Program PWSCF v.5.1.1 starts on 28Jun2015 at 1:58: 6 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: ./HgBr2.save/ file Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S renormalized file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 39 18 5 4009 1312 205 Max 40 19 6 4024 1355 214 Sum 1895 911 265 192643 64207 10041 bravais-lattice index = 14 lattice parameter (alat) = 7.8333 a.u. unit-cell volume = 1343.8269 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 416.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.833330 celldm(2)= 1.000000 celldm(3)= 3.003459 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.365388 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.365388 0.930855 0.000000 ) a(3) = ( 0.000000 0.000000 3.003459 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.392529 -0.000000 ) b(2) = ( 0.000000 1.074281 -0.000000 ) b(3) = ( 0.000000 0.000000 0.332949 ) PseudoPot. # 1 for Hg read from file: /home/autes/Pseudo/Hg.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: a7fd98bfb2640362c6e2ed76594f1960 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1279 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 Br read from file: /home/autes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 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 1213 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 Hg 12.00 200.59000 Hg( 1.00) Br 7.00 79.90400 Br( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.5017297 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 350 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 2) = ( 0.0073239 0.0107428 -0.0000000), wk = 0.0028571 k( 3) = ( 0.0146479 0.0214856 -0.0000000), wk = 0.0028571 k( 4) = ( 0.0219718 0.0322284 -0.0000000), wk = 0.0028571 k( 5) = ( 0.0292957 0.0429712 -0.0000000), wk = 0.0028571 k( 6) = ( 0.0366196 0.0537140 -0.0000000), wk = 0.0028571 k( 7) = ( 0.0439436 0.0644568 -0.0000000), wk = 0.0028571 k( 8) = ( 0.0512675 0.0751996 -0.0000000), wk = 0.0028571 k( 9) = ( 0.0585914 0.0859424 -0.0000000), wk = 0.0028571 k( 10) = ( 0.0659153 0.0966853 -0.0000000), wk = 0.0028571 k( 11) = ( 0.0732393 0.1074281 -0.0000000), wk = 0.0028571 k( 12) = ( 0.0805632 0.1181709 -0.0000000), wk = 0.0028571 k( 13) = ( 0.0878871 0.1289137 -0.0000000), wk = 0.0028571 k( 14) = ( 0.0952111 0.1396565 -0.0000000), wk = 0.0028571 k( 15) = ( 0.1025350 0.1503993 -0.0000000), wk = 0.0028571 k( 16) = ( 0.1098589 0.1611421 -0.0000000), wk = 0.0028571 k( 17) = ( 0.1171828 0.1718849 -0.0000000), wk = 0.0028571 k( 18) = ( 0.1245068 0.1826277 -0.0000000), wk = 0.0028571 k( 19) = ( 0.1318307 0.1933705 -0.0000000), wk = 0.0028571 k( 20) = ( 0.1391546 0.2041133 -0.0000000), wk = 0.0028571 k( 21) = ( 0.1464786 0.2148561 -0.0000000), wk = 0.0028571 k( 22) = ( 0.1538025 0.2255989 -0.0000000), wk = 0.0028571 k( 23) = ( 0.1611264 0.2363417 -0.0000000), wk = 0.0028571 k( 24) = ( 0.1684503 0.2470845 -0.0000000), wk = 0.0028571 k( 25) = ( 0.1757743 0.2578274 -0.0000000), wk = 0.0028571 k( 26) = ( 0.1830982 0.2685702 -0.0000000), wk = 0.0028571 k( 27) = ( 0.1904221 0.2793130 -0.0000000), wk = 0.0028571 k( 28) = ( 0.1977461 0.2900558 -0.0000000), wk = 0.0028571 k( 29) = ( 0.2050700 0.3007986 -0.0000000), wk = 0.0028571 k( 30) = ( 0.2123939 0.3115414 -0.0000000), wk = 0.0028571 k( 31) = ( 0.2197178 0.3222842 -0.0000000), wk = 0.0028571 k( 32) = ( 0.2270418 0.3330270 -0.0000000), wk = 0.0028571 k( 33) = ( 0.2343657 0.3437698 -0.0000000), wk = 0.0028571 k( 34) = ( 0.2416896 0.3545126 -0.0000000), wk = 0.0028571 k( 35) = ( 0.2490135 0.3652554 -0.0000000), wk = 0.0028571 k( 36) = ( 0.2563375 0.3759982 -0.0000000), wk = 0.0028571 k( 37) = ( 0.2636614 0.3867410 -0.0000000), wk = 0.0028571 k( 38) = ( 0.2709853 0.3974838 -0.0000000), wk = 0.0028571 k( 39) = ( 0.2783093 0.4082266 -0.0000000), wk = 0.0028571 k( 40) = ( 0.2856332 0.4189694 -0.0000000), wk = 0.0028571 k( 41) = ( 0.2929571 0.4297122 -0.0000000), wk = 0.0028571 k( 42) = ( 0.3002810 0.4404551 -0.0000000), wk = 0.0028571 k( 43) = ( 0.3076050 0.4511979 -0.0000000), wk = 0.0028571 k( 44) = ( 0.3149289 0.4619407 -0.0000000), wk = 0.0028571 k( 45) = ( 0.3222528 0.4726835 -0.0000000), wk = 0.0028571 k( 46) = ( 0.3295767 0.4834263 -0.0000000), wk = 0.0028571 k( 47) = ( 0.3369007 0.4941691 -0.0000000), wk = 0.0028571 k( 48) = ( 0.3442246 0.5049119 -0.0000000), wk = 0.0028571 k( 49) = ( 0.3515485 0.5156547 -0.0000000), wk = 0.0028571 k( 50) = ( 0.3588725 0.5263975 -0.0000000), wk = 0.0028571 k( 51) = ( 0.3661964 0.5371403 -0.0000000), wk = 0.0028571 k( 52) = ( 0.3661964 0.5371403 -0.0000000), wk = 0.0028571 k( 53) = ( 0.3531180 0.5371403 -0.0000000), wk = 0.0028571 k( 54) = ( 0.3400395 0.5371403 -0.0000000), wk = 0.0028571 k( 55) = ( 0.3269611 0.5371403 -0.0000000), wk = 0.0028571 k( 56) = ( 0.3138826 0.5371403 -0.0000000), wk = 0.0028571 k( 57) = ( 0.3008042 0.5371403 -0.0000000), wk = 0.0028571 k( 58) = ( 0.2877257 0.5371403 -0.0000000), wk = 0.0028571 k( 59) = ( 0.2746473 0.5371403 -0.0000000), wk = 0.0028571 k( 60) = ( 0.2615689 0.5371403 -0.0000000), wk = 0.0028571 k( 61) = ( 0.2484904 0.5371403 -0.0000000), wk = 0.0028571 k( 62) = ( 0.2354120 0.5371403 -0.0000000), wk = 0.0028571 k( 63) = ( 0.2223335 0.5371403 -0.0000000), wk = 0.0028571 k( 64) = ( 0.2092551 0.5371403 -0.0000000), wk = 0.0028571 k( 65) = ( 0.1961766 0.5371403 -0.0000000), wk = 0.0028571 k( 66) = ( 0.1830982 0.5371403 -0.0000000), wk = 0.0028571 k( 67) = ( 0.1700197 0.5371403 -0.0000000), wk = 0.0028571 k( 68) = ( 0.1569413 0.5371403 -0.0000000), wk = 0.0028571 k( 69) = ( 0.1438629 0.5371403 -0.0000000), wk = 0.0028571 k( 70) = ( 0.1307844 0.5371403 -0.0000000), wk = 0.0028571 k( 71) = ( 0.1177060 0.5371403 -0.0000000), wk = 0.0028571 k( 72) = ( 0.1046275 0.5371403 -0.0000000), wk = 0.0028571 k( 73) = ( 0.0915491 0.5371403 -0.0000000), wk = 0.0028571 k( 74) = ( 0.0784707 0.5371403 -0.0000000), wk = 0.0028571 k( 75) = ( 0.0653922 0.5371403 -0.0000000), wk = 0.0028571 k( 76) = ( 0.0523138 0.5371403 -0.0000000), wk = 0.0028571 k( 77) = ( 0.0392353 0.5371403 -0.0000000), wk = 0.0028571 k( 78) = ( 0.0261569 0.5371403 -0.0000000), wk = 0.0028571 k( 79) = ( 0.0130784 0.5371403 -0.0000000), wk = 0.0028571 k( 80) = ( 0.0000000 0.5371403 -0.0000000), wk = 0.0028571 k( 81) = ( 0.0000000 0.5371403 -0.0000000), wk = 0.0028571 k( 82) = ( 0.0000000 0.5371403 0.0128057), wk = 0.0028571 k( 83) = ( 0.0000000 0.5371403 0.0256115), wk = 0.0028571 k( 84) = ( 0.0000000 0.5371403 0.0384172), wk = 0.0028571 k( 85) = ( 0.0000000 0.5371403 0.0512230), wk = 0.0028571 k( 86) = ( 0.0000000 0.5371403 0.0640287), wk = 0.0028571 k( 87) = ( 0.0000000 0.5371403 0.0768345), wk = 0.0028571 k( 88) = ( 0.0000000 0.5371403 0.0896402), wk = 0.0028571 k( 89) = ( 0.0000000 0.5371403 0.1024460), wk = 0.0028571 k( 90) = ( 0.0000000 0.5371403 0.1152517), wk = 0.0028571 k( 91) = ( 0.0000000 0.5371403 0.1280575), wk = 0.0028571 k( 92) = ( 0.0000000 0.5371403 0.1408632), wk = 0.0028571 k( 93) = ( 0.0000000 0.5371403 0.1536690), wk = 0.0028571 k( 94) = ( 0.0000000 0.5371403 0.1664747), wk = 0.0028571 k( 95) = ( 0.0000000 0.5371403 0.1664747), wk = 0.0028571 k( 96) = ( 0.0130784 0.5371403 0.1664747), wk = 0.0028571 k( 97) = ( 0.0261569 0.5371403 0.1664747), wk = 0.0028571 k( 98) = ( 0.0392353 0.5371403 0.1664747), wk = 0.0028571 k( 99) = ( 0.0523138 0.5371403 0.1664747), wk = 0.0028571 k( 100) = ( 0.0653922 0.5371403 0.1664747), wk = 0.0028571 k( 101) = ( 0.0784707 0.5371403 0.1664747), wk = 0.0028571 k( 102) = ( 0.0915491 0.5371403 0.1664747), wk = 0.0028571 k( 103) = ( 0.1046275 0.5371403 0.1664747), wk = 0.0028571 k( 104) = ( 0.1177060 0.5371403 0.1664747), wk = 0.0028571 k( 105) = ( 0.1307844 0.5371403 0.1664747), wk = 0.0028571 k( 106) = ( 0.1438629 0.5371403 0.1664747), wk = 0.0028571 k( 107) = ( 0.1569413 0.5371403 0.1664747), wk = 0.0028571 k( 108) = ( 0.1700197 0.5371403 0.1664747), wk = 0.0028571 k( 109) = ( 0.1830982 0.5371403 0.1664747), wk = 0.0028571 k( 110) = ( 0.1961766 0.5371403 0.1664747), wk = 0.0028571 k( 111) = ( 0.2092551 0.5371403 0.1664747), wk = 0.0028571 k( 112) = ( 0.2223335 0.5371403 0.1664747), wk = 0.0028571 k( 113) = ( 0.2354120 0.5371403 0.1664747), wk = 0.0028571 k( 114) = ( 0.2484904 0.5371403 0.1664747), wk = 0.0028571 k( 115) = ( 0.2615689 0.5371403 0.1664747), wk = 0.0028571 k( 116) = ( 0.2746473 0.5371403 0.1664747), wk = 0.0028571 k( 117) = ( 0.2877257 0.5371403 0.1664747), wk = 0.0028571 k( 118) = ( 0.3008042 0.5371403 0.1664747), wk = 0.0028571 k( 119) = ( 0.3138826 0.5371403 0.1664747), wk = 0.0028571 k( 120) = ( 0.3269611 0.5371403 0.1664747), wk = 0.0028571 k( 121) = ( 0.3400395 0.5371403 0.1664747), wk = 0.0028571 k( 122) = ( 0.3531180 0.5371403 0.1664747), wk = 0.0028571 k( 123) = ( 0.3661964 0.5371403 0.1664747), wk = 0.0028571 k( 124) = ( 0.3661964 0.5371403 0.1664747), wk = 0.0028571 k( 125) = ( 0.3588725 0.5263975 0.1664747), wk = 0.0028571 k( 126) = ( 0.3515485 0.5156547 0.1664747), wk = 0.0028571 k( 127) = ( 0.3442246 0.5049119 0.1664747), wk = 0.0028571 k( 128) = ( 0.3369007 0.4941691 0.1664747), wk = 0.0028571 k( 129) = ( 0.3295767 0.4834263 0.1664747), wk = 0.0028571 k( 130) = ( 0.3222528 0.4726835 0.1664747), wk = 0.0028571 k( 131) = ( 0.3149289 0.4619407 0.1664747), wk = 0.0028571 k( 132) = ( 0.3076050 0.4511979 0.1664747), wk = 0.0028571 k( 133) = ( 0.3002810 0.4404551 0.1664747), wk = 0.0028571 k( 134) = ( 0.2929571 0.4297122 0.1664747), wk = 0.0028571 k( 135) = ( 0.2856332 0.4189694 0.1664747), wk = 0.0028571 k( 136) = ( 0.2783093 0.4082266 0.1664747), wk = 0.0028571 k( 137) = ( 0.2709853 0.3974838 0.1664747), wk = 0.0028571 k( 138) = ( 0.2636614 0.3867410 0.1664747), wk = 0.0028571 k( 139) = ( 0.2563375 0.3759982 0.1664747), wk = 0.0028571 k( 140) = ( 0.2490135 0.3652554 0.1664747), wk = 0.0028571 k( 141) = ( 0.2416896 0.3545126 0.1664747), wk = 0.0028571 k( 142) = ( 0.2343657 0.3437698 0.1664747), wk = 0.0028571 k( 143) = ( 0.2270418 0.3330270 0.1664747), wk = 0.0028571 k( 144) = ( 0.2197178 0.3222842 0.1664747), wk = 0.0028571 k( 145) = ( 0.2123939 0.3115414 0.1664747), wk = 0.0028571 k( 146) = ( 0.2050700 0.3007986 0.1664747), wk = 0.0028571 k( 147) = ( 0.1977461 0.2900558 0.1664747), wk = 0.0028571 k( 148) = ( 0.1904221 0.2793130 0.1664747), wk = 0.0028571 k( 149) = ( 0.1830982 0.2685702 0.1664747), wk = 0.0028571 k( 150) = ( 0.1757743 0.2578274 0.1664747), wk = 0.0028571 k( 151) = ( 0.1684503 0.2470845 0.1664747), wk = 0.0028571 k( 152) = ( 0.1611264 0.2363417 0.1664747), wk = 0.0028571 k( 153) = ( 0.1538025 0.2255989 0.1664747), wk = 0.0028571 k( 154) = ( 0.1464786 0.2148561 0.1664747), wk = 0.0028571 k( 155) = ( 0.1391546 0.2041133 0.1664747), wk = 0.0028571 k( 156) = ( 0.1318307 0.1933705 0.1664747), wk = 0.0028571 k( 157) = ( 0.1245068 0.1826277 0.1664747), wk = 0.0028571 k( 158) = ( 0.1171828 0.1718849 0.1664747), wk = 0.0028571 k( 159) = ( 0.1098589 0.1611421 0.1664747), wk = 0.0028571 k( 160) = ( 0.1025350 0.1503993 0.1664747), wk = 0.0028571 k( 161) = ( 0.0952111 0.1396565 0.1664747), wk = 0.0028571 k( 162) = ( 0.0878871 0.1289137 0.1664747), wk = 0.0028571 k( 163) = ( 0.0805632 0.1181709 0.1664747), wk = 0.0028571 k( 164) = ( 0.0732393 0.1074281 0.1664747), wk = 0.0028571 k( 165) = ( 0.0659153 0.0966853 0.1664747), wk = 0.0028571 k( 166) = ( 0.0585914 0.0859424 0.1664747), wk = 0.0028571 k( 167) = ( 0.0512675 0.0751996 0.1664747), wk = 0.0028571 k( 168) = ( 0.0439436 0.0644568 0.1664747), wk = 0.0028571 k( 169) = ( 0.0366196 0.0537140 0.1664747), wk = 0.0028571 k( 170) = ( 0.0292957 0.0429712 0.1664747), wk = 0.0028571 k( 171) = ( 0.0219718 0.0322284 0.1664747), wk = 0.0028571 k( 172) = ( 0.0146479 0.0214856 0.1664747), wk = 0.0028571 k( 173) = ( 0.0073239 0.0107428 0.1664747), wk = 0.0028571 k( 174) = ( 0.0000000 0.0000000 0.1664747), wk = 0.0028571 k( 175) = ( 0.0000000 0.0000000 0.1664747), wk = 0.0028571 k( 176) = ( 0.0000000 0.0000000 0.1536690), wk = 0.0028571 k( 177) = ( 0.0000000 0.0000000 0.1408632), wk = 0.0028571 k( 178) = ( 0.0000000 0.0000000 0.1280575), wk = 0.0028571 k( 179) = ( 0.0000000 0.0000000 0.1152517), wk = 0.0028571 k( 180) = ( 0.0000000 0.0000000 0.1024460), wk = 0.0028571 k( 181) = ( 0.0000000 0.0000000 0.0896402), wk = 0.0028571 k( 182) = ( 0.0000000 0.0000000 0.0768345), wk = 0.0028571 k( 183) = ( 0.0000000 0.0000000 0.0640287), wk = 0.0028571 k( 184) = ( 0.0000000 0.0000000 0.0512230), wk = 0.0028571 k( 185) = ( 0.0000000 0.0000000 0.0384172), wk = 0.0028571 k( 186) = ( 0.0000000 0.0000000 0.0256115), wk = 0.0028571 k( 187) = ( 0.0000000 0.0000000 0.0128057), wk = 0.0028571 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 190) = ( -0.0108696 0.0074103 0.0000000), wk = 0.0028571 k( 191) = ( -0.0217391 0.0148207 0.0000000), wk = 0.0028571 k( 192) = ( -0.0326087 0.0222310 0.0000000), wk = 0.0028571 k( 193) = ( -0.0434783 0.0296414 0.0000000), wk = 0.0028571 k( 194) = ( -0.0543478 0.0370517 0.0000000), wk = 0.0028571 k( 195) = ( -0.0652174 0.0444621 0.0000000), wk = 0.0028571 k( 196) = ( -0.0760870 0.0518724 0.0000000), wk = 0.0028571 k( 197) = ( -0.0869565 0.0592828 0.0000000), wk = 0.0028571 k( 198) = ( -0.0978261 0.0666931 0.0000000), wk = 0.0028571 k( 199) = ( -0.1086957 0.0741035 0.0000000), wk = 0.0028571 k( 200) = ( -0.1195652 0.0815138 0.0000000), wk = 0.0028571 k( 201) = ( -0.1304348 0.0889241 0.0000000), wk = 0.0028571 k( 202) = ( -0.1413043 0.0963345 0.0000000), wk = 0.0028571 k( 203) = ( -0.1521739 0.1037448 0.0000000), wk = 0.0028571 k( 204) = ( -0.1630435 0.1111552 0.0000000), wk = 0.0028571 k( 205) = ( -0.1739130 0.1185655 0.0000000), wk = 0.0028571 k( 206) = ( -0.1847826 0.1259759 0.0000000), wk = 0.0028571 k( 207) = ( -0.1956522 0.1333862 0.0000000), wk = 0.0028571 k( 208) = ( -0.2065217 0.1407966 0.0000000), wk = 0.0028571 k( 209) = ( -0.2173913 0.1482069 0.0000000), wk = 0.0028571 k( 210) = ( -0.2282609 0.1556173 0.0000000), wk = 0.0028571 k( 211) = ( -0.2391304 0.1630276 0.0000000), wk = 0.0028571 k( 212) = ( -0.2500000 0.1704380 0.0000000), wk = 0.0028571 k( 213) = ( -0.2608696 0.1778483 0.0000000), wk = 0.0028571 k( 214) = ( -0.2717391 0.1852586 0.0000000), wk = 0.0028571 k( 215) = ( -0.2826087 0.1926690 0.0000000), wk = 0.0028571 k( 216) = ( -0.2934783 0.2000793 0.0000000), wk = 0.0028571 k( 217) = ( -0.3043478 0.2074897 0.0000000), wk = 0.0028571 k( 218) = ( -0.3152174 0.2149000 0.0000000), wk = 0.0028571 k( 219) = ( -0.3260870 0.2223104 0.0000000), wk = 0.0028571 k( 220) = ( -0.3369565 0.2297207 0.0000000), wk = 0.0028571 k( 221) = ( -0.3478261 0.2371311 0.0000000), wk = 0.0028571 k( 222) = ( -0.3586956 0.2445414 0.0000000), wk = 0.0028571 k( 223) = ( -0.3695652 0.2519518 0.0000000), wk = 0.0028571 k( 224) = ( -0.3804348 0.2593621 0.0000000), wk = 0.0028571 k( 225) = ( -0.3913044 0.2667725 0.0000000), wk = 0.0028571 k( 226) = ( -0.4021739 0.2741828 0.0000000), wk = 0.0028571 k( 227) = ( -0.4130435 0.2815931 0.0000000), wk = 0.0028571 k( 228) = ( -0.4239130 0.2890035 0.0000000), wk = 0.0028571 k( 229) = ( -0.4347826 0.2964138 0.0000000), wk = 0.0028571 k( 230) = ( -0.4456522 0.3038242 0.0000000), wk = 0.0028571 k( 231) = ( -0.4565217 0.3112345 0.0000000), wk = 0.0028571 k( 232) = ( -0.4673913 0.3186449 0.0000000), wk = 0.0028571 k( 233) = ( -0.4782609 0.3260552 0.0000000), wk = 0.0028571 k( 234) = ( -0.4891304 0.3334656 0.0000000), wk = 0.0028571 k( 235) = ( -0.5000000 0.3408759 0.0000000), wk = 0.0028571 k( 236) = ( -0.5000000 0.3408759 0.0000000), wk = 0.0028571 k( 237) = ( -0.4929577 0.3512056 -0.0000000), wk = 0.0028571 k( 238) = ( -0.4859154 0.3615353 -0.0000000), wk = 0.0028571 k( 239) = ( -0.4788731 0.3718650 -0.0000000), wk = 0.0028571 k( 240) = ( -0.4718308 0.3821947 -0.0000000), wk = 0.0028571 k( 241) = ( -0.4647885 0.3925244 -0.0000000), wk = 0.0028571 k( 242) = ( -0.4577462 0.4028541 -0.0000000), wk = 0.0028571 k( 243) = ( -0.4507039 0.4131839 -0.0000000), wk = 0.0028571 k( 244) = ( -0.4436616 0.4235135 -0.0000000), wk = 0.0028571 k( 245) = ( -0.4366193 0.4338433 -0.0000000), wk = 0.0028571 k( 246) = ( -0.4295771 0.4441730 -0.0000000), wk = 0.0028571 k( 247) = ( -0.4225348 0.4545027 -0.0000000), wk = 0.0028571 k( 248) = ( -0.4154925 0.4648324 -0.0000000), wk = 0.0028571 k( 249) = ( -0.4084502 0.4751621 -0.0000000), wk = 0.0028571 k( 250) = ( -0.4014079 0.4854918 -0.0000000), wk = 0.0028571 k( 251) = ( -0.3943656 0.4958215 -0.0000000), wk = 0.0028571 k( 252) = ( -0.3873233 0.5061512 -0.0000000), wk = 0.0028571 k( 253) = ( -0.3802810 0.5164809 -0.0000000), wk = 0.0028571 k( 254) = ( -0.3732387 0.5268106 -0.0000000), wk = 0.0028571 k( 255) = ( -0.3661964 0.5371403 -0.0000000), wk = 0.0028571 k( 256) = ( -0.3661964 0.5371403 -0.0000000), wk = 0.0028571 k( 257) = ( -0.3661964 0.5371403 0.0128057), wk = 0.0028571 k( 258) = ( -0.3661964 0.5371403 0.0256115), wk = 0.0028571 k( 259) = ( -0.3661964 0.5371403 0.0384172), wk = 0.0028571 k( 260) = ( -0.3661964 0.5371403 0.0512230), wk = 0.0028571 k( 261) = ( -0.3661964 0.5371403 0.0640287), wk = 0.0028571 k( 262) = ( -0.3661964 0.5371403 0.0768345), wk = 0.0028571 k( 263) = ( -0.3661964 0.5371403 0.0896402), wk = 0.0028571 k( 264) = ( -0.3661964 0.5371403 0.1024460), wk = 0.0028571 k( 265) = ( -0.3661964 0.5371403 0.1152517), wk = 0.0028571 k( 266) = ( -0.3661964 0.5371403 0.1280575), wk = 0.0028571 k( 267) = ( -0.3661964 0.5371403 0.1408632), wk = 0.0028571 k( 268) = ( -0.3661964 0.5371403 0.1536690), wk = 0.0028571 k( 269) = ( -0.3661964 0.5371403 0.1664747), wk = 0.0028571 k( 270) = ( -0.3661964 0.5371403 0.1664747), wk = 0.0028571 k( 271) = ( -0.3732387 0.5268106 0.1664747), wk = 0.0028571 k( 272) = ( -0.3802810 0.5164809 0.1664747), wk = 0.0028571 k( 273) = ( -0.3873233 0.5061512 0.1664747), wk = 0.0028571 k( 274) = ( -0.3943656 0.4958215 0.1664747), wk = 0.0028571 k( 275) = ( -0.4014079 0.4854918 0.1664747), wk = 0.0028571 k( 276) = ( -0.4084502 0.4751621 0.1664747), wk = 0.0028571 k( 277) = ( -0.4154925 0.4648324 0.1664747), wk = 0.0028571 k( 278) = ( -0.4225348 0.4545027 0.1664747), wk = 0.0028571 k( 279) = ( -0.4295771 0.4441730 0.1664747), wk = 0.0028571 k( 280) = ( -0.4366193 0.4338433 0.1664747), wk = 0.0028571 k( 281) = ( -0.4436616 0.4235135 0.1664747), wk = 0.0028571 k( 282) = ( -0.4507039 0.4131839 0.1664747), wk = 0.0028571 k( 283) = ( -0.4577462 0.4028541 0.1664747), wk = 0.0028571 k( 284) = ( -0.4647885 0.3925244 0.1664747), wk = 0.0028571 k( 285) = ( -0.4718308 0.3821947 0.1664747), wk = 0.0028571 k( 286) = ( -0.4788731 0.3718650 0.1664747), wk = 0.0028571 k( 287) = ( -0.4859154 0.3615353 0.1664747), wk = 0.0028571 k( 288) = ( -0.4929577 0.3512056 0.1664747), wk = 0.0028571 k( 289) = ( -0.5000000 0.3408759 0.1664747), wk = 0.0028571 k( 290) = ( -0.5000000 0.3408759 0.1664747), wk = 0.0028571 k( 291) = ( -0.5000000 0.3408759 0.1536690), wk = 0.0028571 k( 292) = ( -0.5000000 0.3408759 0.1408632), wk = 0.0028571 k( 293) = ( -0.5000000 0.3408759 0.1280575), wk = 0.0028571 k( 294) = ( -0.5000000 0.3408759 0.1152517), wk = 0.0028571 k( 295) = ( -0.5000000 0.3408759 0.1024460), wk = 0.0028571 k( 296) = ( -0.5000000 0.3408759 0.0896402), wk = 0.0028571 k( 297) = ( -0.5000000 0.3408759 0.0768345), wk = 0.0028571 k( 298) = ( -0.5000000 0.3408759 0.0640287), wk = 0.0028571 k( 299) = ( -0.5000000 0.3408759 0.0512230), wk = 0.0028571 k( 300) = ( -0.5000000 0.3408759 0.0384172), wk = 0.0028571 k( 301) = ( -0.5000000 0.3408759 0.0256115), wk = 0.0028571 k( 302) = ( -0.5000000 0.3408759 0.0128057), wk = 0.0028571 k( 303) = ( -0.5000000 0.3408759 0.0000000), wk = 0.0028571 k( 304) = ( 0.0000000 0.0000000 0.1664747), wk = 0.0028571 k( 305) = ( -0.0108696 0.0074103 0.1664747), wk = 0.0028571 k( 306) = ( -0.0217391 0.0148207 0.1664747), wk = 0.0028571 k( 307) = ( -0.0326087 0.0222310 0.1664747), wk = 0.0028571 k( 308) = ( -0.0434783 0.0296414 0.1664747), wk = 0.0028571 k( 309) = ( -0.0543478 0.0370517 0.1664747), wk = 0.0028571 k( 310) = ( -0.0652174 0.0444621 0.1664747), wk = 0.0028571 k( 311) = ( -0.0760870 0.0518724 0.1664747), wk = 0.0028571 k( 312) = ( -0.0869565 0.0592828 0.1664747), wk = 0.0028571 k( 313) = ( -0.0978261 0.0666931 0.1664747), wk = 0.0028571 k( 314) = ( -0.1086957 0.0741035 0.1664747), wk = 0.0028571 k( 315) = ( -0.1195652 0.0815138 0.1664747), wk = 0.0028571 k( 316) = ( -0.1304348 0.0889241 0.1664747), wk = 0.0028571 k( 317) = ( -0.1413043 0.0963345 0.1664747), wk = 0.0028571 k( 318) = ( -0.1521739 0.1037448 0.1664747), wk = 0.0028571 k( 319) = ( -0.1630435 0.1111552 0.1664747), wk = 0.0028571 k( 320) = ( -0.1739130 0.1185655 0.1664747), wk = 0.0028571 k( 321) = ( -0.1847826 0.1259759 0.1664747), wk = 0.0028571 k( 322) = ( -0.1956522 0.1333862 0.1664747), wk = 0.0028571 k( 323) = ( -0.2065217 0.1407966 0.1664747), wk = 0.0028571 k( 324) = ( -0.2173913 0.1482069 0.1664747), wk = 0.0028571 k( 325) = ( -0.2282609 0.1556173 0.1664747), wk = 0.0028571 k( 326) = ( -0.2391304 0.1630276 0.1664747), wk = 0.0028571 k( 327) = ( -0.2500000 0.1704380 0.1664747), wk = 0.0028571 k( 328) = ( -0.2608696 0.1778483 0.1664747), wk = 0.0028571 k( 329) = ( -0.2717391 0.1852586 0.1664747), wk = 0.0028571 k( 330) = ( -0.2826087 0.1926690 0.1664747), wk = 0.0028571 k( 331) = ( -0.2934783 0.2000793 0.1664747), wk = 0.0028571 k( 332) = ( -0.3043478 0.2074897 0.1664747), wk = 0.0028571 k( 333) = ( -0.3152174 0.2149000 0.1664747), wk = 0.0028571 k( 334) = ( -0.3260870 0.2223104 0.1664747), wk = 0.0028571 k( 335) = ( -0.3369565 0.2297207 0.1664747), wk = 0.0028571 k( 336) = ( -0.3478261 0.2371311 0.1664747), wk = 0.0028571 k( 337) = ( -0.3586956 0.2445414 0.1664747), wk = 0.0028571 k( 338) = ( -0.3695652 0.2519518 0.1664747), wk = 0.0028571 k( 339) = ( -0.3804348 0.2593621 0.1664747), wk = 0.0028571 k( 340) = ( -0.3913044 0.2667725 0.1664747), wk = 0.0028571 k( 341) = ( -0.4021739 0.2741828 0.1664747), wk = 0.0028571 k( 342) = ( -0.4130435 0.2815931 0.1664747), wk = 0.0028571 k( 343) = ( -0.4239130 0.2890035 0.1664747), wk = 0.0028571 k( 344) = ( -0.4347826 0.2964138 0.1664747), wk = 0.0028571 k( 345) = ( -0.4456522 0.3038242 0.1664747), wk = 0.0028571 k( 346) = ( -0.4565217 0.3112345 0.1664747), wk = 0.0028571 k( 347) = ( -0.4673913 0.3186449 0.1664747), wk = 0.0028571 k( 348) = ( -0.4782609 0.3260552 0.1664747), wk = 0.0028571 k( 349) = ( -0.4891304 0.3334656 0.1664747), wk = 0.0028571 k( 350) = ( -0.5000000 0.3408759 0.1664747), wk = 0.0028571 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 2) = ( 0.0073239 0.0073239 -0.0000000), wk = 0.0028571 k( 3) = ( 0.0146479 0.0146479 -0.0000000), wk = 0.0028571 k( 4) = ( 0.0219718 0.0219718 -0.0000000), wk = 0.0028571 k( 5) = ( 0.0292957 0.0292957 0.0000000), wk = 0.0028571 k( 6) = ( 0.0366196 0.0366196 0.0000000), wk = 0.0028571 k( 7) = ( 0.0439436 0.0439436 0.0000000), wk = 0.0028571 k( 8) = ( 0.0512675 0.0512675 -0.0000000), wk = 0.0028571 k( 9) = ( 0.0585914 0.0585914 0.0000000), wk = 0.0028571 k( 10) = ( 0.0659153 0.0659153 -0.0000000), wk = 0.0028571 k( 11) = ( 0.0732393 0.0732393 0.0000000), wk = 0.0028571 k( 12) = ( 0.0805632 0.0805632 0.0000000), wk = 0.0028571 k( 13) = ( 0.0878871 0.0878871 0.0000000), wk = 0.0028571 k( 14) = ( 0.0952111 0.0952111 0.0000000), wk = 0.0028571 k( 15) = ( 0.1025350 0.1025350 0.0000000), wk = 0.0028571 k( 16) = ( 0.1098589 0.1098589 0.0000000), wk = 0.0028571 k( 17) = ( 0.1171828 0.1171828 0.0000000), wk = 0.0028571 k( 18) = ( 0.1245068 0.1245068 0.0000000), wk = 0.0028571 k( 19) = ( 0.1318307 0.1318307 -0.0000000), wk = 0.0028571 k( 20) = ( 0.1391546 0.1391546 0.0000000), wk = 0.0028571 k( 21) = ( 0.1464786 0.1464786 0.0000000), wk = 0.0028571 k( 22) = ( 0.1538025 0.1538025 0.0000000), wk = 0.0028571 k( 23) = ( 0.1611264 0.1611264 0.0000000), wk = 0.0028571 k( 24) = ( 0.1684503 0.1684503 0.0000000), wk = 0.0028571 k( 25) = ( 0.1757743 0.1757743 -0.0000000), wk = 0.0028571 k( 26) = ( 0.1830982 0.1830982 0.0000000), wk = 0.0028571 k( 27) = ( 0.1904221 0.1904221 0.0000000), wk = 0.0028571 k( 28) = ( 0.1977461 0.1977461 0.0000000), wk = 0.0028571 k( 29) = ( 0.2050700 0.2050700 0.0000000), wk = 0.0028571 k( 30) = ( 0.2123939 0.2123939 0.0000000), wk = 0.0028571 k( 31) = ( 0.2197178 0.2197178 0.0000000), wk = 0.0028571 k( 32) = ( 0.2270418 0.2270418 0.0000000), wk = 0.0028571 k( 33) = ( 0.2343657 0.2343657 0.0000000), wk = 0.0028571 k( 34) = ( 0.2416896 0.2416896 0.0000000), wk = 0.0028571 k( 35) = ( 0.2490135 0.2490135 0.0000000), wk = 0.0028571 k( 36) = ( 0.2563375 0.2563375 0.0000000), wk = 0.0028571 k( 37) = ( 0.2636614 0.2636614 -0.0000000), wk = 0.0028571 k( 38) = ( 0.2709853 0.2709853 0.0000000), wk = 0.0028571 k( 39) = ( 0.2783093 0.2783092 0.0000000), wk = 0.0028571 k( 40) = ( 0.2856332 0.2856332 0.0000000), wk = 0.0028571 k( 41) = ( 0.2929571 0.2929571 0.0000000), wk = 0.0028571 k( 42) = ( 0.3002810 0.3002810 0.0000000), wk = 0.0028571 k( 43) = ( 0.3076050 0.3076050 0.0000000), wk = 0.0028571 k( 44) = ( 0.3149289 0.3149289 0.0000000), wk = 0.0028571 k( 45) = ( 0.3222528 0.3222528 0.0000000), wk = 0.0028571 k( 46) = ( 0.3295767 0.3295767 0.0000000), wk = 0.0028571 k( 47) = ( 0.3369007 0.3369007 0.0000000), wk = 0.0028571 k( 48) = ( 0.3442246 0.3442246 -0.0000000), wk = 0.0028571 k( 49) = ( 0.3515485 0.3515485 -0.0000000), wk = 0.0028571 k( 50) = ( 0.3588725 0.3588725 -0.0000000), wk = 0.0028571 k( 51) = ( 0.3661964 0.3661964 0.0000000), wk = 0.0028571 k( 52) = ( 0.3661964 0.3661964 0.0000000), wk = 0.0028571 k( 53) = ( 0.3531180 0.3709751 0.0000000), wk = 0.0028571 k( 54) = ( 0.3400395 0.3757538 -0.0000000), wk = 0.0028571 k( 55) = ( 0.3269611 0.3805325 0.0000000), wk = 0.0028571 k( 56) = ( 0.3138826 0.3853112 0.0000000), wk = 0.0028571 k( 57) = ( 0.3008042 0.3900899 -0.0000000), wk = 0.0028571 k( 58) = ( 0.2877257 0.3948686 -0.0000000), wk = 0.0028571 k( 59) = ( 0.2746473 0.3996473 0.0000000), wk = 0.0028571 k( 60) = ( 0.2615689 0.4044260 0.0000000), wk = 0.0028571 k( 61) = ( 0.2484904 0.4092047 -0.0000000), wk = 0.0028571 k( 62) = ( 0.2354120 0.4139834 -0.0000000), wk = 0.0028571 k( 63) = ( 0.2223335 0.4187621 0.0000000), wk = 0.0028571 k( 64) = ( 0.2092551 0.4235408 0.0000000), wk = 0.0028571 k( 65) = ( 0.1961766 0.4283195 0.0000000), wk = 0.0028571 k( 66) = ( 0.1830982 0.4330982 -0.0000000), wk = 0.0028571 k( 67) = ( 0.1700197 0.4378769 0.0000000), wk = 0.0028571 k( 68) = ( 0.1569413 0.4426556 0.0000000), wk = 0.0028571 k( 69) = ( 0.1438629 0.4474343 -0.0000000), wk = 0.0028571 k( 70) = ( 0.1307844 0.4522130 0.0000000), wk = 0.0028571 k( 71) = ( 0.1177060 0.4569917 0.0000000), wk = 0.0028571 k( 72) = ( 0.1046275 0.4617704 -0.0000000), wk = 0.0028571 k( 73) = ( 0.0915491 0.4665491 0.0000000), wk = 0.0028571 k( 74) = ( 0.0784707 0.4713278 0.0000000), wk = 0.0028571 k( 75) = ( 0.0653922 0.4761065 0.0000000), wk = 0.0028571 k( 76) = ( 0.0523138 0.4808852 0.0000000), wk = 0.0028571 k( 77) = ( 0.0392353 0.4856639 0.0000000), wk = 0.0028571 k( 78) = ( 0.0261569 0.4904426 -0.0000000), wk = 0.0028571 k( 79) = ( 0.0130784 0.4952213 -0.0000000), wk = 0.0028571 k( 80) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028571 k( 81) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028571 k( 82) = ( 0.0000000 0.5000000 0.0384615), wk = 0.0028571 k( 83) = ( 0.0000000 0.5000000 0.0769231), wk = 0.0028571 k( 84) = ( 0.0000000 0.5000000 0.1153846), wk = 0.0028571 k( 85) = ( 0.0000000 0.5000000 0.1538461), wk = 0.0028571 k( 86) = ( 0.0000000 0.5000000 0.1923077), wk = 0.0028571 k( 87) = ( 0.0000000 0.5000000 0.2307692), wk = 0.0028571 k( 88) = ( 0.0000000 0.5000000 0.2692308), wk = 0.0028571 k( 89) = ( 0.0000000 0.5000000 0.3076923), wk = 0.0028571 k( 90) = ( 0.0000000 0.5000000 0.3461538), wk = 0.0028571 k( 91) = ( 0.0000000 0.5000000 0.3846154), wk = 0.0028571 k( 92) = ( 0.0000000 0.5000000 0.4230769), wk = 0.0028571 k( 93) = ( 0.0000000 0.5000000 0.4615385), wk = 0.0028571 k( 94) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028571 k( 95) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028571 k( 96) = ( 0.0130784 0.4952213 0.5000000), wk = 0.0028571 k( 97) = ( 0.0261569 0.4904426 0.5000000), wk = 0.0028571 k( 98) = ( 0.0392353 0.4856639 0.5000000), wk = 0.0028571 k( 99) = ( 0.0523138 0.4808852 0.5000000), wk = 0.0028571 k( 100) = ( 0.0653922 0.4761065 0.5000000), wk = 0.0028571 k( 101) = ( 0.0784707 0.4713278 0.5000000), wk = 0.0028571 k( 102) = ( 0.0915491 0.4665491 0.5000000), wk = 0.0028571 k( 103) = ( 0.1046275 0.4617704 0.5000000), wk = 0.0028571 k( 104) = ( 0.1177060 0.4569917 0.5000000), wk = 0.0028571 k( 105) = ( 0.1307844 0.4522130 0.5000000), wk = 0.0028571 k( 106) = ( 0.1438629 0.4474343 0.5000000), wk = 0.0028571 k( 107) = ( 0.1569413 0.4426556 0.5000000), wk = 0.0028571 k( 108) = ( 0.1700197 0.4378769 0.5000000), wk = 0.0028571 k( 109) = ( 0.1830982 0.4330982 0.5000000), wk = 0.0028571 k( 110) = ( 0.1961766 0.4283195 0.5000000), wk = 0.0028571 k( 111) = ( 0.2092551 0.4235408 0.5000000), wk = 0.0028571 k( 112) = ( 0.2223335 0.4187621 0.5000000), wk = 0.0028571 k( 113) = ( 0.2354120 0.4139834 0.5000000), wk = 0.0028571 k( 114) = ( 0.2484904 0.4092047 0.5000000), wk = 0.0028571 k( 115) = ( 0.2615689 0.4044260 0.5000000), wk = 0.0028571 k( 116) = ( 0.2746473 0.3996473 0.5000000), wk = 0.0028571 k( 117) = ( 0.2877257 0.3948686 0.5000000), wk = 0.0028571 k( 118) = ( 0.3008042 0.3900899 0.5000000), wk = 0.0028571 k( 119) = ( 0.3138826 0.3853112 0.5000000), wk = 0.0028571 k( 120) = ( 0.3269611 0.3805325 0.5000000), wk = 0.0028571 k( 121) = ( 0.3400395 0.3757538 0.5000000), wk = 0.0028571 k( 122) = ( 0.3531180 0.3709751 0.5000000), wk = 0.0028571 k( 123) = ( 0.3661964 0.3661964 0.5000000), wk = 0.0028571 k( 124) = ( 0.3661964 0.3661964 0.5000000), wk = 0.0028571 k( 125) = ( 0.3588725 0.3588725 0.5000000), wk = 0.0028571 k( 126) = ( 0.3515485 0.3515485 0.5000000), wk = 0.0028571 k( 127) = ( 0.3442246 0.3442246 0.5000000), wk = 0.0028571 k( 128) = ( 0.3369007 0.3369007 0.5000000), wk = 0.0028571 k( 129) = ( 0.3295767 0.3295767 0.5000000), wk = 0.0028571 k( 130) = ( 0.3222528 0.3222528 0.5000000), wk = 0.0028571 k( 131) = ( 0.3149289 0.3149289 0.5000000), wk = 0.0028571 k( 132) = ( 0.3076050 0.3076050 0.5000000), wk = 0.0028571 k( 133) = ( 0.3002810 0.3002810 0.5000000), wk = 0.0028571 k( 134) = ( 0.2929571 0.2929571 0.5000000), wk = 0.0028571 k( 135) = ( 0.2856332 0.2856332 0.5000000), wk = 0.0028571 k( 136) = ( 0.2783093 0.2783092 0.5000000), wk = 0.0028571 k( 137) = ( 0.2709853 0.2709853 0.5000000), wk = 0.0028571 k( 138) = ( 0.2636614 0.2636614 0.5000000), wk = 0.0028571 k( 139) = ( 0.2563375 0.2563375 0.5000000), wk = 0.0028571 k( 140) = ( 0.2490135 0.2490135 0.5000000), wk = 0.0028571 k( 141) = ( 0.2416896 0.2416896 0.5000000), wk = 0.0028571 k( 142) = ( 0.2343657 0.2343657 0.5000000), wk = 0.0028571 k( 143) = ( 0.2270418 0.2270418 0.5000000), wk = 0.0028571 k( 144) = ( 0.2197178 0.2197178 0.5000000), wk = 0.0028571 k( 145) = ( 0.2123939 0.2123939 0.5000000), wk = 0.0028571 k( 146) = ( 0.2050700 0.2050700 0.5000000), wk = 0.0028571 k( 147) = ( 0.1977461 0.1977461 0.5000000), wk = 0.0028571 k( 148) = ( 0.1904221 0.1904221 0.5000000), wk = 0.0028571 k( 149) = ( 0.1830982 0.1830982 0.5000000), wk = 0.0028571 k( 150) = ( 0.1757743 0.1757743 0.5000000), wk = 0.0028571 k( 151) = ( 0.1684503 0.1684503 0.5000000), wk = 0.0028571 k( 152) = ( 0.1611264 0.1611264 0.5000000), wk = 0.0028571 k( 153) = ( 0.1538025 0.1538025 0.5000000), wk = 0.0028571 k( 154) = ( 0.1464786 0.1464786 0.5000000), wk = 0.0028571 k( 155) = ( 0.1391546 0.1391546 0.5000000), wk = 0.0028571 k( 156) = ( 0.1318307 0.1318307 0.5000000), wk = 0.0028571 k( 157) = ( 0.1245068 0.1245068 0.5000000), wk = 0.0028571 k( 158) = ( 0.1171828 0.1171828 0.5000000), wk = 0.0028571 k( 159) = ( 0.1098589 0.1098589 0.5000000), wk = 0.0028571 k( 160) = ( 0.1025350 0.1025350 0.5000000), wk = 0.0028571 k( 161) = ( 0.0952111 0.0952111 0.5000000), wk = 0.0028571 k( 162) = ( 0.0878871 0.0878871 0.5000000), wk = 0.0028571 k( 163) = ( 0.0805632 0.0805632 0.5000000), wk = 0.0028571 k( 164) = ( 0.0732393 0.0732393 0.5000000), wk = 0.0028571 k( 165) = ( 0.0659153 0.0659153 0.5000000), wk = 0.0028571 k( 166) = ( 0.0585914 0.0585914 0.5000000), wk = 0.0028571 k( 167) = ( 0.0512675 0.0512675 0.5000000), wk = 0.0028571 k( 168) = ( 0.0439436 0.0439436 0.5000000), wk = 0.0028571 k( 169) = ( 0.0366196 0.0366196 0.5000000), wk = 0.0028571 k( 170) = ( 0.0292957 0.0292957 0.5000000), wk = 0.0028571 k( 171) = ( 0.0219718 0.0219718 0.5000000), wk = 0.0028571 k( 172) = ( 0.0146479 0.0146479 0.5000000), wk = 0.0028571 k( 173) = ( 0.0073239 0.0073239 0.5000000), wk = 0.0028571 k( 174) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 175) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 176) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0028571 k( 177) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0028571 k( 178) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0028571 k( 179) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0028571 k( 180) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0028571 k( 181) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0028571 k( 182) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0028571 k( 183) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0028571 k( 184) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0028571 k( 185) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0028571 k( 186) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0028571 k( 187) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0028571 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 190) = ( -0.0108696 0.0108696 -0.0000000), wk = 0.0028571 k( 191) = ( -0.0217391 0.0217391 -0.0000000), wk = 0.0028571 k( 192) = ( -0.0326087 0.0326087 -0.0000000), wk = 0.0028571 k( 193) = ( -0.0434783 0.0434783 -0.0000000), wk = 0.0028571 k( 194) = ( -0.0543478 0.0543478 -0.0000000), wk = 0.0028571 k( 195) = ( -0.0652174 0.0652174 -0.0000000), wk = 0.0028571 k( 196) = ( -0.0760870 0.0760870 -0.0000000), wk = 0.0028571 k( 197) = ( -0.0869565 0.0869565 -0.0000000), wk = 0.0028571 k( 198) = ( -0.0978261 0.0978261 -0.0000000), wk = 0.0028571 k( 199) = ( -0.1086957 0.1086956 -0.0000000), wk = 0.0028571 k( 200) = ( -0.1195652 0.1195652 -0.0000000), wk = 0.0028571 k( 201) = ( -0.1304348 0.1304348 -0.0000000), wk = 0.0028571 k( 202) = ( -0.1413043 0.1413043 -0.0000000), wk = 0.0028571 k( 203) = ( -0.1521739 0.1521739 -0.0000000), wk = 0.0028571 k( 204) = ( -0.1630435 0.1630435 -0.0000000), wk = 0.0028571 k( 205) = ( -0.1739130 0.1739130 -0.0000000), wk = 0.0028571 k( 206) = ( -0.1847826 0.1847826 -0.0000000), wk = 0.0028571 k( 207) = ( -0.1956522 0.1956522 -0.0000000), wk = 0.0028571 k( 208) = ( -0.2065217 0.2065217 -0.0000000), wk = 0.0028571 k( 209) = ( -0.2173913 0.2173913 -0.0000000), wk = 0.0028571 k( 210) = ( -0.2282609 0.2282609 -0.0000000), wk = 0.0028571 k( 211) = ( -0.2391304 0.2391304 -0.0000000), wk = 0.0028571 k( 212) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0028571 k( 213) = ( -0.2608696 0.2608696 -0.0000000), wk = 0.0028571 k( 214) = ( -0.2717391 0.2717391 -0.0000000), wk = 0.0028571 k( 215) = ( -0.2826087 0.2826087 -0.0000000), wk = 0.0028571 k( 216) = ( -0.2934783 0.2934783 -0.0000000), wk = 0.0028571 k( 217) = ( -0.3043478 0.3043478 -0.0000000), wk = 0.0028571 k( 218) = ( -0.3152174 0.3152174 -0.0000000), wk = 0.0028571 k( 219) = ( -0.3260870 0.3260870 -0.0000000), wk = 0.0028571 k( 220) = ( -0.3369565 0.3369565 -0.0000000), wk = 0.0028571 k( 221) = ( -0.3478261 0.3478261 -0.0000000), wk = 0.0028571 k( 222) = ( -0.3586956 0.3586956 -0.0000000), wk = 0.0028571 k( 223) = ( -0.3695652 0.3695652 -0.0000000), wk = 0.0028571 k( 224) = ( -0.3804348 0.3804348 -0.0000000), wk = 0.0028571 k( 225) = ( -0.3913044 0.3913044 -0.0000000), wk = 0.0028571 k( 226) = ( -0.4021739 0.4021739 -0.0000000), wk = 0.0028571 k( 227) = ( -0.4130435 0.4130435 -0.0000000), wk = 0.0028571 k( 228) = ( -0.4239130 0.4239130 -0.0000000), wk = 0.0028571 k( 229) = ( -0.4347826 0.4347826 -0.0000000), wk = 0.0028571 k( 230) = ( -0.4456522 0.4456522 -0.0000000), wk = 0.0028571 k( 231) = ( -0.4565217 0.4565217 -0.0000000), wk = 0.0028571 k( 232) = ( -0.4673913 0.4673913 -0.0000000), wk = 0.0028571 k( 233) = ( -0.4782609 0.4782609 -0.0000000), wk = 0.0028571 k( 234) = ( -0.4891304 0.4891304 -0.0000000), wk = 0.0028571 k( 235) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 236) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 237) = ( -0.4929577 0.5070423 -0.0000000), wk = 0.0028571 k( 238) = ( -0.4859154 0.5140846 -0.0000000), wk = 0.0028571 k( 239) = ( -0.4788731 0.5211269 -0.0000000), wk = 0.0028571 k( 240) = ( -0.4718308 0.5281692 -0.0000000), wk = 0.0028571 k( 241) = ( -0.4647885 0.5352115 -0.0000000), wk = 0.0028571 k( 242) = ( -0.4577462 0.5422538 -0.0000000), wk = 0.0028571 k( 243) = ( -0.4507039 0.5492961 -0.0000000), wk = 0.0028571 k( 244) = ( -0.4436616 0.5563384 -0.0000000), wk = 0.0028571 k( 245) = ( -0.4366193 0.5633807 -0.0000000), wk = 0.0028571 k( 246) = ( -0.4295771 0.5704229 -0.0000000), wk = 0.0028571 k( 247) = ( -0.4225348 0.5774653 -0.0000000), wk = 0.0028571 k( 248) = ( -0.4154925 0.5845075 -0.0000000), wk = 0.0028571 k( 249) = ( -0.4084502 0.5915498 -0.0000000), wk = 0.0028571 k( 250) = ( -0.4014079 0.5985921 -0.0000000), wk = 0.0028571 k( 251) = ( -0.3943656 0.6056344 -0.0000000), wk = 0.0028571 k( 