.3224 4.3254 5.6566 5.6603 6.0711 6.0766 6.6708 6.6719 6.7690 6.7701 8.5167 8.5195 9.0997 9.1030 k = 0.5000-0.3038 0.3257 ( 8262 PWs) bands (ev): -16.9841 -16.9841 -16.2336 -16.2335 -16.2230 -16.2229 -13.0402 -13.0401 -12.9821 -12.9820 -12.8782 -12.8782 -12.6942 -12.6942 -11.4108 -11.4106 -11.3441 -11.3439 -6.3755 -6.3736 -6.3339 -6.3320 -5.8702 -5.8691 -5.4668 -5.4660 -4.1662 -4.1619 -3.9932 -3.9914 -3.8106 -3.8063 -3.0397 -3.0382 -2.2116 -2.1997 -1.9977 -1.9912 -1.9336 -1.9308 -1.7888 -1.7816 -0.5622 -0.5435 -0.5140 -0.5034 -0.3624 -0.3495 -0.2145 -0.2044 -0.1152 -0.1065 0.0118 0.0396 0.3312 0.3485 0.3919 0.4080 0.4690 0.4815 1.0156 1.0219 1.1566 1.1603 1.2186 1.2256 4.2791 4.2816 5.6972 5.7009 6.0641 6.0693 6.6807 6.6818 6.7693 6.7704 8.4897 8.4925 9.1292 9.1323 k = 0.5000-0.3177 0.3391 ( 8252 PWs) bands (ev): -16.9828 -16.9827 -16.2333 -16.2332 -16.2243 -16.2242 -13.0364 -13.0363 -12.9838 -12.9838 -12.8832 -12.8832 -12.6999 -12.6999 -11.4018 -11.4016 -11.3418 -11.3416 -6.3714 -6.3697 -6.3331 -6.3314 -5.8887 -5.8879 -5.4637 -5.4631 -4.1453 -4.1412 -3.9901 -3.9885 -3.8269 -3.8225 -3.0679 -3.0666 -2.1978 -2.1870 -2.0051 -1.9994 -1.9113 -1.9096 -1.7840 -1.7779 -0.5565 -0.5380 -0.5062 -0.4962 -0.3527 -0.3385 -0.2158 -0.2053 -0.1049 -0.0942 0.0063 0.0357 0.3363 0.3505 0.3867 0.3980 0.4714 0.4821 1.0054 1.0111 1.1570 1.1602 1.2139 1.2202 4.2364 4.2384 5.7371 5.7407 6.0573 6.0620 6.6908 6.6918 6.7698 6.7708 8.4624 8.4651 9.1530 9.1558 k = 0.5000-0.3316 0.3526 ( 8250 PWs) bands (ev): -16.9815 -16.9815 -16.2329 -16.2328 -16.2255 -16.2254 -13.0323 -13.0323 -12.9855 -12.9855 -12.8884 -12.8883 -12.7058 -12.7058 -11.3926 -11.3925 -11.3396 -11.3394 -6.3670 -6.3655 -6.3325 -6.3309 -5.9076 -5.9069 -5.4605 -5.4601 -4.1242 -4.1202 -3.9872 -3.9857 -3.8422 -3.8376 -3.0955 -3.0944 -2.1851 -2.1753 -2.0165 -2.0107 -1.8887 -1.8860 -1.7790 -1.7737 -0.5496 -0.5313 -0.4982 -0.4890 -0.3426 -0.3271 -0.2171 -0.2065 -0.0966 -0.0841 0.0003 0.0308 0.3371 0.3461 0.3871 0.3926 0.4760 0.4847 0.9945 0.9995 1.1584 1.1612 1.2097 1.2153 4.1947 4.1963 5.7758 5.7792 6.0506 6.0548 6.7009 6.7019 6.7703 6.7712 8.4352 8.4378 9.1705 9.1732 k = 0.5000-0.3455 0.3660 ( 8246 PWs) bands (ev): -16.9804 -16.9804 -16.2325 -16.2324 -16.2266 -16.2265 -13.0281 -13.0280 -12.9870 -12.9870 -12.8936 -12.8936 -12.7119 -12.7119 -11.3834 -11.3833 -11.3376 -11.3374 -6.3624 -6.3611 -6.3319 -6.3305 -5.9263 -5.9258 -5.4574 -5.4571 -4.1031 -4.0991 -3.9845 -3.9830 -3.8563 -3.8516 -3.1220 -3.1210 -2.1736 -2.1648 -2.0292 -2.0235 -1.8662 -1.8631 -1.7737 -1.7693 -0.5417 -0.5236 -0.4901 -0.4819 -0.3320 -0.3152 -0.2182 -0.2077 -0.0900 -0.0763 -0.0063 0.0248 0.3285 0.3358 0.3920 0.3996 0.4815 0.4885 0.9828 0.9872 1.1606 1.1631 1.2058 1.2107 4.1547 4.1560 5.8126 5.8159 6.0441 6.0480 6.7110 6.7120 6.7708 6.7716 8.4085 8.4111 9.1819 9.1845 k = 0.5000-0.3594 0.3795 ( 8232 PWs) bands (ev): -16.9795 -16.9794 -16.2322 -16.2321 -16.2274 -16.2273 -13.0236 -13.0236 -12.9885 -12.9884 -12.8989 -12.8989 -12.7180 -12.7180 -11.3744 -11.3742 -11.3357 -11.3356 -6.3576 -6.3565 -6.3314 -6.3302 -5.9445 -5.9442 -5.4544 -5.4541 -4.0825 -4.0785 -3.9820 -3.9804 -3.8694 -3.8644 -3.1471 -3.1463 -2.1632 -2.1555 -2.0423 -2.0368 -1.8447 -1.8416 -1.7686 -1.7649 -0.5329 -0.5151 -0.4822 -0.4750 -0.3212 -0.3029 -0.2190 -0.2089 -0.0851 -0.0708 -0.0136 0.0174 0.3142 0.3215 0.4033 0.4127 0.4873 0.4931 0.9706 0.9743 1.1635 1.1657 1.2023 1.2065 4.1168 4.1178 5.8473 5.8503 6.0380 6.0414 6.7209 6.7218 6.7712 6.7720 8.3828 8.3852 9.1882 9.1907 k = 0.5000-0.3733 0.3929 ( 8224 PWs) bands (ev): -16.9786 -16.9786 -16.2319 -16.2318 -16.2282 -16.2281 -13.0191 -13.0190 -12.9897 -12.9897 -12.9041 -12.9041 -12.7240 -12.7240 -11.3657 -11.3656 -11.3340 -11.3339 -6.3530 -6.3520 -6.3309 -6.3299 -5.9618 -5.9616 -5.4516 -5.4514 -4.0627 -4.0587 -3.9797 -3.9781 -3.8812 -3.8761 -3.1706 -3.1699 -2.1542 -2.1475 -2.0551 -2.0501 -1.8247 -1.8218 -1.7636 -1.7605 -0.5237 -0.5064 -0.4744 -0.4684 -0.3099 -0.2904 -0.2196 -0.2101 -0.0815 -0.0676 -0.0216 0.0086 0.2986 0.3055 0.4185 0.4282 0.4933 0.4980 0.9579 0.9610 1.1669 1.1688 1.1991 1.2026 4.0815 4.0822 5.8793 5.8821 6.0323 6.0354 6.7304 6.7313 6.7717 6.7724 8.3585 8.3608 9.1903 9.1928 k = 0.5000-0.3872 0.4064 ( 8236 PWs) bands (ev): -16.9779 -16.9778 -16.2316 -16.2315 -16.2288 -16.2287 -13.0146 -13.0145 -12.9909 -12.9909 -12.9091 -12.9091 -12.7298 -12.7298 -11.3575 -11.3574 -11.3325 -11.3324 -6.3485 -6.3476 -6.3305 -6.3297 -5.9779 -5.9778 -5.4490 -5.4488 -4.0441 -4.0401 -3.9776 -3.9759 -3.8919 -3.8866 -3.1922 -3.1916 -2.1465 -2.1408 -2.0671 -2.0626 -1.8065 -1.8038 -1.7589 -1.7564 -0.5143 -0.4978 -0.4669 -0.4621 -0.2983 -0.2775 -0.2199 -0.2114 -0.0790 -0.0664 -0.0301 -0.0016 0.2832 0.2895 0.4355 0.4446 0.4991 0.5029 0.9451 0.9477 1.1705 1.1721 1.1962 1.1992 4.0493 4.0498 5.9084 5.9109 6.0272 6.0298 6.7394 6.7402 6.7721 6.7727 8.3360 8.3381 9.1894 9.1918 k = 0.5000-0.4011 0.4198 ( 8222 PWs) bands (ev): -16.9772 -16.9772 -16.2313 -16.2312 -16.2293 -16.2292 -13.0102 -13.0101 -12.9919 -12.9918 -12.9139 -12.9139 -12.7352 -12.7352 -11.3500 -11.3500 -11.3312 -11.3311 -6.3443 -6.3435 -6.3302 -6.3295 -5.9925 -5.9924 -5.4467 -5.4466 -4.0270 -4.0230 -3.9757 -3.9738 -3.9013 -3.8959 -3.2115 -3.2110 -2.1402 -2.1357 -2.0777 -2.0740 -1.7902 -1.7879 -1.7547 -1.7526 -0.5051 -0.4898 -0.4598 -0.4562 -0.2864 -0.2646 -0.2199 -0.2126 -0.0773 -0.0673 -0.0386 -0.0130 0.2690 0.2746 0.4530 0.4613 0.5045 0.5076 0.9325 0.9345 1.1741 1.1754 1.1937 1.1962 4.0204 4.0208 5.9343 5.9365 6.0227 6.0249 6.7477 6.7484 6.7724 6.7730 8.3157 8.3175 9.1866 9.1888 k = 0.5000-0.4150 0.4333 ( 8216 PWs) bands (ev): -16.9767 -16.9767 -16.2310 -16.2310 -16.2296 -16.2296 -13.0060 -13.0060 -12.9927 -12.9927 -12.9182 -12.9182 -12.7401 -12.7401 -11.3434 -11.3434 -11.3300 -11.3299 -6.3405 -6.3400 -6.3298 -6.3293 -6.0053 -6.0052 -5.4447 -5.4446 -4.0118 -4.0079 -3.9740 -3.9720 -3.9095 -3.9040 -3.2283 -3.2279 -2.1355 -2.1321 -2.0865 -2.0837 -1.7762 -1.7743 -1.7508 -1.7493 -0.4966 -0.4829 -0.4531 -0.4506 -0.2743 -0.2518 -0.2197 -0.2138 -0.0762 -0.0701 -0.0464 -0.0256 0.2565 0.2612 0.4698 0.4771 0.5096 0.5120 0.9204 0.9220 1.1775 1.1786 1.1916 1.1936 3.9954 3.9956 5.9565 5.9584 6.0188 6.0207 6.7551 6.7557 6.7727 6.7732 8.2978 8.2994 9.1826 9.1846 k = 0.5000-0.4289 0.4467 ( 8220 PWs) bands (ev): -16.9763 -16.9763 -16.2308 -16.2308 -16.2299 -16.2299 -13.0023 -13.0022 -12.9934 -12.9933 -12.9220 -12.9220 -12.7444 -12.7443 -11.3378 -11.3378 -11.3291 -11.3290 -6.3374 -6.3370 -6.3294 -6.3291 -6.0160 -6.0160 -5.4430 -5.4429 -3.9986 -3.9952 -3.9724 -3.9702 -3.9163 -3.9109 -3.2425 -3.2422 -2.1325 -2.1303 -2.0931 -2.0913 -1.7646 -1.7631 -1.7475 -1.7464 -0.4889 -0.4774 -0.4470 -0.4455 -0.2622 -0.2398 -0.2194 -0.2150 -0.0770 -0.0733 -0.0529 -0.0386 0.2461 0.2499 0.4852 0.4913 0.5142 0.5161 0.9094 0.9106 1.1805 