252) = ( -0.3873233 0.6126767 -0.0000000), wk = 0.0028571 k( 253) = ( -0.3802810 0.6197190 -0.0000000), wk = 0.0028571 k( 254) = ( -0.3732387 0.6267613 -0.0000000), wk = 0.0028571 k( 255) = ( -0.3661964 0.6338036 -0.0000000), wk = 0.0028571 k( 256) = ( -0.3661964 0.6338036 -0.0000000), wk = 0.0028571 k( 257) = ( -0.3661964 0.6338036 0.0384615), wk = 0.0028571 k( 258) = ( -0.3661964 0.6338036 0.0769231), wk = 0.0028571 k( 259) = ( -0.3661964 0.6338036 0.1153846), wk = 0.0028571 k( 260) = ( -0.3661964 0.6338036 0.1538461), wk = 0.0028571 k( 261) = ( -0.3661964 0.6338036 0.1923077), wk = 0.0028571 k( 262) = ( -0.3661964 0.6338036 0.2307692), wk = 0.0028571 k( 263) = ( -0.3661964 0.6338036 0.2692308), wk = 0.0028571 k( 264) = ( -0.3661964 0.6338036 0.3076923), wk = 0.0028571 k( 265) = ( -0.3661964 0.6338036 0.3461538), wk = 0.0028571 k( 266) = ( -0.3661964 0.6338036 0.3846154), wk = 0.0028571 k( 267) = ( -0.3661964 0.6338036 0.4230769), wk = 0.0028571 k( 268) = ( -0.3661964 0.6338036 0.4615385), wk = 0.0028571 k( 269) = ( -0.3661964 0.6338036 0.5000000), wk = 0.0028571 k( 270) = ( -0.3661964 0.6338036 0.5000000), wk = 0.0028571 k( 271) = ( -0.3732387 0.6267613 0.5000000), wk = 0.0028571 k( 272) = ( -0.3802810 0.6197190 0.5000000), wk = 0.0028571 k( 273) = ( -0.3873233 0.6126767 0.5000000), wk = 0.0028571 k( 274) = ( -0.3943656 0.6056344 0.5000000), wk = 0.0028571 k( 275) = ( -0.4014079 0.5985921 0.5000000), wk = 0.0028571 k( 276) = ( -0.4084502 0.5915498 0.5000000), wk = 0.0028571 k( 277) = ( -0.4154925 0.5845075 0.5000000), wk = 0.0028571 k( 278) = ( -0.4225348 0.5774653 0.5000000), wk = 0.0028571 k( 279) = ( -0.4295771 0.5704229 0.5000000), wk = 0.0028571 k( 280) = ( -0.4366193 0.5633807 0.5000000), wk = 0.0028571 k( 281) = ( -0.4436616 0.5563384 0.5000000), wk = 0.0028571 k( 282) = ( -0.4507039 0.5492961 0.5000000), wk = 0.0028571 k( 283) = ( -0.4577462 0.5422538 0.5000000), wk = 0.0028571 k( 284) = ( -0.4647885 0.5352115 0.5000000), wk = 0.0028571 k( 285) = ( -0.4718308 0.5281692 0.5000000), wk = 0.0028571 k( 286) = ( -0.4788731 0.5211269 0.5000000), wk = 0.0028571 k( 287) = ( -0.4859154 0.5140846 0.5000000), wk = 0.0028571 k( 288) = ( -0.4929577 0.5070423 0.5000000), wk = 0.0028571 k( 289) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 k( 290) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 k( 291) = ( -0.5000000 0.5000000 0.4615385), wk = 0.0028571 k( 292) = ( -0.5000000 0.5000000 0.4230769), wk = 0.0028571 k( 293) = ( -0.5000000 0.5000000 0.3846154), wk = 0.0028571 k( 294) = ( -0.5000000 0.5000000 0.3461538), wk = 0.0028571 k( 295) = ( -0.5000000 0.5000000 0.3076923), wk = 0.0028571 k( 296) = ( -0.5000000 0.5000000 0.2692308), wk = 0.0028571 k( 297) = ( -0.5000000 0.5000000 0.2307692), wk = 0.0028571 k( 298) = ( -0.5000000 0.5000000 0.1923077), wk = 0.0028571 k( 299) = ( -0.5000000 0.5000000 0.1538461), wk = 0.0028571 k( 300) = ( -0.5000000 0.5000000 0.1153846), wk = 0.0028571 k( 301) = ( -0.5000000 0.5000000 0.0769231), wk = 0.0028571 k( 302) = ( -0.5000000 0.5000000 0.0384615), wk = 0.0028571 k( 303) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 304) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 305) = ( -0.0108696 0.0108696 0.5000000), wk = 0.0028571 k( 306) = ( -0.0217391 0.0217391 0.5000000), wk = 0.0028571 k( 307) = ( -0.0326087 0.0326087 0.5000000), wk = 0.0028571 k( 308) = ( -0.0434783 0.0434783 0.5000000), wk = 0.0028571 k( 309) = ( -0.0543478 0.0543478 0.5000000), wk = 0.0028571 k( 310) = ( -0.0652174 0.0652174 0.5000000), wk = 0.0028571 k( 311) = ( -0.0760870 0.0760870 0.5000000), wk = 0.0028571 k( 312) = ( -0.0869565 0.0869565 0.5000000), wk = 0.0028571 k( 313) = ( -0.0978261 0.0978261 0.5000000), wk = 0.0028571 k( 314) = ( -0.1086957 0.1086956 0.5000000), wk = 0.0028571 k( 315) = ( -0.1195652 0.1195652 0.5000000), wk = 0.0028571 k( 316) = ( -0.1304348 0.1304348 0.5000000), wk = 0.0028571 k( 317) = ( -0.1413043 0.1413043 0.5000000), wk = 0.0028571 k( 318) = ( -0.1521739 0.1521739 0.5000000), wk = 0.0028571 k( 319) = ( -0.1630435 0.1630435 0.5000000), wk = 0.0028571 k( 320) = ( -0.1739130 0.1739130 0.5000000), wk = 0.0028571 k( 321) = ( -0.1847826 0.1847826 0.5000000), wk = 0.0028571 k( 322) = ( -0.1956522 0.1956522 0.5000000), wk = 0.0028571 k( 323) = ( -0.2065217 0.2065217 0.5000000), wk = 0.0028571 k( 324) = ( -0.2173913 0.2173913 0.5000000), wk = 0.0028571 k( 325) = ( -0.2282609 0.2282609 0.5000000), wk = 0.0028571 k( 326) = ( -0.2391304 0.2391304 0.5000000), wk = 0.0028571 k( 327) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0028571 k( 328) = ( -0.2608696 0.2608696 0.5000000), wk = 0.0028571 k( 329) = ( -0.2717391 0.2717391 0.5000000), wk = 0.0028571 k( 330) = ( -0.2826087 0.2826087 0.5000000), wk = 0.0028571 k( 331) = ( -0.2934783 0.2934783 0.5000000), wk = 0.0028571 k( 332) = ( -0.3043478 0.3043478 0.5000000), wk = 0.0028571 k( 333) = ( -0.3152174 0.3152174 0.5000000), wk = 0.0028571 k( 334) = ( -0.3260870 0.3260870 0.5000000), wk = 0.0028571 k( 335) = ( -0.3369565 0.3369565 0.5000000), wk = 0.0028571 k( 336) = ( -0.3478261 0.3478261 0.5000000), wk = 0.0028571 k( 337) = ( -0.3586956 0.3586956 0.5000000), wk = 0.0028571 k( 338) = ( -0.3695652 0.3695652 0.5000000), wk = 0.0028571 k( 339) = ( -0.3804348 0.3804348 0.5000000), wk = 0.0028571 k( 340) = ( -0.3913044 0.3913044 0.5000000), wk = 0.0028571 k( 341) = ( -0.4021739 0.4021739 0.5000000), wk = 0.0028571 k( 342) = ( -0.4130435 0.4130435 0.5000000), wk = 0.0028571 k( 343) = ( -0.4239130 0.4239130 0.5000000), wk = 0.0028571 k( 344) = ( -0.4347826 0.4347826 0.5000000), wk = 0.0028571 k( 345) = ( -0.4456522 0.4456522 0.5000000), wk = 0.0028571 k( 346) = ( -0.4565217 0.4565217 0.5000000), wk = 0.0028571 k( 347) = ( -0.4673913 0.4673913 0.5000000), wk = 0.0028571 k( 348) = ( -0.4782609 0.4782609 0.5000000), wk = 0.0028571 k( 349) = ( -0.4891304 0.4891304 0.5000000), wk = 0.0028571 k( 350) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 Dense grid: 192643 G-vectors FFT dimensions: ( 54, 54, 160) Smooth grid: 64207 G-vectors FFT dimensions: ( 36, 36, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.35 Mb ( 374, 62) NL pseudopotentials 0.35 Mb ( 187, 124) Each V/rho on FFT grid 0.18 Mb ( 11664) Each G-vector array 0.03 Mb ( 4020) G-vector shells 0.02 Mb ( 1992) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.42 Mb ( 374, 248) Each subspace H/S matrix 0.94 Mb ( 248, 248) Each matrix 0.23 Mb ( 124, 2, 62) The potential is recalculated from file : ./HgBr2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.3 secs Computing kpt #: 2 total cpu time spent up to now is 49.9 secs Computing kpt #: 3 total cpu time spent up to now is 54.5 secs Computing kpt #: 4 total cpu time spent up to now is 59.0 secs Computing kpt #: 5 total cpu time spent up to now is 63.6 secs Computing kpt #: 6 total cpu time spent up to now is 68.5 secs Computing kpt #: 7 total cpu time spent up to now is 72.8 secs Computing kpt #: 8 total cpu time spent up to now is 77.1 secs Computing kpt #: 9 total cpu time spent up to now is 81.8 secs Computing kpt #: 10 total cpu time spent up to now is 87.3 secs Computing kpt #: 11 total cpu time spent up to now is 93.3 secs Computing kpt #: 12 total cpu time spent up to now is 99.2 secs Computing kpt #: 13 total cpu time spent up to now is 107.3 secs Computing kpt #: 14 total cpu time spent up to now is 112.8 secs Computing kpt #: 15 total cpu time spent up to now is 119.2 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 133.4 secs Computing kpt #: 18 total cpu time spent up to now is 138.1 secs Computing kpt #: 19 total cpu time spent up to now is 142.9 secs Computing kpt #: 20 total cpu time spent up to now is 147.9 secs Computing kpt #: 21 total cpu time spent up to now is 152.7 secs Computing kpt #: 22 total cpu time spent up to now is 157.8 secs Computing kpt #: 23 total cpu time spent up to now is 164.1 secs Computing kpt #: 24 total cpu time spent up to now is 169.4 secs Computing kpt #: 25 total cpu time spent up to now is 175.6 secs Computing kpt #: 26 total cpu time spent up to now is 181.6 secs Computing kpt #: 27 total cpu time spent up to now is 187.7 secs Computing kpt #: 28 total cpu time spent up to now is 192.1 secs Computing kpt #: 29 total cpu time spent up to now is 197.3 secs Computing kpt #: 30 total cpu time spent up to now is 202.5 secs Computing kpt #: 31 total cpu time spent up to now is 207.1 secs Computing kpt #: 32 total cpu time spent up to now is 213.0 secs Computing kpt #: 33 total cpu time spent up to now is 218.2 secs Computing kpt #: 34 total cpu time spent up to now is 225.3 secs Computing kpt #: 35 total cpu time spent up to now is 232.9 secs Computing kpt #: 36 total cpu time spent up to now is 237.8 secs Computing kpt #: 37 total cpu time spent up to now is 242.8 secs Computing kpt #: 38 total cpu time spent up to now is 248.2 secs Computing kpt #: 39 total cpu time spent up to now is 253.1 secs Computing kpt #: 40 total cpu time spent up to now is 258.1 secs Computing kpt #: 41 total cpu time spent up to now is 263.7 secs Computing kpt #: 42 total cpu time spent up to now is 268.6 secs Computing kpt #: 43 total cpu time spent up to now is 273.7 secs Computing kpt #: 44 total cpu time spent up to now is 278.8 secs Computing kpt #: 45 total cpu time spent up to now is 284.7 secs Computing kpt #: 46 total cpu time spent up to now is 290.3 secs Computing kpt #: 47 total cpu time spent up to now is 295.5 secs Computing kpt #: 48 total cpu time spent up to now is 302.1 secs Computing kpt #: 49 total cpu time spent up to now is 307.2 secs Computing kpt #: 50 total cpu time spent up to now is 313.6 secs Computing kpt #: 51 total cpu time spent up to now is 319.0 secs Computing kpt #: 52 total cpu time spent up to now is 323.9 secs Computing kpt #: 53 total cpu time spent up to now is 329.3 secs Computing kpt #: 54 total cpu time spent up to now is 334.0 secs Computing kpt #: 55 total cpu time spent up to now is 339.5 secs Computing kpt #: 56 total cpu time spent up to now is 344.5 secs Computing kpt #: 57 total cpu time spent up to now is 349.1 secs Computing kpt #: 58 total cpu time spent up to now is 353.9 secs Computing kpt #: 59 total cpu time spent up to now is 360.1 secs Computing kpt #: 60 total cpu time spent up to now is 365.1 secs Computing kpt #: 61 total cpu time spent up to now is 370.3 secs Computing kpt #: 62 total cpu time spent up to now is 376.2 secs Computing kpt #: 63 total cpu time spent up to now is 383.8 secs Computing kpt #: 64 total cpu time spent up to now is 388.7 secs Computing kpt #: 65 total cpu time spent up to now is 394.1 secs Computing kpt #: 66 total cpu time spent up to now is 399.2 secs Computing kpt #: 67 total cpu time spent up to now is 404.0 secs Computing kpt #: 68 total cpu time spent up to now is 409.7 secs Computing kpt #: 69 total cpu time spent up to now is 414.9 secs Computing kpt #: 70 total cpu time spent up to now is 421.3 secs Computing kpt #: 71 total cpu time spent up to now is 427.8 secs Computing kpt #: 72 total cpu time spent up to now is 433.5 secs Computing kpt #: 73 total cpu time spent up to now is 440.3 secs Computing kpt #: 74 total cpu time spent up to now is 445.7 secs Computing kpt #: 75 total cpu time spent up to now is 450.3 secs Computing kpt #: 76 total cpu time spent up to now is 454.8 secs Computing kpt #: 77 total cpu time spent up to now is 459.6 secs Computing kpt #: 78 total cpu time spent up to now is 464.6 secs Computing kpt #: 79 total cpu time spent up to now is 469.0 secs Computing kpt #: 80 total cpu time spent up to now is 474.4 secs Computing kpt #: 81 total cpu time spent up to now is 479.2 secs Computing kpt #: 82 total cpu time spent up to now is 486.1 secs Computing kpt #: 83 total cpu time spent up to now is 492.3 secs Computing kpt #: 84 total cpu time spent up to now is 497.7 secs Computing kpt #: 85 total cpu time spent up to now is 503.3 secs Computing kpt #: 86 total cpu time spent up to now is 508.5 secs Computing kpt #: 87 total cpu time spent up to now is 514.8 secs Computing kpt #: 88 total cpu time spent up to now is 521.2 secs Computing kpt #: 89 total cpu time spent up to now is 527.2 secs Computing kpt #: 90 total cpu time spent up to now is 532.3 secs Computing kpt #: 91 total cpu time spent up to now is 537.5 secs Computing kpt #: 92 total cpu time spent up to now is 543.4 secs Computing kpt #: 93 total cpu time spent up to now is 548.1 secs Computing kpt #: 94 total cpu time spent up to now is 554.1 secs Computing kpt #: 95 total cpu time spent up to now is 559.5 secs Computing kpt #: 96 total cpu time spent up to now is 564.7 secs Computing kpt #: 97 total cpu time spent up to now is 569.7 secs Computing kpt #: 98 total cpu time spent up to now is 575.9 secs Computing kpt #: 99 total cpu time spent up to now is 581.9 secs Computing kpt #: 100 total cpu time spent up to now is 586.5 secs Computing kpt #: 101 total cpu time spent up to now is 592.4 secs Computing kpt #: 102 total cpu time spent up to now is 599.1 secs Computing kpt #: 103 total cpu time spent up to now is 605.1 secs Computing kpt #: 104 total cpu time spent up to now is 612.1 secs Computing kpt #: 105 total cpu time spent up to now is 620.2 secs Computing kpt #: 106 total cpu time spent up to now is 626.0 secs Computing kpt #: 107 total cpu time spent up to now is 633.6 secs Computing kpt #: 108 total cpu time spent up to now is 638.5 secs Computing kpt #: 109 total cpu time spent up to now is 643.7 secs Computing kpt #: 110 total cpu time spent up to now is 649.4 secs Computing kpt #: 111 total cpu time spent up to now is 654.8 secs Computing kpt #: 112 total cpu time spent up to now is 659.8 secs Computing kpt #: 113 total cpu time spent up to now is 664.5 secs Computing kpt #: 114 total cpu time spent up to now is 670.0 secs Computing kpt #: 115 total cpu time spent up to now is 675.6 secs Computing kpt #: 116 total cpu time spent up to now is 682.2 secs Computing kpt #: 117 total cpu time spent up to now is 686.7 secs Computing kpt #: 118 total cpu time spent up to now is 691.6 secs Computing kpt #: 119 total cpu time spent up to now is 698.3 secs Computing kpt #: 120 total cpu time spent up to now is 702.9 secs Computing kpt #: 121 total cpu time spent up to now is 708.1 secs Computing kpt #: 122 total cpu time spent up to now is 714.4 secs Computing kpt #: 123 total cpu time spent up to now is 720.4 secs Computing kpt #: 124 total cpu time spent up to now is 726.0 secs Computing kpt #: 125 total cpu time spent up to now is 731.1 secs Computing kpt #: 126 total cpu time spent up to now is 736.0 secs Computing kpt #: 127 total cpu time spent up to now is 740.9 secs Computing kpt #: 128 total cpu time spent up to now is 745.8 secs Computing kpt #: 129 total cpu time spent up to now is 750.5 secs Computing kpt #: 130 total cpu time spent up to now is 755.3 secs Computing kpt #: 131 total cpu time spent up to now is 761.3 secs Computing kpt #: 132 total cpu time spent up to now is 766.0 secs Computing kpt #: 133 total cpu time spent up to now is 771.2 secs Computing kpt #: 134 total cpu time spent up to now is 777.4 secs Computing kpt #: 135 total cpu time spent up to now is 786.6 secs Computing kpt #: 136 total cpu time spent up to now is 792.0 secs Computing kpt #: 137 total cpu time spent up to now is 797.1 secs Computing kpt #: 138 total cpu time spent up to now is 803.1 secs Computing kpt #: 139 total cpu time spent up to now is 808.1 secs Computing kpt #: 140 total cpu time spent up to now is 812.7 secs Computing kpt #: 141 total cpu time spent up to now is 818.3 secs Computing kpt #: 142 total cpu time spent up to now is 824.9 secs Computing kpt #: 143 total cpu time spent up to now is 829.8 secs Computing kpt #: 144 total cpu time spent up to now is 836.6 secs Computing kpt #: 145 total cpu time spent up to now is 841.4 secs Computing kpt #: 146 total cpu time spent up to now is 846.3 secs Computing kpt #: 147 total cpu time spent up to now is 851.8 secs Computing kpt #: 148 total cpu time spent up to now is 856.9 secs Computing kpt #: 149 total cpu time spent up to now is 862.4 secs Computing kpt #: 150 total cpu time spent up to now is 867.3 secs Computing kpt #: 151 total cpu time spent up to now is 872.4 secs Computing kpt #: 152 total cpu time spent up to now is 877.6 secs Computing kpt #: 153 total cpu time spent up to now is 884.1 secs Computing kpt #: 154 total cpu time spent up to now is 891.0 secs Computing kpt #: 155 total cpu time spent up to now is 898.4 secs Computing kpt #: 156 total cpu time spent up to now is 904.5 secs Computing kpt #: 157 total cpu time spent up to now is 910.2 secs Computing kpt #: 158 total cpu time spent up to now is 916.1 secs Computing kpt #: 159 total cpu time spent up to now is 920.5 secs Computing kpt #: 160 total cpu time spent up to now is 926.2 secs Computing kpt #: 161 total cpu time spent up to now is 932.1 secs Computing kpt #: 162 total cpu time spent up to now is 936.2 secs Computing kpt #: 163 total cpu time spent up to now is 940.7 secs Computing kpt #: 164 total cpu time spent up to now is 947.4 secs Computing kpt #: 165 total cpu time spent up to now is 952.3 secs Computing kpt #: 166 total cpu time spent up to now is 956.9 secs Computing kpt #: 167 total cpu time spent up to now is 961.9 secs Computing kpt #: 168 total cpu time spent up to now is 966.2 secs Computing kpt #: 169 total cpu time spent up to now is 970.3 secs Computing kpt #: 170 total cpu time spent up to now is 975.3 secs Computing kpt #: 171 total cpu time spent up to now is 980.2 secs Computing kpt #: 172 total cpu time spent up to now is 985.1 secs Computing kpt #: 173 total cpu time spent up to now is 990.7 secs Computing kpt #: 174 total cpu time spent up to now is 995.0 secs Computing kpt #: 175 total cpu time spent up to now is 998.5 secs Computing kpt #: 176 total cpu time spent up to now is 1004.2 secs Computing kpt #: 177 total cpu time spent up to now is 1009.7 secs Computing kpt #: 178 total cpu time spent up to now is 1014.3 secs Computing kpt #: 179 total cpu time spent up to now is 1019.7 secs Computing kpt #: 180 total cpu time spent up to now is 1024.3 secs Computing kpt #: 181 total cpu time spent up to now is 1029.9 secs Computing kpt #: 182 total cpu time spent up to now is 1035.0 secs Computing kpt #: 183 total cpu time spent up to now is 1041.6 secs Computing kpt #: 184 total cpu time spent up to now is 1046.9 secs Computing kpt #: 185 total cpu time spent up to now is 1052.3 secs Computing kpt #: 186 total cpu time spent up to now is 1057.2 secs Computing kpt #: 187 total cpu time spent up to now is 1061.7 secs Computing kpt #: 188 total cpu time spent up to now is 1067.0 secs Computing kpt #: 189 total cpu time spent up to now is 1072.2 secs Computing kpt #: 190 total cpu time spent up to now is 1076.8 secs Computing kpt #: 191 total cpu time spent up to now is 1082.0 secs Computing kpt #: 192 total cpu time spent up to now is 1086.6 secs Computing kpt #: 193 total cpu time spent up to now is 1092.4 secs Computing kpt #: 194 total cpu time spent up to now is 1099.4 secs Computing kpt #: 195 total cpu time spent up to now is 1104.9 secs Computing kpt #: 196 total cpu time spent up to now is 1111.1 secs Computing kpt #: 197 total cpu time spent up to now is 1115.6 secs Computing kpt #: 198 total cpu time spent up to now is 1120.9 secs Computing kpt #: 199 total cpu time spent up to now is 1127.1 secs Computing kpt #: 200 total cpu time spent up to now is 1132.0 secs Computing kpt #: 201 total cpu time spent up to now is 1138.0 secs Computing kpt #: 202 total cpu time spent up to now is 1146.9 secs Computing kpt #: 203 total cpu time spent up to now is 1151.5 secs Computing kpt #: 204 total cpu time spent up to now is 1158.5 secs Computing kpt #: 205 total cpu time spent up to now is 1163.2 secs Computing kpt #: 206 total cpu time spent up to now is 1168.1 secs Computing kpt #: 207 total cpu time spent up to now is 1173.0 secs Computing kpt #: 208 total cpu time spent up to now is 1178.6 secs Computing kpt #: 209 total cpu time spent up to now is 1183.3 secs Computing kpt #: 210 total cpu time spent up to now is 1188.4 secs Computing kpt #: 211 total cpu time spent up to now is 1193.8 secs Computing kpt #: 212 total cpu time spent up to now is 1199.9 secs Computing kpt #: 213 total cpu time spent up to now is 1205.9 secs Computing kpt #: 214 total cpu time spent up to now is 1211.6 secs Computing kpt #: 215 total cpu time spent up to now is 1217.5 secs Computing kpt #: 216 total cpu time spent up to now is 1223.1 secs Computing kpt #: 217 total cpu time spent up to now is 1228.5 secs Computing kpt #: 218 total cpu time spent up to now is 1235.0 secs Computing kpt #: 219 total cpu time spent up to now is 1240.7 secs Computing kpt #: 220 total cpu time spent up to now is 1245.9 secs Computing kpt #: 221 total cpu time spent up to now is 1250.7 secs Computing kpt #: 222 total cpu time spent up to now is 1257.8 secs Computing kpt #: 223 total cpu time spent up to now is 1263.0 secs Computing kpt #: 224 total cpu time spent up to now is 1267.8 secs Computing kpt #: 225 total cpu time spent up to now is 1274.1 secs Computing kpt #: 226 total cpu time spent up to now is 1279.5 secs Computing kpt #: 227 total cpu time spent up to now is 1284.7 secs Computing kpt #: 228 total cpu time spent up to now is 1289.5 secs Computing kpt #: 229 total cpu time spent up to now is 1296.5 secs Computing kpt #: 230 total cpu time spent up to now is 1301.3 secs Computing kpt #: 231 total cpu time spent up to now is 1307.0 secs Computing kpt #: 232 total cpu time spent up to now is 1312.8 secs Computing kpt #: 233 total cpu time spent up to now is 1318.8 secs Computing kpt #: 234 total cpu time spent up to now is 1323.7 secs Computing kpt #: 235 total cpu time spent up to now is 1329.2 secs Computing kpt #: 236 total cpu time spent up to now is 1333.7 secs Computing kpt #: 237 total cpu time spent up to now is 1338.5 secs Computing kpt #: 238 total cpu time spent up to now is 1343.8 secs Computing kpt #: 239 total cpu time spent up to now is 1348.7 secs Computing kpt #: 240 total cpu time spent up to now is 1354.0 secs Computing kpt #: 241 total cpu time spent up to now is 1359.1 secs Computing kpt #: 242 total cpu time spent up to now is 1364.2 secs Computing kpt #: 243 total cpu time spent up to now is 1369.2 secs Computing kpt #: 244 total cpu time spent up to now is 1374.3 secs Computing kpt #: 245 total cpu time spent up to now is 1380.4 secs Computing kpt #: 246 total cpu time spent up to now is 1386.7 secs Computing kpt #: 247 total cpu time spent up to now is 1393.8 secs Computing kpt #: 248 total cpu time spent up to now is 1399.2 secs Computing kpt #: 249 total cpu time spent up to now is 1405.5 secs Computing kpt #: 250 total cpu time spent up to now is 1411.2 secs Computing kpt #: 251 total cpu time spent up to now is 1416.1 secs Computing kpt #: 252 total cpu time spent up to now is 1421.3 secs Computing kpt #: 253 total cpu time spent up to now is 1426.4 secs Computing kpt #: 254 total cpu time spent up to now is 1432.1 secs Computing kpt #: 255 total cpu time spent up to now is 1438.4 secs Computing kpt #: 256 total cpu time spent up to now is 1444.6 secs Computing kpt #: 257 total cpu time spent up to now is 1449.9 secs Computing kpt #: 258 total cpu time spent up to now is 1454.7 secs Computing kpt #: 259 total cpu time spent up to now is 1460.6 secs Computing kpt #: 260 total cpu time spent up to now is 1466.0 secs Computing kpt #: 261 total cpu time spent up to now is 1470.9 secs Computing kpt #: 262 total cpu time spent up to now is 1476.0 secs Computing kpt #: 263 total cpu time spent up to now is 1481.0 secs Computing kpt #: 264 total cpu time spent up to now is 1485.6 secs Computing kpt #: 265 total cpu time spent up to now is 1491.2 secs Computing kpt #: 266 total cpu time spent up to now is 1497.5 secs Computing kpt #: 267 total cpu time spent up to now is 1502.2 secs Computing kpt #: 268 total cpu time spent up to now is 1509.6 secs Computing kpt #: 269 total cpu time spent up to now is 1513.9 secs Computing kpt #: 270 total cpu time spent up to now is 1518.3 secs Computing kpt #: 271 total cpu time spent up to now is 1523.3 secs Computing kpt #: 272 total cpu time spent up to now is 1528.0 secs Computing kpt #: 273 total cpu time spent up to now is 1533.8 secs Computing kpt #: 274 total cpu time spent up to now is 1540.1 secs Computing kpt #: 275 total cpu time spent up to now is 1545.1 secs Computing kpt #: 276 total cpu time spent up to now is 1550.6 secs Computing kpt #: 277 total cpu time spent up to now is 1555.5 secs Computing kpt #: 278 total cpu time spent up to now is 1560.3 secs Computing kpt #: 279 total cpu time spent up to now is 1565.6 secs Computing kpt #: 280 total cpu time spent up to now is 1570.7 secs Computing kpt #: 281 total cpu time spent up to now is 1576.3 secs Computing kpt #: 282 total cpu time spent up to now is 1582.6 secs Computing kpt #: 283 total cpu time spent up to now is 1590.0 secs Computing kpt #: 284 total cpu time spent up to now is 1597.9 secs Computing kpt #: 285 total cpu time spent up to now is 1604.6 secs Computing kpt #: 286 total cpu time spent up to now is 1611.4 secs Computing kpt #: 287 total cpu time spent up to now is 1619.4 secs Computing kpt #: 288 total cpu time spent up to now is 1628.0 secs Computing kpt #: 289 total cpu time spent up to now is 1632.7 secs Computing kpt #: 290 total cpu time spent up to now is 1639.7 secs Computing kpt #: 291 total cpu time spent up to now is 1645.8 secs Computing kpt #: 292 total cpu time spent up to now is 1652.4 secs Computing kpt #: 293 total cpu time spent up to now is 1659.9 secs Computing kpt #: 294 total cpu time spent up to now is 1665.7 secs Computing kpt #: 295 total cpu time spent up to now is 1671.3 secs Computing kpt #: 296 total cpu time spent up to now is 1677.1 secs Computing kpt #: 297 total cpu time spent up to now is 1683.0 secs Computing kpt #: 298 total cpu time spent up to now is 1687.9 secs Computing kpt #: 299 total cpu time spent up to now is 1692.9 secs Computing kpt #: 300 total cpu time spent up to now is 1698.8 secs Computing kpt #: 301 total cpu time spent up to now is 1703.9 secs Computing kpt #: 302 total cpu time spent up to now is 1709.0 secs Computing kpt #: 303 total cpu time spent up to now is 1714.6 secs Computing kpt #: 304 total cpu time spent up to now is 1718.8 secs Computing kpt #: 305 total cpu time spent up to now is 1724.1 secs Computing kpt #: 306 total cpu time spent up to now is 1731.5 secs Computing kpt #: 307 total cpu time spent up to now is 1736.6 secs Computing kpt #: 308 total cpu time spent up to now is 1741.6 secs Computing kpt #: 309 total cpu time spent up to now is 1746.7 secs Computing kpt #: 310 total cpu time spent up to now is 1751.5 secs Computing kpt #: 311 total cpu time spent up to now is 1756.2 secs Computing kpt #: 312 total cpu time spent up to now is 1761.1 secs Computing kpt #: 313 total cpu time spent up to now is 1766.1 secs Computing kpt #: 314 total cpu time spent up to now is 1770.7 secs Computing kpt #: 315 total cpu time spent up to now is 1776.1 secs Computing kpt #: 316 total cpu time spent up to now is 1782.3 secs Computing kpt #: 317 total cpu time spent up to now is 1788.3 secs Computing kpt #: 318 total cpu time spent up to now is 1793.7 secs Computing kpt #: 319 total cpu time spent up to now is 1799.8 secs Computing kpt #: 320 total cpu time spent up to now is 1804.7 secs Computing kpt #: 321 total cpu time spent up to now is 1810.4 secs Computing kpt #: 322 total cpu time spent up to now is 1815.7 secs Computing kpt #: 323 total cpu time spent up to now is 1820.9 secs Computing kpt #: 324 total cpu time spent up to now is 1825.9 secs Computing kpt #: 325 total cpu time spent up to now is 1830.7 secs Computing kpt #: 326 total cpu time spent up to now is 1835.5 secs Computing kpt #: 327 total cpu time spent up to now is 1840.7 secs Computing kpt #: 328 total cpu time spent up to now is 1845.7 secs Computing kpt #: 329 total cpu time spent up to now is 1850.7 secs Computing kpt #: 330 total cpu time spent up to now is 1856.0 secs Computing kpt #: 331 total cpu time spent up to now is 1861.9 secs Computing kpt #: 332 total cpu time spent up to now is 1867.7 secs Computing kpt #: 333 total cpu time spent up to now is 1873.1 secs Computing kpt #: 334 total cpu time spent up to now is 1878.7 secs Computing kpt #: 335 total cpu time spent up to now is 1883.6 secs Computing kpt #: 336 total cpu time spent up to now is 1888.3 secs Computing kpt #: 337 total cpu time spent up to now is 1893.5 secs Computing kpt #: 338 total cpu time spent up to now is 1899.4 secs Computing kpt #: 339 total cpu time spent up to now is 1904.8 secs Computing kpt #: 340 total cpu time spent up to now is 1910.2 secs Computing kpt #: 341 total cpu time spent up to now is 1915.6 secs Computing kpt #: 342 total cpu time spent up to now is 1920.7 secs Computing kpt #: 343 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1928.1 secs Computing kpt #: 344 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1935.4 secs Computing kpt #: 345 total cpu time spent up to now is 1941.9 secs Computing kpt #: 346 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1949.2 secs Computing kpt #: 347 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1957.2 secs Computing kpt #: 348 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1964.4 secs Computing kpt #: 349 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1971.7 secs Computing kpt #: 350 total cpu time spent up to now is 1976.8 secs ethr = 1.92E-11, avg # of iterations = 46.1 total cpu time spent up to now is 1976.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8023 PWs) bands (ev): -11.2106 -11.2106 -11.0308 -11.0308 -10.8301 -10.8301 -10.6191 -10.6191 -4.0774 -4.0774 -4.0356 -4.0356 -3.5879 -3.5879 -3.5829 -3.5829 -2.6589 -2.6589 -2.5603 -2.5603 -2.0471 -2.0471 -2.0305 -2.0305 -1.6754 -1.6754 -1.6625 -1.6625 -0.6481 -0.6481 -0.4089 -0.4089 0.6621 0.6621 1.1710 1.1710 1.8290 1.8290 2.0234 2.0234 2.1500 2.1500 2.2471 2.2471 2.2986 2.2986 2.4686 2.4686 2.5965 2.5965 2.6346 2.6346 4.8570 4.8570 5.9695 5.9695 7.4635 7.4635 7.5581 7.5581 9.0964 9.0964 k = 0.0073 0.0107-0.0000 ( 8027 PWs) bands (ev): -11.2103 -11.2103 -11.0306 -11.0306 -10.8300 -10.8300 -10.6191 -10.6191 -4.0774 -4.0773 -4.0356 -4.0355 -3.5878 -3.5878 -3.5828 -3.5828 -2.6588 -2.6586 -2.5603 -2.5601 -2.0471 -2.0470 -2.0306 -2.0303 -1.6753 -1.6752 -1.6624 -1.6623 -0.6483 -0.6479 -0.4102 -0.4098 0.6619 0.6621 1.1705 1.1705 1.8275 1.8294 2.0229 2.0250 2.1446 2.1500 2.2399 2.2443 2.2931 2.3055 2.4619 2.4736 2.5920 2.6008 2.6269 2.6409 4.8593 4.8601 5.9692 5.9697 7.4664 7.4679 7.5612 7.5626 9.0940 9.0962 k = 0.0146 0.0215-0.0000 ( 8023 PWs) bands (ev): -11.2094 -11.2094 -11.0300 -11.0300 -10.8296 -10.8296 -10.6191 -10.6191 -4.0771 -4.0770 -4.0354 -4.0352 -3.5874 -3.5874 -3.5826 -3.5825 -2.6584 -2.6581 -2.5602 -2.5598 -2.0471 -2.0468 -2.0306 -2.0301 -1.6749 -1.6748 -1.6621 -1.6619 -0.6485 -0.6477 -0.4134 -0.4126 0.6615 0.6620 1.1688 1.1689 1.8250 1.8287 2.0234 2.0277 2.1335 2.1448 2.2263 2.2312 2.2897 2.3105 2.4543 2.4763 2.5871 2.6038 2.6187 2.6460 4.8671 4.8687 5.9689 5.9697 7.4768 7.4797 7.5720 7.5749 9.0888 9.0932 k = 0.0220 0.0322-0.0000 ( 8019 PWs) bands (ev): -11.2079 -11.2079 -11.0290 -11.0290 -10.8291 -10.8291 -10.6192 -10.6191 -4.0767 -4.0765 -4.0350 -4.0348 -3.5869 -3.5869 -3.5821 -3.5821 -2.6577 -2.6572 -2.5599 -2.5593 -2.0470 -2.0466 -2.0307 -2.0299 -1.6743 -1.6742 -1.6615 -1.6613 -0.6487 -0.6474 -0.4187 -0.4175 0.6609 0.6616 1.1660 1.1661 1.8212 1.8268 2.0245 2.0316 2.1169 2.1347 2.2086 2.2116 2.2856 2.3120 2.4463 2.4765 2.5794 2.6041 2.6122 2.6504 4.8802 4.8825 5.9684 5.9696 7.4943 7.4987 7.5904 7.5947 9.0810 9.0876 k = 0.0293 0.0430-0.0000 ( 8021 PWs) bands (ev): -11.2059 -11.2059 -11.0275 -11.0275 -10.8283 -10.8283 -10.6192 -10.6192 -4.0761 -4.0759 -4.0345 -4.0341 -3.5861 -3.5861 -3.5815 -3.5815 -2.6567 -2.6561 -2.5595 -2.5587 -2.0468 -2.0463 -2.0306 -2.0296 -1.6735 -1.6733 -1.6607 -1.6605 -0.6489 -0.6472 -0.4259 -0.4243 0.6601 0.6611 1.1621 1.1623 1.8160 1.8236 2.0257 2.0367 2.0947 2.1201 2.1887 2.1888 2.2781 2.3091 2.4385 2.4744 2.5665 2.6004 2.6093 2.6543 4.8985 4.9016 5.9677 5.9694 7.5188 7.5245 7.6162 7.6219 9.0708 9.0795 k = 0.0366 0.0537-0.0000 ( 8022 PWs) bands (ev): -11.2033 -11.2033 -11.0257 -11.0257 -10.8272 -10.8272 -10.6193 -10.6193 -4.0753 -4.0751 -4.0338 -4.0334 -3.5852 -3.5851 -3.5808 -3.5807 -2.6555 -2.6546 -2.5589 -2.5579 -2.0466 -2.0459 -2.0305 -2.0292 -1.6724 -1.6722 -1.6597 -1.6594 -0.6491 -0.6470 -0.4350 -0.4330 0.6591 0.6602 1.1572 1.1573 1.8092 1.8187 2.0261 2.0425 2.0679 2.1019 2.1646 2.1683 2.2663 2.3016 2.4312 2.4706 2.5485 2.5926 2.6088 2.6573 4.9219 4.9256 5.9669 5.9691 7.5499 7.5569 7.6491 7.6562 9.0580 9.0688 k = 0.0439 0.0645-0.0000 ( 8022 PWs) bands (ev): -11.2001 -11.2001 -11.0235 -11.0235 -10.8260 -10.8260 -10.6194 -10.6194 -4.0744 -4.0741 -4.0329 -4.0324 -3.5840 -3.5839 -3.5798 -3.5797 -2.6539 -2.6528 -2.5582 -2.5570 -2.0463 -2.0455 -2.0304 -2.0288 -1.6712 -1.6708 -1.6585 -1.6581 -0.6494 -0.6468 -0.4457 -0.4435 0.6579 0.6589 1.1511 1.1512 1.8002 1.8118 2.0240 2.0348 2.0517 2.0813 2.1401 2.1494 2.2500 2.2896 2.4243 2.4656 2.5268 2.5808 2.6084 2.6588 4.9499 4.9542 5.9659 5.9685 7.5872 7.5954 7.6889 7.6973 9.0428 9.0550 k = 0.0513 0.0752-0.0000 ( 8020 PWs) bands (ev): -11.1964 -11.1964 -11.0209 -11.0209 -10.8245 -10.8245 -10.6195 -10.6195 -4.0733 -4.0729 -4.0318 -4.0313 -3.5826 -3.5825 -3.5788 -3.5786 -2.6520 -2.6508 -2.5573 -2.5560 -2.0459 -2.0449 -2.0302 -2.0284 -1.6697 -1.6692 -1.6571 -1.6566 -0.6496 -0.6466 -0.4581 -0.4555 0.6563 0.6573 1.1439 1.1440 1.7888 1.8022 2.0016 2.0161 2.0588 2.0608 2.1157 2.1340 2.2296 2.2733 2.4178 2.4600 2.5021 2.5652 2.6068 2.6580 4.9823 4.9872 5.9647 5.9678 7.6301 7.6394 7.7350 7.7447 9.0249 9.0371 k = 0.0586 0.0859-0.0000 ( 8024 PWs) bands (ev): -11.1921 -11.1921 -11.0179 -11.0179 -10.8228 -10.8228 -10.6197 -10.6197 -4.0720 -4.0716 -4.0307 -4.0300 -3.5811 -3.5810 -3.5775 -3.5773 -2.6499 -2.6485 -2.5563 -2.5548 -2.0455 -2.0443 -2.0299 -2.0278 -1.6681 -1.6675 -1.6556 -1.6550 -0.6499 -0.6465 -0.4719 -0.4691 0.6543 0.6552 1.1355 1.1358 1.7743 1.7893 1.9665 1.9996 2.0425 2.0667 2.0918 2.1244 2.2061 2.2532 2.4113 2.4537 2.4750 2.5465 2.6028 2.6545 5.0187 5.0242 5.9633 5.9667 7.6781 7.6883 7.7869 7.7979 9.0044 9.0150 k = 0.0659 0.0967-0.0000 ( 8034 PWs) bands (ev): -11.1873 -11.1873 -11.0146 -11.0146 -10.8209 -10.8209 -10.6199 -10.6199 -4.0705 -4.0701 -4.0293 -4.0286 -3.5794 -3.5792 -3.5761 -3.5759 -2.6475 -2.6459 -2.5552 -2.5535 -2.0450 -2.0437 -2.0295 -2.0272 -1.6663 -1.6655 -1.6539 -1.6531 -0.6502 -0.6465 -0.4871 -0.4839 0.6519 0.6526 1.1259 1.1265 1.7565 1.7720 1.9312 1.9758 2.0251 2.0663 2.0764 2.1213 2.1808 2.2301 2.4044 2.4417 2.4508 2.5249 2.5961 2.6479 5.0587 5.0647 5.9615 5.9655 7.7306 7.7415 7.8440 7.8563 8.9822 8.9906 k = 0.0732 0.1074-0.0000 ( 8024 PWs) bands (ev): -11.1819 -11.1819 -11.0109 -11.0109 -10.8189 -10.8188 -10.6201 -10.6201 -4.0689 -4.0684 -4.0278 -4.0270 -3.5775 -3.5773 -3.5746 -3.5743 -2.6449 -2.6431 -2.5540 -2.5520 -2.0444 -2.0429 -2.0291 -2.0265 -1.6644 -1.6634 -1.6520 -1.6512 -0.6505 -0.6465 -0.5033 -0.4999 0.6491 0.6494 1.1150 1.1163 1.7352 1.7498 1.8968 1.9480 2.0072 2.0452 2.0797 2.1237 2.1568 2.2047 2.3968 2.4115 2.4424 2.5009 2.5863 2.6383 5.1018 5.1084 5.9595 5.9639 7.7869 7.7982 7.9054 7.9190 8.9597 8.9662 k = 0.0806 0.1182-0.0000 ( 8032 PWs) bands (ev): -11.1761 -11.1761 -11.0069 -11.0069 -10.8166 -10.8166 -10.6204 -10.6203 -4.0671 -4.0665 -4.0261 -4.0253 -3.5756 -3.5753 -3.5729 -3.5726 -2.6420 -2.6400 -2.5526 -2.5505 -2.0437 -2.0421 -2.0286 -2.0257 -1.6624 -1.6612 -1.6501 -1.6490 -0.6510 -0.6466 -0.5204 -0.5169 0.6455 0.6456 1.1030 1.1050 1.7105 1.7226 1.8634 1.9180 1.9886 2.0246 2.0741 2.1295 2.1414 2.1781 2.3775 2.3881 2.4352 2.4751 2.5733 2.6255 5.1475 5.1546 5.9570 5.9620 7.8462 7.8577 7.9702 7.9852 8.9384 8.9434 k = 0.0879 0.1289-0.0000 ( 8038 PWs) bands (ev): -11.1698 -11.1698 -11.0026 -11.0026 -10.8141 -10.8141 -10.6206 -10.6206 -4.0651 -4.0645 -4.0243 -4.0234 -3.5735 -3.5731 -3.5711 -3.5707 -2.6390 -2.6367 -2.5511 -2.5488 -2.0429 -2.0412 -2.0279 -2.0248 -1.6604 -1.6589 -1.6480 -1.6468 -0.6515 -0.6468 -0.5383 -0.5347 0.6409 0.6416 1.0898 1.0927 1.6831 1.6909 1.8308 1.8864 1.9694 2.0058 2.0532 2.1373 2.1401 2.1517 2.3417 2.3778 2.4279 2.4484 2.5572 2.6098 5.1954 5.2030 5.9543 5.9598 7.9077 7.9190 8.0371 8.0535 8.9198 8.9239 k = 0.0952 0.1397-0.0000 ( 8038 PWs) bands (ev): -11.1631 -11.1631 -10.9980 -10.9980 -10.8115 -10.8115 -10.6210 -10.6209 -4.0630 -4.0623 -4.0224 -4.0214 -3.5713 -3.5709 -3.5691 -3.5687 -2.6357 -2.6332 -2.5496 -2.5470 -2.0420 -2.0402 -2.0271 -2.0238 -1.6583 -1.6565 -1.6459 -1.6445 -0.6521 -0.6472 -0.5568 -0.5531 0.6356 0.6369 1.0754 1.0795 1.6537 1.6559 1.7981 1.8537 1.9488 1.9886 2.0229 2.1265 2.1463 2.1472 2.3044 2.3650 2.4202 2.4222 2.5381 2.5914 5.2450 5.2530 5.9511 5.9572 7.9705 7.9811 8.1048 8.1227 8.9055 8.9089 k = 0.1025 0.1504-0.0000 ( 8036 PWs) bands (ev): -11.1559 -11.1558 -10.9931 -10.9931 -10.8087 -10.8087 -10.6214 -10.6213 -4.0606 -4.0599 -4.0203 -4.0192 -3.5690 -3.5686 -3.5671 -3.5665 -2.6322 -2.6295 -2.5479 -2.5451 -2.0410 -2.0391 -2.0263 -2.0227 -1.6561 -1.6540 -1.6438 -1.6422 -0.6528 -0.6477 -0.5756 -0.5719 0.6295 0.6316 1.0597 1.0654 1.6188 1.6229 1.7647 1.8201 1.9258 1.9727 1.9889 2.1044 2.1546 2.1572 2.2667 2.3480 2.3988 2.4122 2.5163 2.5705 5.2956 5.3041 5.9475 5.9542 8.0336 8.0430 8.1715 8.1910 8.8969 8.9001 k = 0.1099 0.1611-0.0000 ( 8028 PWs) bands (ev): -11.1482 -11.1482 -10.9880 -10.9880 -10.8058 -10.8058 -10.6218 -10.6217 -4.0582 -4.0574 -4.0180 -4.0169 -3.5667 -3.5662 -3.5649 -3.5642 -2.6285 -2.6256 -2.5461 -2.5431 -2.0400 -2.0378 -2.0252 -2.0214 -1.6540 -1.6515 -1.6418 -1.6398 -0.6537 -0.6485 -0.5946 -0.5909 0.6226 0.6254 1.0428 1.0504 1.5809 1.5916 1.7302 1.7860 1.8995 1.9531 1.9577 2.0861 2.1596 2.1677 2.2310 2.3256 2.3802 2.4039 2.4922 2.5475 5.3469 5.3559 5.9435 5.9509 8.0957 8.1033 8.2353 8.2563 8.8954 8.8990 k = 0.1172 0.1719-0.0000 ( 8024 PWs) bands (ev): -11.1402 -11.1402 -10.9826 -10.9826 -10.8027 -10.8027 -10.6223 -10.6222 -4.0555 -4.0547 -4.0157 -4.0145 -3.5644 -3.5638 -3.5626 -3.5618 -2.6247 -2.6216 -2.5443 -2.5411 -2.0388 -2.0365 -2.0241 -2.0200 -1.6520 -1.6490 -1.6397 -1.6375 -0.6547 -0.6494 -0.6136 -0.6100 0.6148 0.6186 1.0247 1.0344 1.5429 1.5604 1.6947 1.7517 1.8695 1.9174 1.9419 2.0715 2.1512 2.1771 2.2072 2.2990 2.3667 2.3956 2.4663 2.5229 5.3983 5.4078 5.9392 5.9472 8.1555 8.1606 8.2941 8.3164 8.9022 8.9071 k = 0.1245 0.1826-0.0000 ( 8018 PWs) bands (ev): -11.1318 -11.1318 -10.9770 -10.9770 -10.7995 -10.7995 -10.6228 -10.6227 -4.0527 -4.0518 -4.0132 -4.0119 -3.5620 -3.5613 -3.5602 -3.5593 -2.6207 -2.6174 -2.5424 -2.5390 -2.0374 -2.0351 -2.0228 -2.0185 -1.6500 -1.6465 -1.6378 -1.6352 -0.6559 -0.6506 -0.6324 -0.6288 0.6062 0.6110 1.0055 1.0176 1.5055 1.5297 1.6580 1.7175 1.8362 1.8816 1.9250 2.0596 2.1216 2.1838 2.2031 2.2710 2.3572 2.3871 2.4397 2.4972 5.4494 5.4594 5.9344 5.9431 8.2116 8.2137 8.3460 8.3692 8.9176 8.9249 k = 0.1318 0.1934-0.0000 ( 8010 PWs) bands (ev): -11.1231 -11.1231 -10.9713 -10.9713 -10.7962 -10.7962 -10.6234 -10.6233 -4.0498 -4.0488 -4.0105 -4.0092 -3.5597 -3.5589 -3.5577 -3.5567 -2.6166 -2.6131 -2.5405 -2.5368 -2.0360 -2.0335 -2.0213 -2.0168 -1.6481 -1.6441 -1.6360 -1.6330 -0.6576 -0.6530 -0.6506 -0.6466 0.5967 0.6026 0.9851 0.9998 1.4692 1.4999 1.6205 1.6836 1.8005 1.8466 1.9060 2.0473 2.0852 2.1848 2.2061 2.2448 2.3515 2.3771 2.4149 2.4709 5.4997 5.5102 5.9293 5.9388 8.2612 8.2628 8.3900 8.4136 8.9412 8.9517 k = 0.1392 0.2041-0.0000 ( 8010 PWs) bands (ev): -11.1141 -11.1141 -10.9653 -10.9653 -10.7928 -10.7927 -10.6240 -10.6240 -4.0467 -4.0457 -4.0078 -4.0063 -3.5573 -3.5564 -3.5552 -3.5540 -2.6125 -2.6086 -2.5385 -2.5346 -2.0344 -2.0318 -2.0197 -2.0150 -1.6464 -1.6418 -1.6343 -1.6309 -0.6694 -0.6667 -0.6582 -0.6528 0.5863 0.5934 0.9635 0.9811 1.4345 1.4713 1.5823 1.6505 1.7630 1.8126 1.8842 2.0228 2.0592 2.1752 2.2085 2.2254 2.3499 2.3608 2.3981 2.4448 5.5488 5.5599 5.9238 5.9341 8.3025 8.3079 8.4262 8.4491 8.9715 8.9856 k = 0.1465 0.2149-0.0000 ( 8016 PWs) bands (ev): -11.1047 -11.1047 -10.9592 -10.9592 -10.7893 -10.7892 -10.6248 -10.6247 -4.0435 -4.0424 -4.0049 -4.0034 -3.5550 -3.5540 -3.5526 -3.5514 -2.6082 -2.6041 -2.5365 -2.5324 -2.0327 -2.0300 -2.0179 -2.0130 -1.6448 -1.6396 -1.6329 -1.6290 -0.6867 -0.6841 -0.6601 -0.6549 0.5752 0.5835 0.9409 0.9614 1.4016 1.4440 1.5436 1.6181 1.7247 1.7800 1.8592 1.9829 2.0476 2.1531 2.2081 2.2147 2.3365 2.3515 2.3925 2.4203 5.5963 5.6080 5.9181 5.9292 8.3373 8.3465 8.4555 8.4767 9.0075 9.0245 k = 0.1538 0.2256-0.0000 ( 8018 PWs) bands (ev): -11.0952 -11.0952 -10.9530 -10.9530 -10.7857 -10.7856 -10.6255 -10.6255 -4.0401 -4.0390 -4.0019 -4.0004 -3.5527 -3.5515 -3.5501 -3.5487 -2.6038 -2.5995 -2.5345 -2.5301 -2.0308 -2.0280 -2.0159 -2.0108 -1.6434 -1.6376 -1.6317 -1.6273 -0.7032 -0.7011 -0.6620 -0.6571 0.5633 0.5729 0.9173 0.9406 1.3707 1.4180 1.5046 1.5869 1.6860 1.7491 1.8310 1.9387 2.0387 2.1238 2.2042 2.2079 2.3095 2.3521 2.3942 2.4013 5.6418 5.6542 5.9120 5.9240 8.3665 8.3789 8.4791 8.4975 9.0484 9.0674 k = 0.1611 0.2363-0.0000 ( 8002 PWs) bands (ev): -11.0853 -11.0853 -10.9467 -10.9467 -10.7820 -10.7820 -10.6264 -10.6263 -4.0365 -4.0354 -3.9989 -3.9972 -3.5503 -3.5491 -3.5476 -3.5461 -2.5994 -2.5948 -2.5325 -2.5278 -2.0288 -2.0259 -2.0137 -2.0086 -1.6422 -1.6357 -1.6307 -1.6257 -0.7189 -0.7172 -0.6640 -0.6595 0.5507 0.5617 0.8928 0.9188 1.3422 1.3932 1.4654 1.5568 1.6476 1.7199 1.7998 1.8937 2.0284 2.0910 2.1971 2.2023 2.2827 2.3423 2.3964 2.4007 5.6852 5.6982 5.9058 5.9187 8.3910 8.4061 8.4980 8.5129 9.0938 9.1138 k = 0.1685 0.2471-0.0000 ( 7994 PWs) bands (ev): -11.0753 -11.0753 -10.9403 -10.9403 -10.7783 -10.7783 -10.6273 -10.6273 -4.0329 -4.0316 -3.9957 -3.9940 -3.5481 -3.5467 -3.5452 -3.5435 -2.5950 -2.5901 -2.5304 -2.5256 -2.0266 -2.0236 -2.0114 -2.0061 -1.6412 -1.6341 -1.6299 -1.6244 -0.7336 -0.7324 -0.6663 -0.6622 0.5375 0.5500 0.8674 0.8957 1.3158 1.3693 1.4264 1.5282 1.6101 1.6926 1.7661 1.8488 2.0148 2.0559 2.1878 2.1974 2.2575 2.3221 2.4049 2.4107 5.7260 5.7397 5.8993 5.9132 8.4124 8.4296 8.5130 8.5237 9.1427 9.1630 k = 0.1758 0.2578-0.0000 ( 8002 PWs) bands (ev): -11.0651 -11.0651 -10.9339 -10.9339 -10.7745 -10.7745 -10.6283 -10.6283 -4.0291 -4.0278 -3.9924 -3.9907 -3.5458 -3.5443 -3.5428 -3.5409 -2.5905 -2.5854 -2.5285 -2.5233 -2.0242 -2.0212 -2.0089 -2.0035 -1.6404 -1.6326 -1.6295 -1.6234 -0.7472 -0.7465 -0.6687 -0.6651 0.5237 0.5377 0.8412 0.8715 1.2916 1.3459 1.3879 1.5010 1.5740 1.6670 1.7311 1.8044 1.9969 2.0190 2.1776 2.1932 2.2346 2.2986 2.4189 2.4233 5.7640 5.7784 5.8927 5.9076 8.4319 8.4508 8.5248 8.5312 9.1942 9.2139 k = 0.1831 0.2686-0.0000 ( 7994 PWs) bands (ev): -11.0548 -11.0548 -10.9274 -10.9274 -10.7708 -10.7707 -10.6294 -10.6294 -4.0252 -4.0238 -3.9891 -3.9872 -3.5436 -3.5420 -3.5405 -3.5385 -2.5861 -2.5807 -2.5265 -2.5211 -2.0217 -2.0187 -2.0063 -2.0008 -1.6398 -1.6313 -1.6293 -1.6226 -0.7597 -0.7595 -0.6713 -0.6683 0.5095 0.5250 0.8142 0.8461 1.2690 1.3224 1.3505 1.4754 1.5400 1.6422 1.6960 1.7610 1.9745 1.9805 2.1665 2.1895 2.2147 2.2746 2.4352 2.4377 5.7991 5.8141 5.8862 5.9022 8.4505 8.4709 8.5339 8.5359 9.2468 9.2654 k = 0.1904 0.2793-0.0000 ( 8008 PWs) bands (ev): -11.0443 -11.0443 -10.9210 -10.9209 -10.7670 -10.7669 -10.6306 -10.6305 -4.0212 -4.0197 -3.9857 -3.9838 -3.5415 -3.5397 -3.5383 -3.5361 -2.5816 -2.5760 -2.5246 -2.5190 -2.0190 -2.0160 -2.0035 -1.9979 -1.6395 -1.6303 -1.6294 -1.6221 -0.7713 -0.7709 -0.6741 -0.6717 0.4949 0.5121 0.7866 0.8195 1.2468 1.2981 1.3156 1.4515 1.5084 1.6163 1.6637 1.7190 1.9411 1.9483 2.1530 2.1854 2.1994 2.2514 2.4528 2.4535 5.8306 5.8461 5.8799 5.8973 8.4689 8.4907 8.5387 8.5410 9.2996 9.3163 k = 0.1977 0.2901-0.0000 ( 8018 PWs) bands (ev): -11.0338 -11.0338 -10.9145 -10.9145 -10.7632 -10.7631 -10.6318 -10.6318 -4.0170 -4.0156 -3.9823 -3.9802 -3.5395 -3.5375 -3.5362 -3.5339 -2.5773 -2.5714 -2.5228 -2.5169 -2.0161 -2.0131 -2.0006 -1.9950 -1.6394 -1.6297 -1.6295 -1.6219 -0.7819 -0.7809 -0.6771 -0.6752 0.4801 0.4989 0.7584 0.7919 1.2229 1.2724 1.2852 1.4294 1.4798 1.5863 1.6374 1.6787 1.9012 1.9195 2.1358 2.1791 2.1898 2.2310 2.4701 2.4709 5.8559 5.8712 5.8768 5.8962 8.4875 8.5106 8.5401 8.5466 9.3512 9.3655 k = 0.2051 0.3008-0.0000 ( 8014 PWs) bands (ev): -11.0232 -11.0232 -10.9081 -10.9081 -10.7593 -10.7593 -10.6331 -10.6331 -4.0128 -4.0112 -3.9787 -3.9767 -3.5376 -3.5355 -3.5343 -3.5318 -2.5729 -2.5668 -2.5210 -2.5149 -2.0131 -2.0101 -1.9975 -1.9919 -1.6394 -1.6303 -1.6290 -1.6220 -0.7911 -0.7896 -0.6802 -0.6790 0.4651 0.4855 0.7296 0.7633 1.1947 1.2448 1.2618 1.4090 1.4544 1.5516 1.6181 1.6404 1.8615 1.8895 2.1152 2.1677 2.1848 2.2162 2.4871 2.4893 5.8604 5.8774 5.8914 5.9108 8.5065 8.5305 8.5409 8.5517 9.4007 9.4120 k = 0.2124 0.3115-0.0000 ( 8024 PWs) bands (ev): -11.0126 -11.0126 -10.9017 -10.9017 -10.7556 -10.7555 -10.6345 -10.6345 -4.0085 -4.0069 -3.9752 -3.9730 -3.5358 -3.5335 -3.5324 -3.5298 -2.5687 -2.5623 -2.5194 -2.5129 -2.0100 -2.0070 -1.9943 -1.9887 -1.6396 -1.6311 -1.6286 -1.6223 -0.7990 -0.7970 -0.6835 -0.6828 0.4501 0.4722 0.7005 0.7338 1.1623 1.2151 1.2454 1.3897 1.4323 1.5143 1.6037 1.6044 1.8228 1.8597 2.0925 2.1496 2.1826 2.2084 2.5044 2.5077 5.8546 5.8732 5.9129 5.9326 8.5255 8.5419 8.5478 8.5594 9.4470 9.4549 k = 0.2197 0.3223-0.0000 ( 8022 PWs) bands (ev): -11.0019 -11.0019 -10.8955 -10.8955 -10.7518 -10.7517 -10.6360 -10.6360 -4.0040 -4.0024 -3.9716 -3.9694 -3.5341 -3.5317 -3.5307 -3.5280 -2.5645 -2.5579 -2.5178 -2.5111 -2.0067 -2.0038 -1.9910 -1.9854 -1.6400 -1.6321 -1.6285 -1.6228 -0.8056 -0.8031 -0.6868 -0.6867 0.4352 0.4589 0.6710 0.7036 1.1274 1.1837 1.2340 1.3706 1.4138 1.4762 1.5706 1.5919 1.7864 1.8315 2.0688 2.1274 2.1817 2.2048 2.5216 2.5258 5.8476 5.8675 5.9326 5.9529 8.5378 8.5501 8.5552 8.5773 9.4892 9.4933 k = 0.2270 0.3330-0.0000 ( 8024 PWs) bands (ev): -10.9914 -10.9914 -10.8893 -10.8893 -10.7481 -10.7480 -10.6376 -10.6375 -3.9996 -3.9978 -3.9680 -3.9657 -3.5325 -3.5300 -3.5292 -3.5263 -2.5604 -2.5536 -2.5163 -2.5093 -2.0032 -2.0004 -1.9876 -1.9821 -1.6404 -1.6333 -1.6286 -1.6236 -0.8109 -0.8080 -0.6906 -0.6902 0.4205 0.4458 0.6412 0.6727 1.0918 1.1509 1.2258 1.3509 1.3988 1.4382 1.5390 1.5806 1.7539 1.8061 2.0445 2.1034 2.1816 2.2032 2.5387 2.5435 5.8402 5.8611 5.9496 5.9705 8.5397 8.5592 8.5694 8.5990 9.5255 9.5259 k = 0.2344 0.3438-0.0000 ( 8020 PWs) bands (ev): -10.9808 -10.9808 -10.8833 -10.8833 -10.7444 -10.7443 -10.6392 -10.6392 -3.9950 -3.9932 -3.9644 -3.9620 -3.5311 -3.5284 -3.5278 -3.5248 -2.5565 -2.5494 -2.5149 -2.5077 -1.9997 -1.9970 -1.9841 -1.9787 -1.6410 -1.6346 -1.6288 -1.6246 -0.8148 -0.8117 -0.6945 -0.6937 0.4061 0.4328 0.6113 0.6414 1.0564 1.1175 1.2199 1.3297 1.3872 1.4009 1.5090 1.5673 1.7278 1.7849 2.0200 2.0788 2.1816 2.2022 2.5552 2.5607 5.8325 5.8545 5.9637 5.9854 8.5410 8.5629 8.5903 8.6215 9.5501 9.5532 k = 0.2417 0.3545-0.0000 ( 8030 PWs) bands (ev): -10.9704 -10.9704 -10.8773 -10.8773 -10.7408 -10.7407 -10.6409 -10.6409 -3.9904 -3.9885 -3.9607 -3.9583 -3.5298 -3.5270 -3.5266 -3.5235 -2.5528 -2.5454 -2.5137 -2.5062 -1.9961 -1.9935 -1.9806 -1.9754 -1.6416 -1.6360 -1.6292 -1.6257 -0.8174 -0.8142 -0.6983 -0.6971 0.3921 0.4200 0.5813 0.6098 1.0217 1.0839 1.2153 1.3070 1.3646 1.3784 1.4801 1.5496 1.7108 1.7688 1.9957 2.0541 2.1815 2.2014 2.5713 2.5771 5.8246 5.8475 5.9752 5.9976 8.5429 8.5669 8.6115 8.6442 9.5611 9.5677 k = 0.2490 0.3653-0.0000 ( 8036 PWs) bands (ev): -10.9601 -10.9601 -10.8716 -10.8716 -10.7372 -10.7372 -10.6427 -10.6426 -3.9858 -3.9838 -3.9571 -3.9546 -3.5287 -3.5258 -3.5255 -3.5223 -2.5492 -2.5416 -2.5125 -2.5047 -1.9923 -1.9900 -1.9770 -1.9719 -1.6422 -1.6374 -1.6298 -1.6270 -0.8189 -0.8156 -0.7019 -0.7005 0.3785 0.4075 0.5512 0.5779 0.9884 1.0507 1.2114 1.2831 1.3297 1.3717 1.4515 1.5265 1.7038 1.7585 1.9720 2.0298 2.1810 2.2003 2.5865 2.5926 5.8164 5.8402 5.9840 6.0071 8.5459 8.5715 8.6327 8.6667 9.5589 9.5691 k = 0.2563 0.3760-0.0000 ( 8030 PWs) bands (ev): -10.9499 -10.9498 -10.8660 -10.8660 -10.7337 -10.7337 -10.6445 -10.6445 -3.9811 -3.9791 -3.9535 -3.9509 -3.5278 -3.5247 -3.5246 -3.5213 -2.5459 -2.5380 -2.5115 -2.5034 -1.9886 -1.9864 -1.9734 -1.9685 -1.6429 -1.6388 -1.6306 -1.6283 -0.8191 -0.8160 -0.7053 -0.7038 0.3653 0.3952 0.5212 0.5459 0.9567 1.0185 1.2072 1.2584 1.2968 1.3661 1.4234 1.4991 1.7059 1.7538 1.9495 2.0062 2.1800 2.1989 2.6009 2.6072 5.8079 5.8326 5.9902 6.0140 8.5502 8.5769 8.6535 8.6888 9.5502 9.5631 k = 0.2637 0.3867-0.0000 ( 8044 PWs) bands (ev): -10.9398 -10.9398 -10.8605 -10.8605 -10.7303 -10.7303 -10.6464 -10.6464 -3.9764 -3.9743 -3.9499 -3.9473 -3.5270 -3.5238 -3.5238 -3.5205 -2.5428 -2.5347 -2.5106 -2.5022 -1.9848 -1.9828 -1.9698 -1.9652 -1.6436 -1.6402 -1.6317 -1.6296 -0.8181 -0.8154 -0.7084 -0.7070 0.3527 0.3830 0.4914 0.5140 0.9270 0.9876 1.2012 1.2333 1.2669 1.3590 1.3977 1.4695 1.7153 1.7542 1.9290 1.9837 2.1784 2.1970 2.6143 2.6206 5.7990 5.8245 5.9941 6.0185 8.5560 8.5832 8.6738 8.7101 9.5390 9.5542 k = 0.2710 0.3975-0.0000 ( 8046 PWs) bands (ev): -10.9299 -10.9299 -10.8553 -10.8553 -10.7270 -10.7270 -10.6484 -10.6483 -3.9717 -3.9696 -3.9464 -3.9437 -3.5264 -3.5232 -3.5231 -3.5199 -2.5400 -2.5316 -2.5097 -2.5011 -1.9809 -1.9792 -1.9663 -1.9618 -1.6443 -1.6415 -1.6329 -1.6309 -0.8161 -0.8139 -0.7111 -0.7100 0.3406 0.3710 0.4618 0.4820 0.8997 0.9583 1.1909 1.2084 1.2420 1.3436 1.3808 1.4396 1.7300 1.7586 1.9115 1.9626 2.1760 2.1944 2.6265 2.6329 5.7897 5.8160 5.9956 6.0206 8.5635 8.5906 8.6933 8.7302 9.5269 9.5446 k = 0.2783 0.4082-0.0000 ( 8038 PWs) bands (ev): -10.9203 -10.9203 -10.8502 -10.8502 -10.7238 -10.7238 -10.6504 -10.6503 -3.9670 -3.9648 -3.9428 -3.9401 -3.5260 -3.5228 -3.5226 -3.5195 -2.5374 -2.5288 -2.5089 -2.5001 -1.9771 -1.9755 -1.9628 -1.9585 -1.6452 -1.6426 -1.6345 -1.6321 -0.8131 -0.8117 -0.7134 -0.7127 0.3291 0.3590 0.4325 0.4503 0.8751 0.9311 1.1734 1.1839 1.2241 1.3178 1.3747 1.4111 1.7489 1.7649 1.8987 1.9436 2.1729 2.1912 2.6375 2.6437 5.7799 5.8068 5.9950 6.0205 8.5730 8.5991 8.7118 8.7490 9.5145 9.5350 k = 0.2856 0.4190-0.0000 ( 8034 PWs) bands (ev): -10.9108 -10.9108 -10.8454 -10.8454 -10.7207 -10.7206 -10.6524 -10.6524 -3.9624 -3.9601 -3.9394 -3.9366 -3.5257 -3.5225 -3.5222 -3.5192 -2.5351 -2.5264 -2.5082 -2.4992 -1.9733 -1.9719 -1.9593 -1.9553 -1.6462 -1.6434 -1.6361 -1.6332 -0.8091 -0.8087 -0.7153 -0.7151 0.3180 0.3470 0.4036 0.4189 0.8535 0.9060 1.1504 1.1602 1.2105 1.2881 1.3726 1.3852 1.7708 1.7708 1.8930 1.9271 2.1690 2.1872 2.6470 2.6532 5.7696 5.7971 5.9923 6.0183 8.5843 8.6087 8.7292 8.7660 9.5019 9.5257 k = 0.2930 0.4297-0.0000 ( 8046 PWs) bands (ev): -10.9016 -10.9016 -10.8407 -10.8407 -10.7177 -10.7176 -10.6545 -10.6545 -3.9578 -3.9555 -3.9360 -3.9331 -3.5257 -3.5224 -3.5221 -3.5191 -2.5332 -2.5243 -2.5076 -2.4983 -1.9695 -1.9683 -1.9559 -1.9522 -1.6472 -1.6441 -1.6379 -1.6344 -0.8050 -0.8043 -0.7171 -0.7165 0.3074 0.3348 0.3752 0.3878 0.8351 0.8834 1.1255 1.1375 1.1972 1.2574 1.3628 1.3714 1.7741 1.7947 1.8962 1.9142 2.1643 2.1825 2.6551 2.6611 5.7586 5.7866 5.9876 6.0140 8.5976 8.6193 8.7453 8.7809 9.4893 9.5170 k = 0.3003 0.4405-0.0000 ( 8062 PWs) bands (ev): -10.8926 -10.8926 -10.8363 -10.8363 -10.7148 -10.7147 -10.6566 -10.6566 -3.9532 -3.9509 -3.9326 -3.9297 -3.5257 -3.5224 -3.5221 -3.5192 -2.5317 -2.5226 -2.5070 -2.4975 -1.9657 -1.9647 -1.9526 -1.9491 -1.6484 -1.6447 -1.6397 -1.6356 -0.8008 -0.7987 -0.7187 -0.7172 0.2971 0.3225 0.3475 0.3572 0.8203 0.8633 1.1006 1.1159 1.1815 1.2270 1.3442 1.3696 1.7748 1.8187 1.9065 1.9086 2.1588 2.1770 2.6616 2.6673 5.7470 5.7753 5.9812 6.0079 8.6128 8.6309 8.7600 8.7933 9.4765 9.5088 k = 0.3076 0.4512-0.0000 ( 8062 PWs) bands (ev): -10.8840 -10.8839 -10.8321 -10.8321 -10.7120 -10.7119 -10.6588 -10.6587 -3.9487 -3.9464 -3.9293 -3.9264 -3.5259 -3.5226 -3.5222 -3.5194 -2.5305 -2.5212 -2.5064 -2.4968 -1.9620 -1.9612 -1.9494 -1.9461 -1.6495 -1.6452 -1.6416 -1.6369 -0.7962 -0.7925 -0.7198 -0.7172 0.2868 0.3098 0.3208 0.3271 0.8090 0.8459 1.0766 1.0956 1.1630 1.1973 1.3292 1.3666 1.7746 1.8393 1.9077 1.9284 2.1526 2.1707 2.6663 2.6719 5.7346 5.7632 5.9730 6.0000 8.6297 8.6432 8.7730 8.8027 9.4634 9.5009 k = 0.3149 0.4619-0.0000 ( 8070 PWs) bands (ev): -10.8755 -10.8755 -10.8281 -10.8281 -10.7093 -10.7093 -10.6610 -10.6609 -3.9444 -3.9419 -3.9261 -3.9231 -3.5263 -3.5229 -3.5226 -3.5198 -2.5297 -2.5203 -2.5058 -2.4961 -1.9584 -1.9577 -1.9462 -1.9431 -1.6507 -1.6457 -1.6435 -1.6383 -0.7912 -0.7858 -0.7204 -0.7166 0.2754 0.2949 0.2961 0.2997 0.8014 0.8313 1.0537 1.0765 1.1422 1.1689 1.3168 1.3617 1.7758 1.8522 1.9220 1.9535 2.1456 2.1637 2.6694 2.6746 5.7214 5.7502 5.9632 5.9904 8.6480 8.6557 8.7841 8.8085 9.4499 9.4880 k = 0.3223 0.4727-0.0000 ( 8070 PWs) bands (ev): -10.8674 -10.8674 -10.8244 -10.8244 -10.7068 -10.7067 -10.6631 -10.6631 -3.9401 -3.9376 -3.9229 -3.9200 -3.5267 -3.5234 -3.5230 -3.5203 -2.5292 -2.5197 -2.5053 -2.4954 -1.9548 -1.9543 -1.9432 -1.9403 -1.6518 -1.6463 -1.6454 -1.6398 -0.7858 -0.7785 -0.7204 -0.7152 0.2590 0.2679 0.2776 0.2848 0.7974 0.8193 1.0322 1.0585 1.1198 1.1423 1.3059 1.3546 1.7799 1.8592 1.9476 1.9819 2.1381 2.1560 2.6705 2.6756 5.7073 5.7363 5.9520 5.9792 8.6671 8.6681 8.7932 8.8102 9.4355 9.4461 k = 0.3296 0.4834-0.0000 ( 8068 PWs) bands (ev): -10.8596 -10.8596 -10.8208 -10.8208 -10.7043 -10.7042 -10.6653 -10.6653 -3.9360 -3.9335 -3.9198 -3.9169 -3.5273 -3.5240 -3.5237 -3.5210 -2.5290 -2.5195 -2.5048 -2.4949 -1.9513 -1.9509 -1.9402 -1.9376 -1.6529 -1.6473 -1.6469 -1.6414 -0.7803 -0.7710 -0.7198 -0.7131 0.2367 0.2399 0.2660 0.2717 0.7969 0.8100 1.0122 1.0412 1.0969 1.1182 1.2955 1.3451 1.7877 1.8656 1.9789 2.0125 2.1303 2.1475 2.6698 2.6746 5.6925 5.7215 5.9393 5.9666 8.6797 8.6861 8.7998 8.8071 9.4006 9.4224 k = 0.3369 0.4942-0.0000 ( 8066 PWs) bands (ev): -10.8521 -10.8521 -10.8175 -10.8175 -10.7020 -10.7019 -10.6675 -10.6674 -3.9320 -3.9295 -3.9168 -3.9138 -3.5280 -3.5247 -3.5244 -3.5218 -2.5291 -2.5196 -2.5044 -2.4944 -1.9478 -1.9475 -1.9374 -1.9349 -1.6540 -1.6492 -1.6475 -1.6430 -0.7746 -0.7632 -0.7186 -0.7103 0.2126 0.2130 0.2569 0.2587 0.7997 0.8032 0.9937 1.0242 1.0742 1.0975 1.2849 1.3334 1.7994 1.8740 2.0131 2.0435 2.1232 2.1384 2.6672 2.6718 5.6768 5.7057 5.9254 5.9526 8.6894 8.7035 8.7985 8.8035 9.3565 9.4078 k = 0.3442 0.5049-0.0000 ( 8078 PWs) bands (ev): -10.8449 -10.8449 -10.8144 -10.8144 -10.6998 -10.6997 -10.6696 -10.6696 -3.9282 -3.9256 -3.9138 -3.9109 -3.5288 -3.5255 -3.5253 -3.5227 -2.5295 -2.5200 -2.5040 -2.4940 -1.9445 -1.9443 -1.9346 -1.9323 -1.6551 -1.6512 -1.6483 -1.6448 -0.7688 -0.7554 -0.7168 -0.7068 0.1861 0.1895 0.2458 0.2485 0.7988 0.8055 0.9768 1.0067 1.0523 1.0809 1.2738 1.3198 1.8148 1.8853 2.0486 2.0708 2.1204 2.1289 2.6627 2.6670 5.6603 5.6890 5.9104 5.9373 8.6959 8.7176 8.7840 8.8034 9.3157 9.3934 k = 0.3515 0.5157-0.0000 ( 8078 PWs) bands (ev): -10.8380 -10.8380 -10.8115 -10.8115 -10.6977 -10.6976 -10.6718 -10.6717 -3.9245 -3.9220 -3.9109 -3.9080 -3.5297 -3.5264 -3.5262 -3.5237 -2.5301 -2.5206 -2.5038 -2.4938 -1.9412 -1.9411 -1.9320 -1.9299 -1.6562 -1.6531 -1.6492 -1.6466 -0.7630 -0.7475 -0.7143 -0.7026 0.1605 0.1667 0.2333 0.2405 0.7966 0.8137 0.9616 0.9884 1.0318 1.0692 1.2620 1.3047 1.8338 1.8998 2.0819 2.0838 2.1200 2.1339 2.6562 2.6603 5.6431 5.6715 5.8943 5.9210 8.6971 8.7254 8.7646 8.7989 9.2821 9.3796 k = 0.3589 0.5264-0.0000 ( 8068 PWs) bands (ev): -10.8315 -10.8315 -10.8088 -10.8088 -10.6957 -10.6957 -10.6739 -10.6739 -3.9211 -3.9185 -3.9080 -3.9052 -3.5307 -3.5274 -3.5273 -3.5248 -2.5308 -2.5215 -2.5036 -2.4937 -1.9380 -1.9379 -1.9294 -1.9275 -1.6573 -1.6550 -1.6503 -1.6485 -0.7572 -0.7398 -0.7113 -0.6979 0.1360 0.1448 0.2210 0.2327 0.7965 0.8237 0.9483 0.9694 