1.1814 1.1899 1.1914 3.9744 3.9745 5.9750 5.9765 6.0158 6.0172 6.7614 6.7619 6.7730 6.7733 8.2828 8.2841 9.1784 9.1801 k = 0.5000-0.4428 0.4602 ( 8220 PWs) bands (ev): -16.9759 -16.9759 -16.2307 -16.2306 -16.2302 -16.2301 -12.9991 -12.9991 -12.9939 -12.9939 -12.9252 -12.9252 -12.7478 -12.7478 -11.3333 -11.3333 -11.3283 -11.3283 -6.3350 -6.3348 -6.3289 -6.3287 -6.0246 -6.0245 -5.4417 -5.4417 -3.9879 -3.9853 -3.9710 -3.9685 -3.9217 -3.9167 -3.2537 -3.2535 -2.1312 -2.1301 -2.0974 -2.0964 -1.7555 -1.7546 -1.7446 -1.7439 -0.4825 -0.4736 -0.4418 -0.4412 -0.2506 -0.2292 -0.2191 -0.2159 -0.0819 -0.0731 -0.0583 -0.0512 0.2379 0.2408 0.4980 0.5028 0.5184 0.5198 0.8999 0.9008 1.1830 1.1836 1.1886 1.1898 3.9578 3.9579 5.9894 5.9905 6.0137 6.0147 6.7665 6.7669 6.7732 6.7734 8.2709 8.2719 9.1745 9.1758 k = 0.5000-0.4567 0.4736 ( 8218 PWs) bands (ev): -16.9757 -16.9757 -16.2306 -16.2305 -16.2303 -16.2303 -12.9966 -12.9966 -12.9942 -12.9942 -12.9277 -12.9276 -12.7504 -12.7504 -11.3301 -11.3300 -11.3278 -11.3278 -6.3335 -6.3334 -6.3283 -6.3282 -6.0308 -6.0308 -5.4408 -5.4407 -3.9800 -3.9787 -3.9694 -3.9666 -3.9255 -3.9214 -3.2618 -3.2617 -2.1312 -2.1308 -2.0997 -2.0992 -1.7493 -1.7489 -1.7420 -1.7417 -0.4773 -0.4713 -0.4379 -0.4377 -0.2402 -0.2220 -0.2188 -0.2159 -0.0864 -0.0729 -0.0650 -0.0598 0.2321 0.2340 0.5073 0.5104 0.5226 0.5233 0.8926 0.8932 1.1848 1.1851 1.1879 1.1887 3.9458 3.9458 5.9992 5.9999 6.0129 6.0134 6.7703 6.7706 6.7733 6.7735 8.2622 8.2629 9.1714 9.1723 k = 0.5000-0.4706 0.4871 ( 8210 PWs) bands (ev): -16.9756 -16.9756 -16.2305 -16.2305 -16.2303 -16.2303 -12.9951 -12.9951 -12.9944 -12.9944 -12.9292 -12.9292 -12.7519 -12.7519 -11.3281 -11.3281 -11.3274 -11.3274 -6.3327 -6.3327 -6.3278 -6.3278 -6.0346 -6.0345 -5.4402 -5.4402 -3.9756 -3.9754 -3.9674 -3.9652 -3.9274 -3.9250 -3.2668 -3.2667 -2.1317 -2.1317 -2.1007 -2.1005 -1.7460 -1.7460 -1.7399 -1.7399 -0.4736 -0.4706 -0.4355 -0.4355 -0.2318 -0.2226 -0.2154 -0.2149 -0.0877 -0.0780 -0.0680 -0.0637 0.2288 0.2298 0.5127 0.5141 0.5261 0.5262 0.8881 0.8884 1.1856 1.1857 1.1878 1.1882 3.9385 3.9385 6.0041 6.0042 6.0137 6.0138 6.7726 6.7728 6.7734 6.7735 8.2571 8.2574 9.1695 9.1700 k = 0.5000-0.4845 0.5005 ( 8198 PWs) bands (ev): -16.9755 -16.9755 -16.2305 -16.2305 -16.2304 -16.2304 -12.9946 -12.9946 -12.9944 -12.9944 -12.9297 -12.9297 -12.7525 -12.7525 -11.3276 -11.3276 -11.3272 -11.3272 -6.3325 -6.3325 -6.3276 -6.3276 -6.0358 -6.0358 -5.4400 -5.4400 -3.9744 -3.9744 -3.9655 -3.9655 -3.9271 -3.9271 -3.2684 -3.2684 -2.1320 -2.1320 -2.1009 -2.1009 -1.7451 -1.7451 -1.7391 -1.7391 -0.4714 -0.4714 -0.4347 -0.4347 -0.2260 -0.2260 -0.2141 -0.2141 -0.0847 -0.0847 -0.0664 -0.0664 0.2281 0.2281 0.5147 0.5147 0.5275 0.5275 0.8866 0.8866 1.1858 1.1858 1.1880 1.1880 3.9361 3.9361 6.0052 6.0052 6.0145 6.0145 6.7734 6.7734 6.7736 6.7736 8.2554 8.2554 9.1690 9.1690 Writing output data file BNCl2.save init_run : 3.81s CPU 12.21s WALL ( 1 calls) electrons : 1778.02s CPU 1796.83s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.22s CPU 1.52s WALL ( 1 calls) Called by electrons: c_bands : 1778.01s CPU 1796.01s WALL ( 1 calls) v_of_rho : 0.06s CPU 1.00s WALL ( 1 calls) v_h : 0.01s CPU 0.02s WALL ( 1 calls) v_xc : 0.04s CPU 0.63s WALL ( 1 calls) newd : 0.72s CPU 0.98s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.21s WALL ( 282 calls) cegterg : 1652.60s CPU 1664.29s WALL ( 653 calls) Called by sum_band: Called by *egterg: h_psi : 756.78s CPU 769.32s WALL ( 10953 calls) s_psi : 99.07s CPU 99.39s WALL ( 10953 calls) g_psi : 1.74s CPU 1.71s WALL ( 10018 calls) cdiaghg : 580.86s CPU 579.33s WALL ( 10300 calls) cegterg:over : 134.64s CPU 132.12s WALL ( 10018 calls) cegterg:upda : 45.95s CPU 48.60s WALL ( 10018 calls) cegterg:last : 38.29s CPU 38.84s WALL ( 1772 calls) Called by h_psi: h_psi:vloc : 556.80s CPU 566.74s WALL ( 10953 calls) h_psi:vnl : 198.90s CPU 200.82s WALL ( 10953 calls) add_vuspsi : 79.67s CPU 82.60s WALL ( 10953 calls) General routines calbec : 119.14s CPU 118.08s WALL ( 10953 calls) fft : 0.13s CPU 1.10s WALL ( 19 calls) ffts : 0.01s CPU 0.01s WALL ( 4 calls) fftw : 522.83s CPU 532.06s WALL ( 1567272 calls) interpolate : 0.04s CPU 0.04s WALL ( 4 calls) davcio : 0.05s CPU 3.93s WALL ( 564 calls) Parallel routines fft_scatter : 299.20s CPU 299.87s WALL ( 1567295 calls) PWSCF : 31m26.88s CPU 35m42.27s WALL This run was terminated on: 6:56:30 7Dec2015 =------------------------------------------------------------------------------= JOB DONE. 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