1.0132 1.0623 1.2497 1.2887 1.8556 1.9173 2.0772 2.1020 2.1279 2.1632 2.6478 2.6518 5.6252 5.6532 5.8773 5.9036 8.6882 8.7232 8.7440 8.7897 9.2600 9.3667 k = 0.3662 0.5371-0.0000 ( 8052 PWs) bands (ev): -10.8253 -10.8253 -10.8063 -10.8063 -10.6939 -10.6938 -10.6760 -10.6759 -3.9179 -3.9153 -3.9052 -3.9024 -3.5317 -3.5284 -3.5284 -3.5259 -2.5317 -2.5225 -2.5035 -2.4938 -1.9349 -1.9349 -1.9269 -1.9252 -1.6585 -1.6569 -1.6514 -1.6504 -0.7515 -0.7322 -0.7077 -0.6926 0.1126 0.1237 0.2093 0.2250 0.7981 0.8343 0.9374 0.9502 0.9970 1.0597 1.2370 1.2723 1.8800 1.9373 2.0675 2.0932 2.1624 2.1971 2.6376 2.6413 5.6068 5.6342 5.8595 5.8854 8.6630 8.7067 8.7280 8.7773 9.2524 9.3557 k = 0.3662 0.5371-0.0000 ( 8052 PWs) bands (ev): -10.8253 -10.8253 -10.8063 -10.8063 -10.6939 -10.6938 -10.6760 -10.6759 -3.9179 -3.9153 -3.9052 -3.9024 -3.5317 -3.5284 -3.5284 -3.5259 -2.5317 -2.5225 -2.5035 -2.4938 -1.9349 -1.9349 -1.9269 -1.9252 -1.6585 -1.6569 -1.6514 -1.6504 -0.7515 -0.7322 -0.7077 -0.6926 0.1126 0.1237 0.2093 0.2250 0.7981 0.8343 0.9374 0.9502 0.9970 1.0597 1.2370 1.2723 1.8800 1.9373 2.0675 2.0932 2.1624 2.1971 2.6376 2.6413 5.6068 5.6342 5.8595 5.8854 8.6630 8.7067 8.7280 8.7773 9.2524 9.3557 k = 0.3531 0.5371-0.0000 ( 8059 PWs) bands (ev): -10.8291 -10.8291 -10.8076 -10.8076 -10.6952 -10.6952 -10.6746 -10.6746 -3.9199 -3.9171 -3.9070 -3.9040 -3.5311 -3.5279 -3.5277 -3.5252 -2.5313 -2.5219 -2.5037 -2.4938 -1.9369 -1.9365 -1.9284 -1.9265 -1.6578 -1.6558 -1.6507 -1.6493 -0.7546 -0.7362 -0.7097 -0.6954 0.1258 0.1353 0.2174 0.2305 0.7936 0.8218 0.9364 0.9467 1.0223 1.0723 1.2476 1.2853 1.8658 1.9254 2.0730 2.0994 2.1430 2.1780 2.6435 2.6473 5.6177 5.6453 5.8694 5.8955 8.6786 8.7151 8.7390 8.7850 9.2544 9.3598 k = 0.3400 0.5371-0.0000 ( 8062 PWs) bands (ev): -10.8336 -10.8335 -10.8089 -10.8089 -10.6971 -10.6971 -10.6731 -10.6730 -3.9225 -3.9191 -3.9093 -3.9056 -3.5304 -3.5273 -3.5269 -3.5245 -2.5311 -2.5214 -2.5043 -2.4940 -1.9390 -1.9383 -1.9300 -1.9279 -1.6570 -1.6547 -1.6500 -1.6481 -0.7572 -0.7394 -0.7115 -0.6977 0.1394 0.1464 0.2286 0.2384 0.7831 0.7996 0.9239 0.9316 1.0638 1.1042 1.2650 1.3054 1.8521 1.9139 2.0756 2.1040 2.1285 2.1611 2.6484 2.6523 5.6291 5.6568 5.8781 5.9042 8.6868 8.7131 8.7559 8.7926 9.2609 9.3607 k = 0.3270 0.5371-0.0000 ( 8053 PWs) bands (ev): -10.8384 -10.8384 -10.8103 -10.8103 -10.6994 -10.6993 -10.6715 -10.6714 -3.9254 -3.9213 -3.9118 -3.9075 -3.5297 -3.5267 -3.5260 -3.5237 -2.5313 -2.5211 -2.5053 -2.4944 -1.9413 -1.9402 -1.9317 -1.9293 -1.6561 -1.6533 -1.6491 -1.6468 -0.7592 -0.7418 -0.7128 -0.6994 0.1528 0.1570 0.2427 0.2487 0.7668 0.7730 0.9022 0.9173 1.1104 1.1461 1.2892 1.3322 1.8393 1.9029 2.0713 2.1020 2.1252 2.1498 2.6523 2.6562 5.6408 5.6684 5.8852 5.9111 8.6875 8.7047 8.7741 8.7991 9.2723 9.3597 k = 0.3139 0.5371-0.0000 ( 8053 PWs) bands (ev): -10.8437 -10.8436 -10.8119 -10.8119 -10.7019 -10.7018 -10.6699 -10.6698 -3.9286 -3.9240 -3.9145 -3.9097 -3.5289 -3.5260 -3.5251 -3.5229 -2.5318 -2.5211 -2.5067 -2.4952 -1.9435 -1.9422 -1.9335 -1.9309 -1.6550 -1.6519 -1.6480 -1.6453 -0.7603 -0.7433 -0.7137 -0.7006 0.1659 0.1672 0.2587 0.2615 0.7404 0.7502 0.8779 0.9021 1.1591 1.1919 1.3202 1.3649 1.8276 1.8923 2.0594 2.0936 2.1295 2.1485 2.6552 2.6592 5.6528 5.6801 5.8903 5.9158 8.6811 8.6912 8.7906 8.8044 9.2883 9.3593 k = 0.3008 0.5371-0.0000 ( 8057 PWs) bands (ev): -10.8491 -10.8491 -10.8137 -10.8137 -10.7045 -10.7044 -10.6685 -10.6684 -3.9319 -3.9270 -3.9174 -3.9122 -3.5281 -3.5253 -3.5242 -3.5221 -2.5328 -2.5214 -2.5085 -2.4963 -1.9459 -1.9442 -1.9354 -1.9324 -1.6537 -1.6503 -1.6467 -1.6437 -0.7605 -0.7439 -0.7142 -0.7014 0.1772 0.1786 0.2747 0.2780 0.7096 0.7281 0.8533 0.8857 1.2085 1.2389 1.3578 1.4029 1.8174 1.8823 2.0449 2.0804 2.1370 2.1557 2.6572 2.6613 5.6647 5.6916 5.8930 5.9180 8.6671 8.6744 8.8020 8.8098 9.3079 9.3616 k = 0.2877 0.5371-0.0000 ( 8053 PWs) bands (ev): -10.8548 -10.8547 -10.8157 -10.8156 -10.7073 -10.7072 -10.6671 -10.6670 -3.9355 -3.9303 -3.9204 -3.9150 -3.5272 -3.5245 -3.5232 -3.5212 -2.5342 -2.5223 -2.5107 -2.4978 -1.9481 -1.9462 -1.9372 -1.9340 -1.6521 -1.6485 -1.6452 -1.6419 -0.7596 -0.7435 -0.7140 -0.7018 0.1872 0.1908 0.2905 0.2969 0.6783 0.7048 0.8290 0.8683 1.2577 1.2850 1.4018 1.4451 1.8094 1.8730 2.0310 2.0655 2.1470 2.1665 2.6582 2.6624 5.6763 5.7027 5.8930 5.9172 8.6449 8.6557 8.8047 8.8176 9.3294 9.3687 k = 0.2746 0.5371-0.0000 ( 8046 PWs) bands (ev): -10.8605 -10.8605 -10.8178 -10.8178 -10.7101 -10.7100 -10.6659 -10.6658 -3.9393 -3.9340 -3.9235 -3.9180 -3.5262 -3.5237 -3.5222 -3.5203 -2.5360 -2.5238 -2.5131 -2.4998 -1.9503 -1.9481 -1.9389 -1.9356 -1.6501 -1.6465 -1.6433 -1.6399 -0.7576 -0.7423 -0.7131 -0.7017 0.1971 0.2023 0.3069 0.3165 0.6473 0.6808 0.8055 0.8503 1.3061 1.3295 1.4512 1.4901 1.8041 1.8644 2.0192 2.0507 2.1587 2.1787 2.6585 2.6627 5.6875 5.7131 5.8900 5.9133 8.6172 8.6336 8.8027 8.8223 9.3501 9.3823 k = 0.2616 0.5371-0.0000 ( 8052 PWs) bands (ev): -10.8664 -10.8663 -10.8202 -10.8201 -10.7129 -10.7128 -10.6648 -10.6647 -3.9431 -3.9378 -3.9267 -3.9213 -3.5252 -3.5228 -3.5212 -3.5194 -2.5384 -2.5260 -2.5156 -2.5022 -1.9523 -1.9500 -1.9406 -1.9371 -1.6479 -1.6444 -1.6411 -1.6377 -0.7547 -0.7404 -0.7115 -0.7013 0.2069 0.2131 0.3233 0.3362 0.6171 0.6567 0.7831 0.8322 1.3536 1.3723 1.5046 1.5361 1.8025 1.8568 2.0103 2.0372 2.1716 2.1918 2.6579 2.6622 5.6978 5.7226 5.8839 5.9062 8.5855 8.6071 8.7973 8.8218 9.3683 9.4024 k = 0.2485 0.5371-0.0000 ( 8050 PWs) bands (ev): -10.8722 -10.8722 -10.8226 -10.8226 -10.7158 -10.7157 -10.6639 -10.6638 -3.9471 -3.9419 -3.9301 -3.9247 -3.5242 -3.5219 -3.5202 -3.5185 -2.5412 -2.5290 -2.5183 -2.5049 -1.9542 -1.9516 -1.9422 -1.9385 -1.6454 -1.6420 -1.6386 -1.6353 -0.7507 -0.7379 -0.7090 -0.7006 0.2164 0.2230 0.3390 0.3557 0.5882 0.6332 0.7623 0.8142 1.3996 1.4141 1.5602 1.5806 1.8057 1.8505 2.0051 2.0262 2.1855 2.2053 2.6567 2.6611 5.7070 5.7307 5.8749 5.8959 8.5508 8.5766 8.7881 8.8154 9.3848 9.4255 k = 0.2354 0.5371-0.0000 ( 8046 PWs) bands (ev): -10.8781 -10.8781 -10.8252 -10.8252 -10.7186 -10.7185 -10.6630 -10.6629 -3.9511 -3.9461 -3.9336 -3.9284 -3.5232 -3.5210 -3.5191 -3.5175 -2.5445 -2.5327 -2.5210 -2.5081 -1.9559 -1.9531 -1.9436 -1.9398 -1.6425 -1.6394 -1.6359 -1.6328 -0.7458 -0.7351 -0.7056 -0.6996 0.2253 0.2317 0.3534 0.3747 0.5610 0.6105 0.7434 0.7967 1.4428 1.4564 1.6149 1.6221 1.8141 1.8465 2.0037 2.0196 2.2001 2.2190 2.6548 2.6595 5.7147 5.7370 5.8633 5.8827 8.5136 8.5424 8.7746 8.8027 9.4000 9.4482 k = 0.2223 0.5371-0.0000 ( 8047 PWs) bands (ev): -10.8839 -10.8839 -10.8279 -10.8278 -10.7214 -10.7213 -10.6623 -10.6622 -3.9552 -3.9503 -3.9371 -3.9322 -3.5221 -3.5201 -3.5181 -3.5166 -2.5482 -2.5371 -2.5239 -2.5116 -1.9573 -1.9544 -1.9449 -1.9410 -1.6394 -1.6367 -1.6330 -1.6301 -0.7402 -0.7320 -0.7014 -0.6983 0.2330 0.2390 0.3657 0.3930 0.5363 0.5890 0.7268 0.7800 1.4816 1.5002 1.6519 1.6732 1.8241 1.8487 2.0058 2.0204 2.2153 2.2327 2.6523 2.6577 5.7202 5.7407 5.8495 5.8672 8.4744 8.5049 8.7560 8.7839 9.4120 9.4675 k = 0.2093 0.5371-0.0000 ( 8047 PWs) bands (ev): -10.8896 -10.8896 -10.8306 -10.8305 -10.7242 -10.7241 -10.6616 -10.6615 -3.9592 -3.9546 -3.9408 -3.9360 -3.5211 -3.5192 -3.5171 -3.5156 -2.5523 -2.5420 -2.5269 -2.5154 -1.9585 -1.9555 -1.9460 -1.9419 -1.6361 -1.6338 -1.6299 -1.6273 -0.7338 -0.7287 -0.6969 -0.6965 0.2389 0.2452 0.3750 0.4100 0.5150 0.5691 0.7129 0.7643 1.5166 1.5444 1.6776 1.7255 1.8280 1.8621 2.0125 2.0313 2.2310 2.2468 2.6492 2.6559 5.7228 5.7408 5.8348 5.8503 8.4335 8.4648 8.7318 8.7591 9.4192 9.4787 k = 0.1962 0.5371-0.0000 ( 8051 PWs) bands (ev): -10.8952 -10.8951 -10.8333 -10.8333 -10.7268 -10.7267 -10.6611 -10.6610 -3.9633 -3.9589 -3.9444 -3.9399 -3.5200 -3.5183 -3.5161 -3.5147 -2.5566 -2.5472 -2.5301 -2.5195 -1.9595 -1.9563 -1.9469 -1.9427 -1.6327 -1.6307 -1.6266 -1.6244 -0.7272 -0.7250 -0.6952 -0.6908 0.2423 0.2503 0.3800 0.4249 0.4984 0.5512 0.7018 0.7499 1.5482 1.5875 1.6981 1.7727 1.8290 1.8796 2.0270 2.0525 2.2464 2.2619 2.6456 2.6543 5.7209 5.7361 5.8202 5.8340 8.3913 8.4227 8.7015 8.7288 9.4214 9.4816 k = 0.1831 0.5371-0.0000 ( 8050 PWs) bands (ev): -10.9006 -10.9005 -10.8361 -10.8361 -10.7294 -10.7293 -10.6606 -10.6605 -3.9672 -3.9631 -3.9480 -3.9438 -3.5190 -3.5175 -3.5151 -3.5138 -2.5613 -2.5527 -2.5335 -2.5238 -1.9602 -1.9569 -1.9476 -1.9433 -1.6291 -1.6276 -1.6232 -1.6215 -0.7225 -0.7191 -0.6934 -0.6847 0.2429 0.2543 0.3795 0.4371 0.4872 0.5368 0.6937 0.7371 1.5764 1.6279 1.7168 1.8106 1.8312 1.8978 2.0493 2.0833 2.2602 2.2797 2.6414 2.6533 5.7126 5.7256 5.8071 5.8206 8.3480 8.3791 8.6651 8.6936 9.4203 9.4824 k = 0.1700 0.5371-0.0000 ( 8054 PWs) bands (ev): -10.9058 -10.9057 -10.8388 -10.8388 -10.7318 -10.7317 -10.6602 -10.6601 -3.9710 -3.9673 -3.9515 -3.9477 -3.5181 -3.5167 -3.5141 -3.5129 -2.5660 -2.5583 -2.5370 -2.5282 -1.9607 -1.9573 -1.9481 -1.9437 -1.6255 -1.6245 -1.6198 -1.6185 -0.7190 -0.7117 -0.6915 -0.6783 0.2411 0.2567 0.3736 0.4457 0.4795 0.5285 0.6880 0.7261 1.6012 1.6636 1.7365 1.8332 1.8370 1.9218 2.0766 2.1214 2.2718 2.3014 2.6369 2.6530 5.6968 5.7092 5.7964 5.8113 8.3039 8.3347 8.6233 8.6540 9.4180 9.4829 k = 0.1569 0.5371-0.0000 ( 8039 PWs) bands (ev): -10.9107 -10.9107 -10.8414 -10.8414 -10.7341 -10.7340 -10.6599 -10.6598 -3.9747 -3.9713 -3.9550 -3.9514 -3.5172 -3.5159 -3.5132 -3.5121 -2.5709 -2.5639 -2.5406 -2.5326 -1.9610 -1.9575 -1.9484 -1.9439 -1.6219 -1.6213 -1.6164 -1.6155 -0.7155 -0.7042 -0.6893 -0.6718 0.2374 0.2572 0.3640 0.4492 0.4735 0.5281 0.6845 0.7175 1.6227 1.6928 1.7585 1.8419 1.8473 1.9533 2.1061 2.1625 2.2817 2.3274 2.6320 2.6537 5.6749 5.6874 5.7887 5.8049 8.2594 8.2902 8.5771 8.6107 9.4160 9.4836 k = 0.1439 0.5371-0.0000 ( 8037 PWs) bands (ev): -10.9154 -10.9154 -10.8440 -10.8440 -10.7363 -10.7362 -10.6596 -10.6595 -3.9782 -3.9751 -3.9583 -3.9551 -3.5163 -3.5152 -3.5123 -3.5113 -2.5757 -2.5695 -2.5442 -2.5370 -1.9612 -1.9576 -1.9485 -1.9440 -1.6186 -1.6181 -1.6132 -1.6124 -0.7122 -0.6973 -0.6866 -0.6654 0.2322 0.2555 0.3533 0.4434 0.4732 0.5331 0.6824 0.7114 1.6411 1.7159 1.7798 1.8461 1.8619 1.9884 2.1352 2.2029 2.2907 2.3579 2.6268 2.6556 5.6492 5.6617 5.7831 5.7998 8.2149 8.2460 8.5282 8.5645 9.4150 9.4842 k = 0.1308 0.5371-0.0000 ( 8043 PWs) bands (ev): -10.9198 -10.9198 -10.8464 -10.8464 -10.7383 -10.7383 -10.6594 -10.6593 -3.9816 -3.9787 -3.9614 -3.9585 -3.5155 -3.5145 -3.5115 -3.5106 -2.5804 -2.5750 -2.5477 -2.5414 -1.9611 -1.9576 -1.9484 -1.9440 -1.6156 -1.6148 -1.6101 -1.6093 -0.7089 -0.6919 -0.6826 -0.6592 0.2260 0.2516 0.3431 0.4310 0.4779 0.5398 0.6814 0.7081 1.6569 1.7350 1.7961 1.8477 1.8853 2.0240 2.1618 2.2388 2.3007 2.3925 2.6213 2.6588 5.6217 5.6338 5.7785 5.7950 8.1709 8.2025 8.4780 8.5165 9.4155 9.4847 k = 0.1177 0.5371-0.0000 ( 8046 PWs) bands (ev): -10.9239 -10.9238 -10.8487 -10.8487 -10.7402 -10.7401 -10.6592 -10.6591 -3.9847 -3.9821 -3.9644 -3.9618 -3.5148 -3.5139 -3.5107 -3.5099 -2.5849 -2.5801 -2.5511 -2.5455 -1.9610 -1.9575 -1.9481 -1.9439 -1.6127 -1.6116 -1.6072 -1.6063 -0.7057 -0.6886 -0.6768 -0.6534 0.2193 0.2457 0.3344 0.4167 0.4840 0.5461 0.6813 0.7072 1.6703 1.7516 1.8061 1.8504 1.9149 2.0587 2.1844 2.2640 2.3171 2.4302 2.6156 2.6634 5.5937 5.6050 5.7742 5.7901 8.1283 8.1604 8.4282 8.4680 9.4173 9.4849 k = 0.1046 0.5371-0.0000 ( 8050 PWs) bands (ev): -10.9276 -10.9275 -10.8509 -10.8508 -10.7419 -10.7418 -10.6590 -10.6590 -3.9875 -3.9853 -3.9671 -3.9648 -3.5142 -3.5134 -3.5100 -3.5092 -2.5891 -2.5850 -2.5544 -2.5495 -1.9607 -1.9575 -1.9477 -1.9437 -1.6101 -1.6088 -1.6044 -1.6033 -0.7025 -0.6866 -0.6702 -0.6482 0.2126 0.2383 0.3275 0.4023 0.4903 0.5507 0.6825 0.7079 1.6821 1.7655 1.8122 1.8555 1.9473 2.0917 2.2029 2.2750 2.3433 2.4691 2.6096 2.6691 5.5662 5.5767 5.7700 5.7850 8.0876 8.1198 8.3802 8.4201 9.4203 9.4848 k = 0.0915 0.5371-0.0000 ( 8042 PWs) bands (ev): -10.9309 -10.9309 -10.8528 -10.8528 -10.7434 -10.7433 -10.6589 -10.6588 -3.9900 -3.9881 -3.9695 -3.9676 -3.5136 -3.5129 -3.5093 -3.5087 -2.5930 -2.5895 -2.5573 -2.5531 -1.9603 -1.9574 -1.9472 -1.9436 -1.6076 -1.6063 -1.6018 -1.6006 -0.6996 -0.6851 -0.6636 -0.6435 0.2062 0.2300 0.3224 0.3884 0.4965 0.5531 0.6850 0.7097 1.6924 1.7747 1.8188 1.8627 1.9801 2.1222 2.2173 2.2775 2.3735 2.5076 2.6033 2.6755 5.5402 5.5496 5.7659 5.7796 8.0499 8.0814 8.3353 8.3742 9.4244 9.4843 k = 0.0785 0.5371-0.0000 ( 8040 PWs) bands (ev): -10.9338 -10.9338 -10.8545 -10.8545 -10.7447 -10.7447 -10.6588 -10.6588 -3.9923 -3.9906 -3.9717 -3.9700 -3.5131 -3.5125 -3.5087 -3.5082 -2.5965 -2.5936 -2.5600 -2.5564 -1.9599 -1.9573 -1.9467 -1.9434 -1.6054 -1.6041 -1.5994 -1.5982 -0.6968 -0.6841 -0.6573 -0.6396 0.2004 0.2215 0.3188 0.3755 0.5024 0.5536 0.6888 0.7117 1.7018 1.7778 1.8286 1.8706 2.0119 2.1494 2.2277 2.2764 2.4034 2.5442 2.5966 2.6822 5.5163 5.5246 5.7619 5.7741 8.0157 8.0457 8.2949 8.3313 9.4292 9.4831 k = 0.0654 0.5371-0.0000 ( 8033 PWs) bands (ev): -10.9363 -10.9363 -10.8560 -10.8560 -10.7459 -10.7458 -10.6587 -10.6587 -3.9942 -3.9928 -3.9735 -3.9721 -3.5127 -3.5122 -3.5082 -3.5077 -2.5995 -2.5971 -2.5623 -2.5593 -1.9595 -1.9572 -1.9461 -1.9433 -1.6035 -1.6022 -1.5972 -1.5961 -0.6941 -0.6835 -0.6516 -0.6365 0.1954 0.2134 0.3165 0.3636 0.5081 0.5524 0.6934 0.7137 1.7105 1.7764 1.8410 1.8783 2.0421 2.1722 2.2343 2.2741 2.4315 2.5777 2.5895 2.6883 5.4952 5.5023 5.7582 5.7688 7.9860 8.0133 8.2598 8.2926 9.4345 9.4813 k = 0.0523 0.5371-0.0000 ( 8030 PWs) bands (ev): -10.9384 -10.9384 -10.8572 -10.8572 -10.7468 -10.7468 -10.6587 -10.6586 -3.9958 -3.9947 -3.9751 -3.9739 -3.5123 -3.5120 -3.5078 -3.5074 -2.6021 -2.6002 -2.5641 -2.5618 -1.9591 -1.9572 -1.9455 -1.9432 -1.6018 -1.6008 -1.5953 -1.5944 -0.6918 -0.6831 -0.6465 -0.6342 0.1915 0.2060 0.3154 0.3529 0.5136 0.5500 0.6982 0.7152 1.7187 1.7724 1.8539 1.8849 2.0704 2.1885 2.2381 2.2723 2.4572 2.5809 2.6081 2.6931 5.4774 5.4831 5.7550 5.7638 7.9613 7.9848 8.2310 8.2588 9.4401 9.4788 k = 0.0392 0.5371-0.0000 ( 8024 PWs) bands (ev): -10.9400 -10.9400 -10.8582 -10.8582 -10.7475 -10.7475 -10.6586 -10.6586 -3.9970 -3.9962 -3.9762 -3.9754 -3.5121 -3.5118 -3.5074 -3.5071 -2.6040 -2.6026 -2.5656 -2.5639 -1.9587 -1.9572 -1.9449 -1.9431 -1.6005 -1.5997 -1.5938 -1.5931 -0.6896 -0.6831 -0.6421 -0.6327 0.1886 0.1996 0.3156 0.3435 0.5188 0.5466 0.7029 0.7160 1.7264 1.7672 1.8659 1.8897 2.0966 2.1949 2.2425 2.2712 2.4804 2.5718 2.6339 2.6958 5.4633 5.4676 5.7526 5.7594 7.9423 7.9609 8.2090 8.2308 9.4459 9.4756 k = 0.0262 0.5371-0.0000 ( 8029 PWs) bands (ev): -10.9412 -10.9412 -10.8589 -10.8589 -10.7480 -10.7480 -10.6586 -10.6586 -3.9978 -3.9973 -3.9770 -3.9765 -3.5119 -3.5117 -3.5071 -3.5070 -2.6053 -2.6044 -2.5666 -2.5654 -1.9583 -1.9573 -1.9444 -1.9432 -1.5995 -1.5989 -1.5926 -1.5921 -0.6878 -0.6834 -0.6385 -0.6321 0.1871 0.1944 0.3170 0.3355 0.5239 0.5426 0.7072 0.7161 1.7339 1.7613 1.8762 1.8923 2.1208 2.1904 2.2496 2.2700 2.5011 2.5614 2.6552 2.6955 5.4531 5.4561 5.7511 5.7557 7.9294 7.9423 8.1942 8.2092 9.4517 9.4718 k = 0.0131 0.5371-0.0000 ( 8031 PWs) bands (ev): -10.9419 -10.9419 -10.8593 -10.8593 -10.7484 -10.7483 -10.6586 -10.6586 -3.9982 -3.9980 -3.9774 -3.9772 -3.5117 -3.5116 -3.5070 -3.5069 -2.6061 -2.6056 -2.5670 -2.5665 -1.9580 -1.9575 -1.9440 -1.9434 -1.5988 -1.5985 -1.5918 -1.5916 -0.6862 -0.6840 -0.6356 -0.6324 0.1869 0.1905 0.3196 0.3289 0.5289 0.5383 0.7108 0.7153 1.7412 1.7549 1.8842 1.8924 2.1427 2.1785 2.2572 2.2676 2.5194 2.5493 2.6719 2.6918 5.4473 5.4488 5.7506 5.7529 7.9230 7.9296 8.1868 8.1944 9.4572 9.4674 k = 0.0000 0.5371-0.0000 ( 8030 PWs) bands (ev): -10.9421 -10.9421 -10.8595 -10.8595 -10.7485 -10.7485 -10.6586 -10.6586 -3.9983 -3.9983 -3.9775 -3.9775 -3.5116 -3.5116 -3.5069 -3.5069 -2.6061 -2.6061 -2.5670 -2.5670 -1.9577 -1.9577 -1.9436 -1.9436 -1.5985 -1.5985 -1.5915 -1.5915 -0.6849 -0.6849 -0.6336 -0.6336 0.1880 0.1880 0.3236 0.3236 0.5337 0.5337 0.7135 0.7135 1.7482 1.7482 1.8897 1.8897 2.1621 2.1621 2.2634 2.2634 2.5354 2.5354 2.6840 2.6840 5.4458 5.4458 5.7512 5.7512 7.9230 7.9230 8.1869 8.1869 9.4625 9.4625 k = 0.0000 0.5371-0.0000 ( 8030 PWs) bands (ev): -10.9421 -10.9421 -10.8595 -10.8595 -10.7485 -10.7485 -10.6586 -10.6586 -3.9983 -3.9983 -3.9775 -3.9775 -3.5116 -3.5116 -3.5069 -3.5069 -2.6061 -2.6061 -2.5670 -2.5670 -1.9577 -1.9577 -1.9436 -1.9436 -1.5985 -1.5985 -1.5915 -1.5915 -0.6849 -0.6849 -0.6336 -0.6336 0.1880 0.1880 0.3236 0.3236 0.5337 0.5337 0.7135 0.7135 1.7482 1.7482 1.8897 1.8897 2.1621 2.1621 2.2634 2.2634 2.5354 2.5354 2.6840 2.6840 5.4458 5.4458 5.7512 5.7512 7.9230 7.9230 8.1869 8.1869 9.4625 9.4625 k = 0.0000 0.5371 0.0128 ( 8032 PWs) bands (ev): -10.9419 -10.9419 -10.8600 -10.8600 -10.7479 -10.7479 -10.6588 -10.6588 -3.9988 -3.9977 -3.9781 -3.9770 -3.5116 -3.5116 -3.5069 -3.5069 -2.6071 -2.6049 -2.5683 -2.5660 -1.9590 -1.9563 -1.9453 -1.9420 -1.5994 -1.5975 -1.5926 -1.5905 -0.6857 -0.6834 -0.6351 -0.6319 0.1843 0.1868 0.3183 0.3245 0.5330 0.5400 0.7107 0.7201 1.7466 1.7537 1.8890 1.8905 2.1565 2.1647 2.2564 2.2689 2.5276 2.5426 2.6798 2.6865 5.4468 5.4484 5.7504 5.7514 7.9204 7.9265 8.1844 8.1871 9.4558 9.4689 k = 0.0000 0.5371 0.0256 ( 8032 PWs) bands (ev): -10.9413 -10.9413 -10.8616 -10.8616 -10.7462 -10.7462 -10.6595 -10.6595 -3.9991 -3.9969 -3.9789 -3.9767 -3.5116 -3.5115 -3.5070 -3.5069 -2.6077 -2.6034 -2.5698 -2.5654 -1.9602 -1.9548 -1.9470 -1.9406 -1.6002 -1.5965 -1.5937 -1.5895 -0.6858 -0.6812 -0.6364 -0.6300 0.1765 0.1811 0.3089 0.3206 0.5381 0.5516 0.7118 0.7298 1.7491 1.7632 1.8884 1.8915 2.1481 2.1642 2.2477 2.2726 2.5194 2.5491 2.6740 2.6873 5.4513 5.4544 5.7489 5.7508 7.9188 7.9308 8.1795 8.1850 9.4490 9.4746 k = 0.0000 0.5371 0.0384 ( 8034 PWs) bands (ev): -10.9403 -10.9403 -10.8641 -10.8641 -10.7436 -10.7436 -10.6607 -10.6606 -3.9993 -3.9960 -3.9798 -3.9765 -3.5116 -3.5114 -3.5071 -3.5070 -2.6081 -2.6017 -2.5716 -2.5650 -1.9612 -1.9531 -1.9487 -1.9392 -1.6010 -1.5954 -1.5948 -1.5886 -0.6852 -0.6783 -0.6375 -0.6281 0.1656 0.1720 0.2957 0.3117 0.5487 0.5680 0.7161 0.7417 1.7557 1.7766 1.8881 1.8929 2.1371 2.1604 2.2375 2.2742 2.5115 2.5549 2.6667 2.6866 5.4591 5.4637 5.7466 5.7495 7.9182 7.9360 8.1721 8.1806 9.4427 9.4797 k = 0.0000 0.5371 0.0512 ( 8028 PWs) bands (ev): -10.9388 -10.9388 -10.8674 -10.8674 -10.7401 -10.7401 -10.6623 -10.6623 -3.9993 -3.9950 -3.9809 -3.9765 -3.5115 -3.5112 -3.5073 -3.5071 -2.6081 -2.5997 -2.5735 -2.5649 -1.9620 -1.9514 -1.9504 -1.9380 -1.6016 -1.5959 -1.5944 -1.5877 -0.6840 -0.6748 -0.6385 -0.6262 0.1534 0.1609 0.2793 0.2983 0.5640 0.5882 0.7226 0.7544 1.7660 1.7934 1.8880 1.8950 2.1239 2.1532 2.2255 2.2731 2.5045 2.5602 2.6579 2.6843 5.4701 5.4761 5.7433 5.7472 7.9190 7.9420 8.1625 8.1741 9.4374 9.4840 k = 0.0000 0.5371 0.0640 ( 8024 PWs) bands (ev): -10.9370 -10.9370 -10.8713 -10.8713 -10.7360 -10.7359 -10.6643 -10.6643 -3.9991 -3.9939 -3.9820 -3.9767 -3.5114 -3.5110 -3.5074 -3.5072 -2.6078 -2.5975 -2.5757 -2.5652 -1.9627 -1.9520 -1.9497 -1.9370 -1.6022 -1.5970 -1.5933 -1.5870 -0.6821 -0.6707 -0.6394 -0.6244 0.1409 0.1494 0.2605 0.2811 0.5828 0.6111 0.7300 0.7670 1.7799 1.8134 1.8886 1.8981 2.1087 2.1430 2.2117 2.2688 2.4993 2.5652 2.6480 2.6807 5.4839 5.4911 5.7388 5.7437 7.9212 7.9491 8.1505 8.1656 9.4334 9.4880 k = 0.0000 0.5371 0.0768 ( 8028 PWs) bands (ev): -10.9348 -10.9348 -10.8757 -10.8757 -10.7313 -10.7313 -10.6668 -10.6668 -3.9988 -3.9927 -3.9832 -3.9771 -3.5113 -3.5109 -3.5077 -3.5074 -2.6072 -2.5952 -2.5780 -2.5658 -1.9632 -1.9537 -1.9479 -1.9362 -1.6027 -1.5980 -1.5922 -1.5865 -0.6797 -0.6662 -0.6403 -0.6229 0.1294 0.1386 0.2404 0.2615 0.6037 0.6356 0.7374 0.7783 1.7969 1.8361 1.8900 1.9026 2.0920 2.1301 2.1957 2.2604 2.4965 2.5702 2.6371 2.6758 5.5002 5.5085 5.7330 5.7389 7.9252 7.9573 8.1365 8.1551 9.4314 9.4917 k = 0.0000 0.5371 0.0896 ( 8038 PWs) bands (ev): -10.9322 -10.9322 -10.8804 -10.8804 -10.7263 -10.7263 -10.6697 -10.6697 -3.9983 -3.9914 -3.9845 -3.9776 -3.5111 -3.5106 -3.5079 -3.5075 -2.6063 -2.5928 -2.5805 -2.5667 -1.9635 -1.9552 -1.9462 -1.9357 -1.6031 -1.5990 -1.5912 -1.5860 -0.6768 -0.6612 -0.6414 -0.6219 0.1197 0.1294 0.2196 0.2406 0.6257 0.6606 0.7438 0.7877 1.8166 1.8604 1.8925 1.9091 2.0745 2.1152 2.1775 2.2475 2.4966 2.5756 2.6254 2.6699 5.5184 5.5277 5.7255 5.7324 7.9310 7.9667 8.1206 8.1430 9.4317 9.4956 k = 0.0000 0.5371 0.1024 ( 8038 PWs) bands (ev): -10.9293 -10.9293 -10.8853 -10.8853 -10.7210 -10.7210 -10.6730 -10.6730 -3.9977 -3.9901 -3.9858 -3.9782 -3.5109 -3.5104 -3.5081 -3.5078 -2.6051 -2.5902 -2.5830 -2.5679 -1.9637 -1.9567 -1.9444 -1.9353 -1.6033 -1.5999 -1.5902 -1.5857 -0.6735 -0.6561 -0.6428 -0.6215 0.1122 0.1225 0.1991 0.2194 0.6475 0.6852 0.7485 0.7946 1.8380 1.8849 1.8966 1.9186 2.0570 2.0993 2.1571 2.2300 2.4998 2.5815 2.6130 2.6631 5.5381 5.5482 5.7163 5.7241 7.9388 7.9774 8.1032 8.1293 9.4347 9.5001 k = 0.0000 0.5371 0.1153 ( 8042 PWs) bands (ev): -10.9260 -10.9260 -10.8903 -10.8903 -10.7157 -10.7156 -10.6767 -10.6767 -3.9969 -3.9887 -3.9872 -3.9790 -3.5107 -3.5102 -3.5084 -3.5080 -2.6037 -2.5876 -2.5856 -2.5693 -1.9637 -1.9580 -1.9428 -1.9353 -1.6035 -1.6007 -1.5892 -1.5855 -0.6699 -0.6507 -0.6444 -0.6219 0.1075 0.1184 0.1794 0.1988 0.6686 0.7088 0.7510 0.7985 1.8599 1.9025 1.9062 1.9330 2.0408 2.0840 2.1345 2.2084 2.5059 2.5881 2.6003 2.6555 5.5589 5.5695 5.7052 5.7139 7.9487 7.9894 8.0846 8.1144 9.4405 9.5055 k = 0.0000 0.5371 0.1281 ( 8034 PWs) bands (ev): -10.9223 -10.9223 -10.8953 -10.8953 -10.7103 -10.7102 -10.6807 -10.6807 -3.9960 -3.9886 -3.9873 -3.9799 -3.5104 -3.5099 -3.5087 -3.5082 -2.6020 -2.5882 -2.5850 -2.5710 -1.9636 -1.9592 -1.9412 -1.9354 -1.6035 -1.6014 -1.5884 -1.5855 -0.6662 -0.6465 -0.6454 -0.6230 0.1059 0.1175 0.1613 0.1795 0.6881 0.7305 0.7508 0.7991 1.8803 1.9102 1.9226 1.9515 2.0276 2.0721 2.1104 2.1833 2.5142 2.5872 2.5954 2.6472 5.5801 5.5912 5.6921 5.7016 7.9607 8.0027 8.0653 8.0986 9.4493 9.5122 k = 0.0000 0.5371 0.1409 ( 8032 PWs) bands (ev): -10.9184 -10.9184 -10.9003 -10.9003 -10.7049 -10.7049 -10.6850 -10.6850 -3.9949 -3.9900 -3.9860 -3.9810 -3.5102 -3.5096 -3.5090 -3.5085 -2.6001 -2.5908 -2.5824 -2.5730 -1.9632 -1.9603 -1.9398 -1.9359 -1.6034 -1.6020 -1.5876 -1.5857 -0.6624 -0.6490 -0.6403 -0.6250 0.1075 0.1200 0.1451 0.1621 0.7055 0.7478 0.7498 0.7962 1.8971 1.9182 1.9367 1.9660 2.0209 2.0686 2.0854 2.1560 2.5243 2.5741 2.6033 2.6386 5.6013 5.6125 5.6770 5.6872 7.9748 8.0172 8.0458 8.0821 9.4609 9.5203 k = 0.0000 0.5371 0.1537 ( 8024 PWs) bands (ev): -10.9142 -10.9142 -10.9051 -10.9051 -10.6997 -10.6996 -10.6897 -10.6896 -3.9938 -3.9913 -3.9846 -3.9821 -3.5099 -3.5093 -3.5093 -3.5088 -2.5979 -2.5933 -2.5799 -2.5751 -1.9627 -1.9613 -1.9385 -1.9365 -1.6032 -1.6025 -1.5869 -1.5859 -0.6586 -0.6518 -0.6356 -0.6278 0.1123 0.1258 0.1314 0.1471 0.7204 0.7417 0.7664 0.7898 1.9098 1.9220 1.9500 1.9690 2.0246 2.0609 2.0789 2.1277 2.5358 2.5609 2.6118 2.6296 5.6220 5.6332 5.6602 5.6709 7.9906 8.0265 8.0326 8.0654 9.4753 9.5115 k = 0.0000 0.5371 0.1665 ( 8016 PWs) bands (ev): -10.9098 -10.9098 -10.9098 -10.9098 -10.6946 -10.6946 -10.6945 -10.6945 -3.9926 -3.9926 -3.9833 -3.9833 -3.5096 -3.5096 -3.5090 -3.5090 -2.5957 -2.5957 -2.5774 -2.5774 -1.9621 -1.9621 -1.9374 -1.9374 -1.6029 -1.6029 -1.5864 -1.5864 -0.6551 -0.6551 -0.6314 -0.6314 0.1204 0.1204 0.1349 0.1349 0.7325 0.7325 0.7798 0.7798 1.9186 1.9186 1.9619 1.9619 2.0393 2.0393 2.1007 2.1007 2.5481 2.5481 2.6207 2.6207 5.6418 5.6418 5.6528 5.6528 8.0080 8.0080 8.0488 8.0488 9.4923 9.4923 k = 0.0000 0.5371 0.1665 ( 8016 PWs) bands (ev): -10.9098 -10.9098 -10.9098 -10.9098 -10.6946 -10.6946 -10.6945 -10.6945 -3.9926 -3.9926 -3.9833 -3.9833 -3.5096 -3.5096 -3.5090 -3.5090 -2.5957 -2.5957 -2.5774 -2.5774 -1.9621 -1.9621 -1.9374 -1.9374 -1.6029 -1.6029 -1.5864 -1.5864 -0.6551 -0.6551 -0.6314 -0.6314 0.1204 0.1204 0.1349 0.1349 0.7325 0.7325 0.7798 0.7798 1.9186 1.9186 1.9619 1.9619 2.0393 2.0393 2.1007 2.1007 2.5481 2.5481 2.6207 2.6207 5.6418 5.6418 5.6528 5.6528 8.0080 8.0080 8.0488 8.0488 9.4923 9.4923 k = 0.0131 0.5371 0.1665 ( 8024 PWs) bands (ev): -10.9096 -10.9096 -10.9095 -10.9095 -10.6946 -10.6946 -10.6944 -10.6944 -3.9924 -3.9924 -3.9831 -3.9831 -3.5096 -3.5096 -3.5091 -3.5091 -2.5954 -2.5954 -2.5771 -2.5771 -1.9621 -1.9621 -1.9375 -1.9375 -1.6031 -1.6031 -1.5866 -1.5866 -0.6554 -0.6554 -0.6318 -0.6318 0.1212 0.1212 0.1359 0.1359 0.7317 0.7317 0.7793 0.7793 1.9177 1.9177 1.9590 1.9590 2.0403 2.0403 2.1011 2.1011 2.5456 2.5456 2.6190 2.6190 5.6430 5.6430 5.6541 5.6541 8.0110 8.0110 8.0527 8.0527 9.4926 9.4926 k = 0.0262 0.5371 0.1665 ( 8034 PWs) bands (ev): -10.9091 -10.9091 -10.9088 -10.9088 -10.6945 -10.6945 -10.6943 -10.6943 -3.9918 -3.9918 -3.9826 -3.9826 -3.5098 -3.5098 -3.5091 -3.5091 -2.5945 -2.5945 -2.5763 -2.5763 -1.9621 -1.9621 -1.9377 -1.9377 -1.6037 -1.6037 -1.5872 -1.5872 -0.6564 -0.6564 -0.6330 -0.6330 0.1236 0.1236 0.1389 0.1389 0.7291 0.7291 0.7778 0.7778 1.9148 1.9148 1.9510 1.9510 2.0425 2.0425 2.1021 2.1021 2.5383 2.5383 2.6140 2.6140 5.6466 5.6466 5.6580 5.6580 8.0202 8.0202 8.0644 8.0644 9.4933 9.4933 k = 0.0392 0.5371 0.1665 ( 8032 PWs) bands (ev): -10.9081 -10.9081 -10.9078 -10.9078 -10.6944 -10.6944 -10.6940 -10.6940 -3.9909 -3.9909 -3.9816 -3.9816 -3.5101 -3.5101 -3.5093 -3.5093 -2.5931 -2.5931 -2.5749 -2.5749 -1.9622 -1.9622 -1.9379 -1.9379 -1.6046 -1.6046 -1.5882 -1.5882 -0.6579 -0.6579 -0.6351 -0.6351 0.1277 0.1277 0.1438 0.1438 0.7249 0.7249 0.7754 0.7754 1.9101 1.9101 1.9390 1.9390 2.0451 2.0451 2.1033 2.1033 2.5267 2.5267 2.6060 2.6060 5.6525 5.6525 5.6643 5.6643 8.0354 8.0354 8.0835 8.0835 9.4946 9.4946 k = 0.0523 0.5371 0.1665 ( 8032 PWs) bands (ev): -10.9068 -10.9068 -10.9063 -10.9063 -10.6942 -10.6942 -10.6937 -10.6937 -3.9896 -3.9896 -3.9803 -3.9803 -3.5104 -3.5104 -3.5095 -3.5095 -2.5911 -2.5911 -2.5729 -2.5729 -1.9623 -1.9623 -1.9383 -1.9383 -1.6058 -1.6058 -1.5897 -1.5897 -0.6601 -0.6601 -0.6379 -0.6379 0.1333 0.1333 0.1506 0.1506 0.7193 0.7193 0.7720 0.7720 1.9035 1.9035 1.9241 1.9241 2.0468 2.0468 2.1043 2.1043 2.5114 2.5114 2.5953 2.5953 5.6605 5.6605 5.6728 5.6728 8.0564 8.0564 8.1096 8.1096 9.4962 9.4962 k = 0.0654 0.5371 0.1665 ( 8032 PWs) bands (ev): -10.9050 -10.9050 -10.9045 -10.9045 -10.6940 -10.6940 -10.6934 -10.6934 -3.9879 -3.9879 -3.9786 -3.9786 -3.5108 -3.5108 -3.5097 -3.5097 -2.5886 -2.5886 -2.5704 -2.5704 -1.9624 -1.9624 -1.9388 -1.9388 -1.6074 -1.6074 -1.5915 -1.5915 -0.6628 -0.6628 -0.6415 -0.6415 0.1404 0.1404 0.1590 0.1590 0.7124 0.7124 0.7677 0.7677 1.8939 1.8939 1.9078 1.9078 2.0471 2.0471 2.1046 2.1046 2.4935 2.4935 2.5824 2.5824 5.6703 5.6703 5.6831 5.6831 8.0826 8.0826 8.1420 8.1420 9.4981 9.4981 k = 0.0785 0.5371 0.1665 ( 8042 PWs) bands (ev): -10.9029 -10.9029 -10.9023 -10.9023 -10.6937 -10.6937 -10.6929 -10.6929 -3.9859 -3.9859 -3.9765 -3.9765 -3.5113 -3.5113 -3.5100 -3.5100 -2.5857 -2.5857 -2.5675 -2.5675 -1.9625 -1.9625 -1.9393 -1.9393 -1.6093 -1.6093 -1.5937 -1.5937 -0.6661 -0.6661 -0.6458 -0.6458 0.1489 0.1489 0.1690 0.1690 0.7046 0.7046 0.7627 0.7627 1.8782 1.8782 1.8934 1.8934 2.0456 2.0456 2.1035 2.1035 2.4741 2.4741 2.5680 2.5680 5.6815 5.6815 5.6949 5.6949 8.1137 8.1137 8.1800 8.1800 9.4998 9.4998 k = 0.0915 0.5371 0.1665 ( 8042 PWs) bands (ev): -10.9005 -10.9005 -10.8997 -10.8997 -10.6933 -10.6933 -10.6925 -10.6925 -3.9836 -3.9836 -3.9742 -3.9742 -3.5119 -3.5119 -3.5104 -3.5104 -2.5823 -2.5823 -2.5642 -2.5642 -1.9625 -1.9625 -1.9399 -1.9399 -1.6115 -1.6115 -1.5962 -1.5962 -0.6698 -0.6698 -0.6507 -0.6507 0.1585 0.1585 0.1802 0.1802 0.6960 0.6960 0.7570 0.7570 1.8560 1.8560 1.8810 1.8810 2.0419 2.0419 2.1007 2.1007 2.4544 2.4544 2.5526 2.5526 5.6939 5.6939 5.7078 5.7078 8.1489 8.1489 8.2229 8.2229 9.5011 9.5011 k = 0.1046 0.5371 0.1665 ( 8040 PWs) bands (ev): -10.8977 -10.8977 -10.8968 -10.8968 -10.6929 -10.6929 -10.6919 -10.6919 -3.9810 -3.9810 -3.9715 -3.9715 -3.5125 -3.5125 -3.5109 -3.5109 -2.5784 -2.5784 -2.5605 -2.5605 -1.9625 -1.9625 -1.9405 -1.9405 -1.6138 -1.6138 -1.5990 -1.5990 -0.6740 -0.6740 -0.6562 -0.6562 0.1692 0.1692 0.1925 0.1925 0.6871 0.6871 0.7510 0.7510 1.8297 1.8297 1.8674 1.8674 2.0359 2.0359 2.0963 2.0963 2.4359 2.4359 2.5369 2.5369 5.7069 5.7069 5.7213 5.7213 8.1875 8.1875 8.2698 8.2698 9.5011 9.5011 k = 0.1177 0.5371 0.1665 ( 8044 PWs) bands (ev): -10.8945 -10.8945 -10.8936 -10.8936 -10.6924 -10.6924 -10.6913 -10.6913 -3.9781 -3.9781 -3.9686 -3.9686 -3.5132 -3.5132 -3.5115 -3.5115 -2.5743 -2.5743 -2.5565 -2.5565 -1.9624 -1.9624 -1.9410 -1.9410 -1.6165 -1.6165 -1.6020 -1.6020 -0.6785 -0.6785 -0.6621 -0.6621 0.1807 0.1807 0.2056 0.2056 0.6782 0.6782 0.7449 0.7449 1.7999 1.7999 1.8511 1.8511 2.0278 2.0278 2.0907 2.0907 2.4195 2.4195 2.5217 2.5217 5.7202 5.7202 5.7350 5.7350 8.2286 8.2286 8.3198 8.3198 9.4990 9.4990 k = 0.1308 0.5371 0.1665 ( 8044 PWs) bands (ev): -10.8911 -10.8911 -10.8901 -10.8901 -10.6918 -10.6918 -10.6907 -10.6907 -3.9749 -3.9749 -3.9654 -3.9654 -3.5140 -3.5140 -3.5121 -3.5121 -2.5699 -2.5699 -2.5523 -2.5523 -1.9622 -1.9622 -1.9415 -1.9415 -1.6192 -1.6192 -1.6053 -1.6053 -0.6834 -0.6834 -0.6685 -0.6685 0.1926 0.1926 0.2190 0.2190 0.6697 0.6697 0.7390 0.7390 1.7665 1.7665 1.8307 1.8307 2.0179 2.0179 2.0844 2.0844 2.4060 2.4060 2.5074 2.5074 5.7333 5.7333 5.7485 5.7485 8.2714 8.2714 8.3720 8.3720 9.4945 9.4945 k = 0.1439 0.5371 0.1665 ( 8034 PWs) bands (ev): -10.8874 -10.8874 -10.8864 -10.8864 -10.6913 -10.6913 -10.6901 -10.6901 -3.9715 -3.9715 -3.9620 -3.9620 -3.5148 -3.5148 -3.5128 -3.5128 -2.5652 -2.5652 -2.5480 -2.5480 -1.9619 -1.9619 -1.9419 -1.9419 -1.6221 -1.6221 -1.6087 -1.6087 -0.6885 -0.6885 -0.6751 -0.6751 0.2047 0.2047 0.2324 0.2324 0.6621 0.6621 0.7338 0.7338 1.7298 1.7298 1.8050 1.8050 2.0076 2.0076 2.0782 2.0782 2.3956 2.3956 2.4945 2.4945 5.7458 5.7458 5.7613 5.7613 8.3148 8.3148 8.4254 8.4254 9.4873 9.4873 k = 0.1569 0.5371 0.1665 ( 8030 PWs) bands (ev): -10.8835 -10.8835 -10.8824 -10.8824 -10.6907 -10.6907 -10.6894 -10.6894 -3.9679 -3.9679 -3.9585 -3.9585 -3.5157 -3.5157 -3.5135 -3.5135 -2.5604 -2.5604 -2.5436 -2.5436 -1.9614 -1.9614 -1.9422 -1.9422 -1.6251 -1.6251 -1.6122 -1.6122 -0.6938 -0.6938 -0.6819 -0.6819 0.2166 0.2166 0.2453 0.2453 0.6560 0.6560 0.7297 0.7297 1.6896 1.6896 1.7731 1.7731 1.9981 1.9981 2.0724 2.0724 2.3881 2.3881 2.4832 2.4832 5.7573 5.7573 5.7731 5.7731 8.3581 8.3581 8.4790 8.4790 9.4776 9.4776 k = 0.1700 0.5371 0.1665 ( 8036 PWs) bands (ev): -10.8794 -10.8794 -10.8782 -10.8782 -10.6901 -10.6901 -10.6888 -10.6888 -3.9642 -3.9642 -3.9548 -3.9548 -3.5166 -3.5166 -3.5143 -3.5143 -2.5556 -2.5556 -2.5392 -2.5392 -1.9608 -1.9608 -1.9423 -1.9423 -1.6282 -1.6282 -1.6159 -1.6159 -0.6992 -0.6992 -0.6888 -0.6888 0.2279 0.2279 0.2572 0.2572 0.6518 0.6518 0.7272 0.7272 1.6463 1.6463 1.7349 1.7349 1.9902 1.9902 2.0671 2.0671 2.3832 2.3832 2.4736 2.4736 5.7676 5.7676 5.7835 5.7835 8.4004 8.4004 8.5319 8.5319 9.4655 9.4655 k = 0.1831 0.5371 0.1665 ( 8034 PWs) bands (ev): -10.8751 -10.8751 -10.8739 -10.8739 -10.6895 -10.6895 -10.6881 -10.6881 -3.9604 -3.9604 -3.9510 -3.9510 -3.5175 -3.5175 -3.5151 -3.5151 -2.5508 -2.5508 -2.5348 -2.5348 -1.9600 -1.9600 -1.9422 -1.9422 -1.6312 -1.6312 -1.6195 -1.6195 -0.7047 -0.7047 -0.6955 -0.6955 0.2382 0.2382 0.2674 0.2674 0.6503 0.6503 0.7266 0.7266 1.6004 1.6004 1.6913 1.6913 1.9844 1.9844 2.0625 2.0625 2.3804 2.3804 2.4657 2.4657 5.7764 5.7764 5.7923 5.7923 8.4409 8.4409 8.5831 8.5831 9.4512 9.4512 k = 0.1962 0.5371 0.1665 ( 8034 PWs) bands (ev): -10.8706 -10.8706 -10.8694 -10.8694 -10.6888 -10.6888 -10.6875 -10.6875 -3.9564 -3.9564 -3.9471 -3.9471 -3.5185 -3.5185 -3.5160 -3.5160 -2.5460 -2.5460 -2.5307 -2.5307 -1.9590 -1.9590 -1.9419 -1.9419 -1.6342 -1.6342 -1.6231 -1.6231 -0.7102 -0.7102 -0.7018 -0.7018 0.2470 0.2470 0.2755 0.2755 0.6518 0.6518 0.7285 0.7285 1.5522 1.5522 1.6432 1.6432 1.9806 1.9806 2.0585 2.0585 2.3792 2.3792 2.4596 2.4596 5.7833 5.7833 5.7993 5.7993 8.4788 8.4788 8.6319 8.6319 9.4351 9.4351 k = 0.2093 0.5371 0.1665 ( 8046 PWs) bands (ev): -10.8660 -10.8660 -10.8648 -10.8648 -10.6882 -10.6882 -10.6868 -10.6868 -3.9524 -3.9524 -3.9432 -3.9432 -3.5195 -3.5195 -3.5169 -3.5169 -2.5415 -2.5415 -2.5268 -2.5268 -1.9579 -1.9579 -1.9413 -1.9413 -1.6371 -1.6371 -1.6266 -1.6266 -0.7156 -0.7156 -0.7077 -0.7077 0.2542 0.2542 0.2811 0.2811 0.6569 0.6569 0.7331 0.7331 1.5024 1.5024 1.5919 1.5919 1.9783 1.9783 2.0549 2.0549 2.3793 2.3793 2.4551 2.4551 5.7884 5.7884 5.8044 5.8044 8.5134 8.5134 8.6773 8.6773 9.4173 9.4173 k = 0.2223 0.5371 0.1665 ( 8048 PWs) bands (ev): -10.8614 -10.8614 -10.8601 -10.8601 -10.6876 -10.6876 -10.6862 -10.6862 -3.9484 -3.9484 -3.9393 -3.9393 -3.5206 -3.5206 -3.5178 -3.5178 -2.5371 -2.5371 -2.5232 -2.5232 -1.9566 -1.9566 -1.9405 -1.9405 -1.6399 -1.6399 -1.6300 -1.6300 -0.7209 -0.7209 -0.7130 -0.7130 0.2593 0.2593 0.2839 0.2839 0.6656 0.6656 0.7406 0.7406 1.4517 1.4517 1.5386 1.5386 1.9772 1.9772 2.0517 2.0517 2.3803 2.3803 2.4522 2.4522 5.7916 5.7916 5.8074 5.8074 8.5444 8.5444 8.7188 8.7188 9.3985 9.3985 k = 0.2354 0.5371 0.1665 ( 8044 PWs) bands (ev): -10.8567 -10.8567 -10.8554 -10.8554 -10.6870 -10.6870 -10.6856 -10.6856 -3.9445 -3.9445 -3.9354 -3.9354 -3.5216 -3.5216 -3.5188 -3.5188 -2.5331 -2.5331 -2.5199 -2.5199 -1.9551 -1.9551 -1.9395 -1.9395 -1.6425 -1.6425 -1.6332 -1.6332 -0.7259 -0.7259 -0.7175 -0.7175 0.2622 0.2622 0.2839 0.2839 0.6778 0.6778 0.7510 0.7510 1.4008 1.4008 1.4844 1.4844 1.9770 1.9770 2.0486 2.0486 2.3822 2.3822 2.4508 2.4508 5.7928 5.7928 5.8085 5.8085 8.5711 8.5711 8.7557 8.7557 9.3792 9.3792 k = 0.2485 0.5371 0.1665 ( 8044 PWs) bands (ev): -10.8520 -10.8520 -10.8508 -10.8508 -10.6865 -10.6865 -10.6851 -10.6851 -3.9406 -3.9406 -3.9316 -3.9316 -3.5226 -3.5226 -3.5197 -3.5197 -2.5295 -2.5295 -2.5171 -2.5171 -1.9534 -1.9534 -1.9383 -1.9383 -1.6450 -1.6450 -1.6363 -1.6363 -0.7305 -0.7305 -0.7213 -0.7213 0.2628 0.2628 0.2814 0.2814 0.6932 0.6932 0.7643 0.7643 1.3505 1.3505 1.4303 1.4303 1.9771 1.9771 2.0454 2.0454 2.3846 2.3846 2.4507 2.4507 5.7920 5.7920 5.8076 5.8076 8.5932 8.5932 8.7875 8.7875 9.3598 9.3598 k = 0.2616 0.5371 0.1665 ( 8046 PWs) bands (ev): -10.8474 -10.8474 -10.8462 -10.8462 -10.6860 -10.6860 -10.6847 -10.6847 -3.9368 -3.9368 -3.9280 -3.9280 -3.5237 -3.5237 -3.5206 -3.5206 -2.5262 -2.5262 -2.5147 -2.5147 -1.9516 -1.9516 -1.9368 -1.9368 -1.6472 -1.6472 -1.6390 -1.6390 -0.7344 -0.7344 -0.7243 -0.7243 0.2613 0.2613 0.2766 0.2766 0.7110 0.7110 0.7800 0.7800 1.3016 1.3016 1.3772 1.3772 1.9774 1.9774 2.0421 2.0421 2.3876 2.3876 2.4519 2.4519 5.7896 5.7896 5.8049 5.8049 8.6105 8.6105 8.8137 8.8137 9.3412 9.3412 k = 0.2746 0.5371 0.1665 ( 8044 PWs) bands (ev): -10.8428 -10.8428 -10.8416 -10.8416 -10.6855 -10.6855 -10.6843 -10.6843 -3.9332 -3.9332 -3.9245 -3.9245 -3.5246 -3.5246 -3.5215 -3.5215 -2.5234 -2.5234 -2.5127 -2.5127 -1.9498 -1.9498 -1.9352 -1.9352 -1.6492 -1.6492 -1.6415 -1.6415 -0.7376 -0.7376 -0.7265 -0.7265 0.2576 0.2576 0.2700 0.2700 0.7306 0.7306 0.7977 0.7977 1.2551 1.2551 1.3261 1.3261 1.9776 1.9776 2.0385 2.0385 2.3911 2.3911 2.4543 2.4543 5.7855 5.7855 5.8005 5.8005 8.6227 8.6227 8.8341 8.8341 9.3239 9.3239 k = 0.2877 0.5371 0.1665 ( 8034 PWs) bands (ev): -10.8383 -10.8383 -10.8373 -10.8373 -10.6851 -10.6851 -10.6840 -10.6840 -3.9297 -3.9297 -3.9212 -3.9212 -3.5256 -3.5256 -3.5224 -3.5224 -2.5211 -2.5211 -2.5112 -2.5112 -1.9478 -1.9478 -1.9335 -1.9335 -1.6510 -1.6510 -1.6437 -1.6437 -0.7399 -0.7399 -0.7278 -0.7278 0.2518 0.2518 0.2620 0.2620 0.7510 0.7510 0.8167 0.8167 1.2120 1.2120 1.2779 1.2779 1.9775 1.9775 2.0344 2.0344 2.3950 2.3950 2.4578 2.4578 5.7800 5.7800 5.7948 5.7948 8.6299 8.6299 8.8484 8.8484 9.3087 9.3087 k = 0.3008 0.5371 0.1665 ( 8026 PWs) bands (ev): -10.8341 -10.8341 -10.8331 -10.8331 -10.6848 -10.6848 -10.6837 -10.6837 -3.9264 -3.9264 -3.9181 -3.9181 -3.5265 -3.5265 -3.5233 -3.5233 -2.5192 -2.5192 -2.5101 -2.5101 -1.9458 -1.9458 -1.9316 -1.9316 -1.6525 -1.6525 -1.6457 -1.6457 -0.7412 -0.7412 -0.7284 -0.7284 0.2442 0.2442 0.2530 0.2530 0.7708 0.7708 0.8359 0.8359 1.1738 1.1738 1.2339 1.2339 1.9769 1.9769 2.0298 2.0298 2.3993 2.3993 2.4621 2.4621 5.7733 5.7733 5.7879 5.7879 8.6322 8.6322 8.8566 8.8566 9.2960 9.2960 k = 0.3139 0.5371 0.1665 ( 8022 PWs) bands (ev): -10.8300 -10.8300 -10.8291 -10.8291 -10.6846 -10.6846 -10.6836 -10.6836 -3.9234 -3.9234 -3.9152 -3.9152 -3.5273 -3.5273 -3.5241 -3.5241 -2.5177 -2.5177 -2.5094 -2.5094 -1.9438 -1.9438 -1.9298 -1.9298 -1.6539 -1.6539 -1.6473 -1.6473 -0.7415 -0.7415 -0.7280 -0.7280 0.2350 0.2350 0.2430 0.2430 0.7885 0.7885 0.8541 0.8541 1.1421 1.1421 1.1954 1.1954 1.9757 1.9757 2.0246 2.0246 2.4041 2.4041 2.4673 2.4673 5.7657 5.7657 5.7800 5.7800 8.6298 8.6298 8.8588 8.8588 9.2863 9.2863 k = 0.3270 0.5371 0.1665 ( 8020 PWs) bands (ev): -10.8262 -10.8262 -10.8254 -10.8254 -10.6844 -10.6844 -10.6836 -10.6836 -3.9206 -3.9206 -3.9126 -3.9126 -3.5282 -3.5282 -3.5248 -3.5248 -2.5167 -2.5167 -2.5091 -2.5091 -1.9418 -1.9418 -1.9279 -1.9279 -1.6550 -1.6550 -1.6488 -1.6488 -0.7408 -0.7408 -0.7269 -0.7269 0.2245 0.2245 0.2324 0.2324 0.8023 0.8023 0.8696 0.8696 1.1189 1.1189 1.1642 1.1642 1.9739 1.9739 2.0189 2.0189 2.4092 2.4092 2.4731 2.4731 5.7575 5.7575 5.7714 5.7714 8.6230 8.6230 8.8555 8.8555 9.2797 9.2797 k = 0.3400 0.5371 0.1665 ( 8014 PWs) bands (ev): -10.8227 -10.8227 -10.8219 -10.8219 -10.6844 -10.6844 -10.6836 -10.6836 -3.9182 -3.9182 -3.9103 -3.9103 -3.5289 -3.5289 -3.5256 -3.5256 -2.5160 -2.5160 -2.5091 -2.5091 -1.9399 -1.9399 -1.9262 -1.9262 -1.6560 -1.6560 -1.6500 -1.6500 -0.7392 -0.7392 -0.7250 -0.7250 0.2130 0.2130 0.2209 0.2209 0.8103 0.8103 0.8805 0.8805 1.1058 1.1058 1.1428 1.1428 1.9713 1.9713 2.0127 2.0127 2.4147 2.4147 2.4793 2.4793 5.7488 5.7488 5.7624 5.7624 8.6125 8.6125 8.8471 8.8471 9.2761 9.2761 k = 0.3531 0.5371 0.1665 ( 8016 PWs) bands (ev): -10.8195 -10.8195 -10.8189 -10.8189 -10.6844 -10.6844 -10.6837 -10.6837 -3.9159 -3.9159 -3.9083 -3.9083 -3.5296 -3.5296 -3.5263 -3.5263 -2.5157 -2.5157 -2.5094 -2.5094 -1.9381 -1.9381 -1.9245 -1.9245 -1.6569 -1.6569 -1.6511 -1.6511 -0.7366 -0.7366 -0.7224 -0.7224 0.2010 0.2010 0.2089 0.2089 0.8115 0.8115 0.8854 0.8854 1.1029 1.1029 1.1334 1.1334 1.9681 1.9681 2.0061 2.0061 2.4204 2.4204 2.4859 2.4859 5.7400 5.7400 5.7533 5.7533 8.5988 8.5988 8.8345 8.8345 9.2753 9.2753 k = 0.3662 0.5371 0.1665 ( 8018 PWs) bands (ev): -10.8167 -10.8167 -10.8162 -10.8162 -10.6845 -10.6845 -10.6839 -10.6839 -3.9140 -3.9140 -3.9066 -3.9066 -3.5302 -3.5302 -3.5270 -3.5270 -2.5157 -2.5157 -2.5098 -2.5098 -1.9364 -1.9364 -1.9230 -1.9230 -1.6578 -1.6578 -1.6520 -1.6520 -0.7332 -0.7332 -0.7191 -0.7191 0.1885 0.1885 0.1964 0.1964 0.8067 0.8067 0.8840 0.8840 1.1085 1.1085 1.1372 1.1372 1.9641 1.9641 1.9994 1.9994 2.4262 2.4262 2.4927 2.4927 5.7312 5.7312 5.7442 5.7442 8.5825 8.5825 8.8185 8.8185 9.2769 9.2769 k = 0.3662 0.5371 0.1665 ( 8018 PWs) bands (ev): -10.8167 -10.8167 -10.8162 -10.8162 -10.6845 -10.6845 -10.6839 -10.6839 -3.9140 -3.9140 -3.9066 -3.9066 -3.5302 -3.5302 -3.5270 -3.5270 -2.5157 -2.5157 -2.5098 -2.5098 -1.9364 -1.9364 -1.9230 -1.9230 -1.6578 -1.6578 -1.6520 -1.6520 -0.7332 -0.7332 -0.7191 -0.7191 0.1885 0.1885 0.1964 0.1964 0.8067 0.8067 0.8840 0.8840 1.1085 1.1085 1.1372 1.1372 1.9641 1.9641 1.9994 1.9994 2.4262 2.4262 2.4927 2.4927 5.7312 5.7312 5.7442 5.7442 8.5825 8.5825 8.8185 8.8185 9.2769 9.2769 k = 0.3589 0.5264 0.1665 ( 8014 PWs) bands (ev): -10.8214 -10.8214 -10.8207 -10.8207 -10.6842 -10.6842 -10.6835 -10.6835 -3.9172 -3.9172 -3.9094 -3.9094 -3.5292 -3.5292 -3.5258 -3.5258 -2.5156 -2.5156 -2.5090 -2.5090 -1.9393 -1.9393 -1.9256 -1.9256 -1.6563 -1.6563 -1.6504 -1.6504 -0.7396 -0.7396 -0.7252 -0.7252 0.2110 0.2110 0.2188 0.2188 0.8204 0.8204 0.8923 0.8923 1.0908 1.0908 1.1215 1.1215 1.9722 1.9722 2.0121 2.0121 2.4152 2.4152 2.4801 2.4801 5.7464 5.7464 5.7599 5.7599 8.6116 8.6116 8.8438 8.8438 9.2772 9.2772 k = 0.3515 0.5157 0.1665 ( 8014 PWs) bands (ev): -10.8264 -10.8264 -10.8256 -10.8256 -10.6839 -10.6839 -10.6831 -10.6831 -3.9205 -3.9205 -3.9124 -3.9124 -3.5282 -3.5282 -3.5248 -3.5248 -2.5156 -2.5156 -2.5083 -2.5083 -1.9424 -1.9424 -1.9282 -1.9282 -1.6550 -1.6550 -1.6488 -1.6488 -0.7456 -0.7456 -0.7310 -0.7310 0.2339 0.2339 0.2414 0.2414 0.8364 0.8364 0.9028 0.9028 1.0712 1.0712 1.1089 1.1089 1.9812 1.9812 2.0258 2.0258 2.4028 2.4028 2.4664 2.4664 5.7613 5.7613 5.7754 5.7754 8.6374 8.6374 8.8572 8.8572 9.2882 9.2882 k = 0.3442 0.5049 0.1665 ( 8022 PWs) bands (ev): -10.8316 -10.8316 -10.8308 -10.8308 -10.6836 -10.6836 -10.6826 -10.6826 -3.9240 -3.9240 -3.9155 -3.9155 -3.5272 -3.5272 -3.5238 -3.5238 -2.5158 -2.5158 -2.5077 -2.5077 -1.9455 -1.9455 -1.9310 -1.9310 -1.6536 -1.6536 -1.6473 -1.6473 -0.7513 -0.7513 -0.7363 -0.7363 0.2571 0.2571 0.2643 0.2643 0.8544 0.8544 0.9157 0.9157 1.0519 1.0519 1.0983 1.0983 1.9912 1.9912 2.0399 2.0399 2.3895 2.3895 2.4519 2.4519 5.7758 5.7758 5.7904 5.7904 8.6597 8.6597 8.8591 8.8591 9.3091 9.3091 k = 0.3369 0.4942 0.1665 ( 8026 PWs) bands (ev): -10.8372 -10.8372 -10.8363 -10.8363 -10.6833 -10.6833 -10.6822 -10.6822 -3.9276 -3.9276 -3.9187 -3.9187 -3.5264 -3.5264 -3.5230 -3.5230 -2.5162 -2.5162 -2.5073 -2.5073 -1.9487 -1.9487 -1.9339 -1.9339 -1.6523 -1.6523 -1.6458 -1.6458 -0.7565 -0.7565 -0.7412 -0.7412 0.2803 0.2803 0.2872 0.2872 0.8744 0.8744 0.9309 0.9309 1.0342 1.0342 1.0895 1.0895 2.0020 2.0020 2.0535 2.0535 2.3755 2.3755 2.4371 2.4371 5.7898 5.7898 5.8050 5.8050 8.6782 8.6782 8.8514 8.8514 9.3376 9.3376 k = 0.3296 0.4834 0.1665 ( 8024 PWs) bands (ev): -10.8431 -10.8431 -10.8421 -10.8421 -10.6830 -10.6830 -10.6818 -10.6818 -3.9312 -3.9312 -3.9220 -3.9220 -3.5257 -3.5257 -3.5223 -3.5223 -2.5168 -2.5168 -2.5071 -2.5071 -1.9519 -1.9519 -1.9369 -1.9369 -1.6511 -1.6511 -1.6443 -1.6443 -0.7612 -0.7612 -0.7456 -0.7456 0.3035 0.3035 0.3100 0.3100 0.8959 0.8959 0.9484 0.9484 1.0191 1.0191 1.0823 1.0823 2.0131 2.0131 2.0662 2.0662 2.3610 2.3610 2.4225 2.4225 5.8032 5.8032 5.8190 5.8190 8.6929 8.6929 8.8366 8.8366 9.3709 9.3709 k = 0.3223 0.4727 0.1665 ( 8032 PWs) bands (ev): -10.8493 -10.8493 -10.8482 -10.8482 -10.6827 -10.6827 -10.6814 -10.6814 -3.9350 -3.9350 -3.9255 -3.9255 -3.5250 -3.5250 -3.5217 -3.5217 -2.5177 -2.5177 -2.5070 -2.5070 -1.9552 -1.9552 -1.9399 -1.9399 -1.6498 -1.6498 -1.6429 -1.6429 -0.7653 -0.7653 -0.7496 -0.7496 0.3265 0.3265 0.3326 0.3326 0.9180 0.9180 0.9675 0.9675 1.0086 1.0086 1.0771 1.0771 2.0242 2.0242 2.0774 2.0774 2.3466 2.3466 2.4088 2.4088 5.8159 5.8159 5.8323 5.8323 8.7039 8.7039 8.8168 8.8168 9.4066 9.4066 k = 0.3149 0.4619 0.1665 ( 8032 PWs) bands (ev): -10.8558 -10.8558 -10.8546 -10.8546 -10.6824 -10.6824 -10.6810 -10.6810 -3.9389 -3.9389 -3.9291 -3.9291 -3.5245 -3.5245 -3.5212 -3.5212 -2.5187 -2.5187 -2.5072 -2.5072 -1.9586 -1.9586 -1.9431 -1.9431 -1.6486 -1.6486 -1.6416 -1.6416 -0.7689 -0.7689 -0.7530 -0.7530 0.3492 0.3492 0.3547 0.3547 0.9384 0.9384 0.9855 0.9855 1.0082 1.0082 1.0744 1.0744 2.0347 2.0347 2.0863 2.0863 2.3324 2.3324 2.3966 2.3966 5.8278 5.8278 5.8448 5.8448 8.7112 8.7112 8.7940 8.7940 9.4426 9.4426 k = 0.3076 0.4512 0.1665 ( 8028 PWs) bands (ev): -10.8626 -10.8626 -10.8613 -10.8613 -10.6822 -10.6822 -10.6807 -10.6807 -3.9429 -3.9429 -3.9327 -3.9327 -3.5242 -3.5242 -3.5208 -3.5208 -2.5199 -2.5199 -2.5076 -2.5076 -1.9620 -1.9620 -1.9463 -1.9463 -1.6474 -1.6474 -1.6402 -1.6402 -0.7717 -0.7717 -0.7559 -0.7559 0.3715 0.3715 0.3763 0.3763 0.9513 0.9513 1.0004 1.0004 1.0251 1.0251 1.0745 1.0745 2.0441 2.0441 2.0925 2.0925 2.3189 2.3189 2.3868 2.3868 5.8390 5.8390 5.8565 5.8565 8.7150 8.7150 8.7695 8.7695 9.4775 9.4775 k = 0.3003 0.4405 0.1665 ( 8048 PWs) bands (ev): -10.8697 -10.8697 -10.8682 -10.8682 -10.6820 -10.6820 -10.6804 -10.6804 -3.9469 -3.9469 -3.9365 -3.9365 -3.5240 -3.5240 -3.5207 -3.5207 -2.5214 -2.5214 -2.5081 -2.5081 -1.9654 -1.9654 -1.9496 -1.9496 -1.6462 -1.6462 -1.6389 -1.6389 -0.7739 -0.7739 -0.7583 -0.7583 0.3932 0.3932 0.3973 0.3973 0.9554 0.9554 1.0210 1.0210 1.0511 1.0511 1.0790 1.0790 2.0514 2.0514 2.0956 2.0956 2.3066 2.3066 2.3802 2.3802 5.8492 5.8492 5.8672 5.8672 8.7146 8.7146 8.7449 8.7449 9.5101 9.5101 k = 0.2930 0.4297 0.1665 ( 8042 PWs) bands (ev): -10.8770 -10.8770 -10.8755 -10.8755 -10.6818 -10.6818 -10.6802 -10.6802 -3.9511 -3.9511 -3.9403 -3.9403 -3.5239 -3.5239 -3.5206 -3.5206 -2.5231 -2.5231 -2.5089 -2.5089 -1.9689 -1.9689 -1.9530 -1.9530 -1.6450 -1.6450 -1.6376 -1.6376 -0.7754 -0.7754 -0.7602 -0.7602 0.4141 0.4141 0.4176 0.4176 0.9571 0.9571 1.0440 1.0440 1.0802 1.0802 1.0909 1.0909 2.0557 2.0557 2.0959 2.0959 2.2960 2.2960 2.3773 2.3773 5.8584 5.8584 5.8769 5.8769 8.7056 8.7056 8.7256 8.7256 9.5391 9.5391 k = 0.2856 0.4190 0.1665 ( 8064 PWs) bands (ev): -10.8845 -10.8845 -10.8830 -10.8830 -10.6817 -10.6817 -10.6800 -10.6800 -3.9552 -3.9552 -3.9442 -3.9442 -3.5240 -3.5240 -3.5208 -3.5208 -2.5250 -2.5250 -2.5100 -2.5100 -1.9725 -1.9725 -1.9564 -1.9564 -1.6438 -1.6438 -1.6364 -1.6364 -0.7761 -0.7761 -0.7615 -0.7615 0.4342 0.4342 0.4372 0.4372 0.9600 0.9600 1.0628 1.0628 1.1083 1.1083 1.1172 1.1172 2.0558 2.0558 2.0938 2.0938 2.2877 2.2877 2.3779 2.3779 5.8665 5.8665 5.8856 5.8856 8.6840 8.6840 8.7166 8.7166 9.5624 9.5624 k = 0.2783 0.4082 0.1665 ( 8076 PWs) bands (ev): -10.8923 -10.8923 -10.8907 -10.8907 -10.6817 -10.6817 -10.6799 -10.6799 -3.9594 -3.9594 -3.9482 -3.9482 -3.5243 -3.5243 -3.5211 -3.5211 -2.5270 -2.5270 -2.5112 -2.5112 -1.9761 -1.9761 -1.9599 -1.9599 -1.6426 -1.6426 -1.6351 -1.6351 -0.7761 -0.7761 -0.7623 -0.7623 0.4532 0.4532 0.4564 0.4564 0.9655 0.9655 1.0777 1.0777 1.1396 1.1396 1.1520 1.1520 2.0513 2.0513 2.0899 2.0899 2.2823 2.2823 2.3818 2.3818 5.8735 5.8735 5.8930 5.8930 8.6586 8.6586 8.7094 8.7094 9.5768 9.5768 k = 0.2710 0.3975 0.1665 ( 8068 PWs) bands (ev): -10.9003 -10.9003 -10.8987 -10.8987 -10.6817 -10.6817 -10.6798 -10.6798 -3.9637 -3.9637 -3.9522 -3.9522 -3.5247 -3.5247 -3.5216 -3.5216 -2.5293 -2.5293 -2.5126 -2.5126 -1.9797 -1.9797 -1.9634 -1.9634 -1.6413 -1.6413 -1.6339 -1.6339 -0.7754 -0.7754 -0.7626 -0.7626 0.4710 0.4710 0.4751 0.4751 0.9740 0.9740 1.0921 1.0921 1.1755 1.1755 1.1900 1.1900 2.0423 2.0423 2.0843 2.0843 2.2801 2.2801 2.3885 2.3885 5.8793 5.8793 5.8993 5.8993 8.6331 8.6331 8.7013 8.7013 9.5830 9.5830 k = 0.2637 0.3867 0.1665 ( 8060 PWs) bands (ev): -10.9086 -10.9086 -10.9069 -10.9069 -10.6817 -10.6817 -10.6799 -10.6799 -3.9679 -3.9679 -3.9563 -3.9563 -3.5253 -3.5253 -3.5222 -3.5222 -2.5317 -2.5317 -2.5143 -2.5143 -1.9833 -1.9833 -1.9669 -1.9669 -1.6401 -1.6401 -1.6326 -1.6326 -0.7739 -0.7739 -0.7623 -0.7623 0.4879 0.4879 0.4934 0.4934 0.9857 0.9857 1.1080 1.1080 1.2142 1.2142 1.2303 1.2303 2.0301 2.0301 2.0768 2.0768 2.2809 2.2809 2.3970 2.3970 5.8838 5.8838 5.9042 5.9042 8.6080 8.6080 8.6920 8.6920 9.5849 9.5849 k = 0.2563 0.3760 0.1665 ( 8048 PWs) bands (ev): -10.9170 -10.9170 -10.9153 -10.9153 -10.6818 -10.6818 -10.6799 -10.6799 -3.9722 -3.9722 -3.9604 -3.9604 -3.5261 -3.5261 -3.5231 -3.5231 -2.5343 -2.5343 -2.5162 -2.5162 -1.9870 -1.9870 -1.9704 -1.9704 -1.6390 -1.6390 -1.6315 -1.6315 -0.7716 -0.7716 -0.7616 -0.7616 0.5039 0.5039 0.5113 0.5113 1.0005 1.0005 1.1259 1.1259 1.2551 1.2551 1.2727 1.2727 2.0157 2.0157 2.0677 2.0677 2.2844 2.2844 2.4069 2.4069 5.8869 5.8869 5.9076 5.9076 8.5839 8.5839 8.6816 8.6816 9.5835 9.5835 k = 0.2490 0.3653 0.1665 ( 8040 PWs) bands (ev): -10.9255 -10.9255 -10.9238 -10.9238 -10.6820 -10.6820 -10.6801 -10.6801 -3.9764 -3.9764 -3.9645 -3.9645 -3.5270 -3.5270 -3.5241 -3.5241 -2.5370 -2.5370 -2.5183 -2.5183 -1.9906 -1.9906 -1.9739 -1.9739 -1.6379 -1.6379 -1.6303 -1.6303 -0.7686 -0.7686 -0.7602 -0.7602 0.5192 0.5192 0.5288 0.5288 1.0183 1.0183 1.1461 1.1461 1.2977 1.2977 1.3169 1.3169 2.0001 2.0001 2.0574 2.0574 2.2898 2.2898 2.4176 2.4176 5.8887 5.8887 5.9097 5.9097 8.5609 8.5609 8.6702 8.6702 9.5790 9.5790 k = 0.2417 0.3545 0.1665 ( 8028 PWs) bands (ev): -10.9343 -10.9343 -10.9326 -10.9326 -10.6822 -10.6822 -10.6803 -10.6803 -3.9806 -3.9806 -3.9686 -3.9686 -3.5281 -3.5281 -3.5252 -3.5252 -2.5398 -2.5398 -2.5205 -2.5205 -1.9943 -1.9943 -1.9774 -1.9774 -1.6368 -1.6368 -1.6293 -1.6293 -0.7648 -0.7648 -0.7583 -0.7583 0.5339 0.5339 0.5460 0.5460 1.0388 1.0388 1.1686 1.1686 1.3418 1.3418 1.3628 1.3628 1.9840 1.9840 2.0465 2.0465 2.2965 2.2965 2.4286 2.4286 5.8890 5.8890 5.9102 5.9102 8.5391 8.5391 8.6582 8.6582 9.5709 9.5709 k = 0.2344 0.3438 0.1665 ( 8022 PWs) bands (ev): -10.9431 -10.9431 -10.9414 -10.9414 -10.6825 -10.6825 -10.6806 -10.6806 -3.9848 -3.9848 -3.9727 -3.9727 -3.5294 -3.5294 -3.5266 -3.5266 -2.5428 -2.5428 -2.5230 -2.5230 -1.9979 -1.9979 -1.9808 -1.9808 -1.6359 -1.6359 -1.6283 -1.6283 -0.7604 -0.7604 -0.7558 -0.7558 0.5482 0.5482 0.5632 0.5632 1.0618 1.0618 1.1932 1.1932 1.3870 1.3870 1.4099 1.4099 1.9680 1.9680 2.0356 2.0356 2.3039 2.3039 2.4396 2.4396 5.8877 5.8877 5.9092 5.9092 8.5188 8.5188 8.6456 8.6456 9.5587 9.5587 k = 0.2270 0.3330 0.1665 ( 8018 PWs) bands (ev): -10.9521 -10.9521 -10.9504 -10.9504 -10.6829 -10.6829 -10.6810 -10.6810 -3.9889 -3.9889 -3.9768 -3.9768 -3.5308 -3.5308 -3.5281 -3.5281 -2.5459 -2.5459 -2.5256 -2.5256 -2.0014 -2.0014 -1.9842 -1.9842 -1.6352 -1.6352 -1.6274 -1.6274 -0.7553 -0.7553 -0.7526 -0.7526 0.5622 0.5622 0.5803 0.5803 1.0871 1.0871 1.2199 1.2199 1.4331 1.4331 1.4582 1.4582 1.9525 1.9525 2.0252 2.0252 2.3116 2.3116 2.4503 2.4503 5.8849 5.8849 5.9065 5.9065 8.4999 8.4999 8.6327 8.6327 9.5420 9.5420 k = 0.2197 0.3223 0.1665 ( 8014 PWs) bands (ev): -10.9611 -10.9611 -10.9594 -10.9594 -10.6833 -10.6833 -10.6814 -10.6814 -3.9930 -3.9930 -3.9808 -3.9808 -3.5324 -3.5324 -3.5297 -3.5297 -2.5490 -2.5490 -2.5284 -2.5284 -2.0049 -2.0049 -1.9875 -1.9875 -1.6346 -1.6346 -1.6267 -1.6267 -0.7497 -0.7497 -0.7486 -0.7486 0.5759 0.5759 0.5975 0.5975 1.1145 1.1145 1.2484 1.2484 1.4798 1.4798 1.5074 1.5074 1.9380 1.9380 2.0159 2.0159 2.3192 2.3192 2.4605 2.4605 5.8805 5.8805 5.9022 5.9022 8.4826 8.4826 8.6194 8.6194 9.5202 9.5202 k = 0.2124 0.3115 0.1665 ( 8018 PWs) bands (ev): -10.9702 -10.9702 -10.9685 -10.9685 -10.6838 -10.6838 -10.6819 -10.6819 -3.9970 -3.9970 -3.9849 -3.9849 -3.5342 -3.5342 -3.5315 -3.5315 -2.5522 -2.5522 -2.5313 -2.5313 -2.0083 -2.0083 -1.9907 -1.9907 -1.6342 -1.6342 -1.6261 -1.6261 -0.7448 -0.7448 -0.7427 -0.7427 0.5896 0.5896 0.6149 0.6149 1.1437 1.1437 1.2787 1.2787 1.5268 1.5268 1.5571 1.5571 1.9249 1.9249 2.0079 2.0079 2.3264 2.3264 2.4700 2.4700 5.8745 5.8745 5.8962 5.8962 8.4667 8.4667 8.6058 8.6058 9.4931 9.4931 k = 0.2051 0.3008 0.1665 ( 8026 PWs) bands (ev): -10.9793 -10.9793 -10.9776 -10.9776 -10.6844 -10.6844 -10.6825 -10.6825 -4.0010 -4.0010 -3.9888 -3.9888 -3.5360 -3.5360 -3.5334 -3.5334 -2.5555 -2.5555 -2.5343 -2.5343 -2.0116 -2.0116 -1.9938 -1.9938 -1.6341 -1.6341 -1.6258 -1.6258 -0.7398 -0.7398 -0.7357 -0.7357 0.6032 0.6032 0.6325 0.6325 1.1745 1.1745 1.3107 1.3107 1.5736 1.5736 1.6069 1.6069 1.9138 1.9138 2.0018 2.0018 2.3331 2.3331 2.4788 2.4788 5.8669 5.8669 5.8885 5.8885 8.4523 8.4523 8.5918 8.5918 9.4606 9.4606 k = 0.1977 0.2901 0.1665 ( 8026 PWs) bands (ev): -10.9884 -10.9884 -10.9868 -10.9868 -10.6850 -10.6850 -10.6831 -10.6831 -4.0049 -4.0049 -3.9928 -3.9928 -3.5380 -3.5380 -3.5355 -3.5355 -2.5588 -2.5588 -2.5375 -2.5375 -2.0147 -2.0147 -1.9968 -1.9968 -1.6342 -1.6342 -1.6256 -1.6256 -0.7342 -0.7342 -0.7281 -0.7281 0.6169 0.6169 0.6504 0.6504 1.2067 1.2067 1.3441 1.3441 1.6195 1.6195 1.6562 1.6562 1.9054 1.9054 1.9979 1.9979 2.3391 2.3391 2.4866 2.4866 5.8577 5.8577 5.8791 5.8791 8.4393 8.4393 8.5773 8.5773 9.4227 9.4227 k = 0.1904 0.2793 0.1665 ( 8022 PWs) bands (ev): -10.9975 -10.9975 -10.9959 -10.9959 -10.6856 -10.6856 -10.6838 -10.6838 -4.0086 -4.0086 -3.9966 -3.9966 -3.5401 -3.5401 -3.5376 -3.5376 -2.5621 -2.5621 -2.5408 -2.5408 -2.0177 -2.0177 -1.9997 -1.9997 -1.6345 -1.6345 -1.6256 -1.6256 -0.7280 -0.7280 -0.7200 -0.7200 0.6307 0.6307 0.6685 0.6685 1.2402 1.2402 1.3788 1.3788 1.6640 1.6640 1.7041 1.7041 1.9008 1.9008 1.9967 1.9967 2.3444 2.3444 2.4935 2.4935 5.8468 5.8468 5.8680 5.8680 8.4275 8.4275 8.5621 8.5621 9.3799 9.3799 k = 0.1831 0.2686 0.1665 ( 8004 PWs) bands (ev): -11.0065 -11.0065 -11.0050 -11.0050 -10.6863 -10.6863 -10.6845 -10.6845 -4.0123 -4.0123 -4.0004 -4.0004 -3.5423 -3.5423 -3.5399 -3.5399 -2.5654 -2.5654 -2.5441 -2.5441 -2.0206 -2.0206 -2.0024 -2.0024 -1.6351 -1.6351 -1.6259 -1.6259 -0.7212 -0.7212 -0.7115 -0.7115 0.6446 0.6446 0.6867 0.6867 1.2746 1.2746 1.4147 1.4147 1.7056 1.7056 1.7490 1.7490 1.9022 1.9022 1.9988 1.9988 2.3489 2.3489 2.4993 2.4993 5.8343 5.8343 5.8553 5.8553 8.4166 8.4166 8.5456 8.5456 9.3321 9.3321 k = 0.1758 0.2578 0.1665 ( 8008 PWs) bands (ev): -11.0155 -11.0155 -11.0140 -11.0140 -10.6871 -10.6871 -10.6853 -10.6853 -4.0158 -4.0158 -4.0041 -4.0041 -3.5446 -3.5446 -3.5422 -3.5422 -2.5687 -2.5687 -2.5475 -2.5475 -2.0233 -2.0233 -2.0051 -2.0051 -1.6360 -1.6360 -1.6264 -1.6264 -0.7139 -0.7139 -0.7026 -0.7026 0.6587 0.6587 0.7052 0.7052 1.3098 1.3098 1.4516 1.4516 1.7428 1.7428 1.7884 1.7884 1.9127 1.9127 2.0049 2.0049 2.3526 2.3526 2.5041 2.5041 5.8203 5.8203 5.8409 5.8409 8.4061 8.4061 8.5275 8.5275 9.2785 9.2785 k = 0.1685 0.2471 0.1665 ( 8008 PWs) bands (ev): -11.0243 -11.0243 -11.0229 -11.0229 -10.6879 -10.6879 -10.6862 -10.6862 -4.0192 -4.0192 -4.0078 -4.0078 -3.5470 -3.5470 -3.5446 -3.5446 -2.5720 -2.5720 -2.5509 -2.5509 -2.0258 -2.0258 -2.0076 -2.0076 -1.6372 -1.6372 -1.6272 -1.6272 -0.7062 -0.7062 -0.6934 -0.6934 0.6730 0.6730 0.7238 0.7238 1.3455 1.3455 1.4892 1.4892 1.7730 1.7730 1.8205 1.8205 1.9356 1.9356 2.0159 2.0159 2.3555 2.3555 2.5078 2.5078 5.8049 5.8049 5.8251 5.8251 8.3954 8.3954 8.5068 8.5068 9.2192 9.2192 k = 0.1611 0.2363 0.1665 ( 8000 PWs) bands (ev): -11.0330 -11.0330 -11.0316 -11.0316 -10.6887 -10.6887 -10.6871 -10.6871 -4.0225 -4.0225 -4.0113 -4.0113 -3.5494 -3.5494 -3.5471 -3.5471 -2.5752 -2.5752 -2.5544 -2.5544 -2.0281 -2.0281 -2.0100 -2.0100 -1.6386 -1.6386 -1.6282 -1.6282 -0.6980 -0.6980 -0.6841 -0.6841 0.6876 0.6876 0.7424 0.7424 1.3814 1.3814 1.5273 1.5273 1.7945 1.7945 1.8469 1.8469 1.9697 1.9697 2.0325 2.0325 2.3579 2.3579 2.5104 2.5104 5.7879 5.7879 5.8077 5.8077 8.3837 8.3837 8.4829 8.4829 9.1574 9.1574 k = 0.1538 0.2256 0.1665 ( 7998 PWs) bands (ev): -11.0416 -11.0416 -11.0402 -11.0402 -10.6896 -10.6896 -10.6880 -10.6880 -4.0257 -4.0257 -4.0147 -4.0147 -3.5519 -3.5519 -3.5496 -3.5496 -2.5784 -2.5784 -2.5579 -2.5579 -2.0303 -2.0303 -2.0122 -2.0122 -1.6402 -1.6402 -1.6294 -1.6294 -0.6895 -0.6895 -0.6746 -0.6746 0.7024 0.7024 0.7610 0.7610 1.4173 1.4173 1.5658 1.5658 1.8094 1.8094 1.8702 1.8702 2.0102 2.0102 2.0549 2.0549 2.3600 2.3600 2.5121 2.5121 5.7697 5.7697 5.7890 5.7890 8.3699 8.3699 8.4547 8.4547 9.0966 9.0966 k = 0.1465 0.2149 0.1665 ( 8014 PWs) bands (ev): -11.0500 -11.0500 -11.0487 -11.0487 -10.6905 -10.6905 -10.6889 -10.6889 -4.0287 -4.0287 -4.0180 -4.0180 -3.5543 -3.5543 -3.5521 -3.5521 -2.5814 -2.5814 -2.5614 -2.5614 -2.0322 -2.0322 -2.0144 -2.0144 -1.6420 -1.6420 -1.6309 -1.6309 -0.6807 -0.6807 -0.6650 -0.6650 0.7174 0.7174 0.7796 0.7796 1.4527 1.4527 1.6041 1.6041 1.8213 1.8213 1.8909 1.8909 2.0524 2.0524 2.0827 2.0827 2.3620 2.3620 2.5128 2.5128 5.7503 5.7503 5.7689 5.7689 8.3526 8.3526 8.4212 8.4212 9.0394 9.0394 k = 0.1392 0.2041 0.1665 ( 8030 PWs) bands (ev): -11.0581 -11.0581 -11.0569 -11.0569 -10.6913 -10.6913 -10.6899 -10.6899 -4.0316 -4.0316 -4.0213 -4.0213 -3.5568 -3.5568 -3.5547 -3.5547 -2.5844 -2.5844 -2.5649 -2.5649 -2.0340 -2.0340 -2.0164 -2.0164 -1.6440 -1.6440 -1.6325 -1.6325 -0.6717 -0.6717 -0.6555 -0.6555 0.7327 0.7327 0.7980 0.7980 1.4873 1.4873 1.6421 1.6421 1.8332 1.8332 1.9096 1.9096 2.0923 2.0923 2.1157 2.1157 2.3645 2.3645 2.5127 2.5127 5.7297 5.7297 5.7478 5.7478 8.3302 8.3302 8.3820 8.3820 8.9885 8.9885 k = 0.1318 0.1934 0.1665 ( 8026 PWs) bands (ev): -11.0661 -11.0661 -11.0649 -11.0649 -10.6922 -10.6922 -10.6908 -10.6908 -4.0344 -4.0344 -4.0244 -4.0244 -3.5593 -3.5593 -3.5572 -3.5572 -2.5873 -2.5873 -2.5683 -2.5683 -2.0356 -2.0356 -2.0184 -2.0184 -1.6461 -1.6461 -1.6344 -1.6344 -0.6627 -0.6627 -0.6461 -0.6461 0.7482 0.7482 0.8161 0.8161 1.5206 1.5206 1.6792 1.6792 1.8470 1.8470 1.9272 1.9272 2.1267 2.1267 2.1538 2.1538 2.3682 2.3682 2.5121 2.5121 5.7082 5.7082 5.7257 5.7257 8.3011 8.3011 8.3369 8.3369 8.9459 8.9459 k = 0.1245 0.1826 0.1665 ( 8010 PWs) bands (ev): -11.0737 -11.0737 -11.0726 -11.0726 -10.6931 -10.6931 -10.6918 -10.6918 -4.0370 -4.0370 -4.0273 -4.0273 -3.5617 -3.5617 -3.5597 -3.5597 -2.5901 -2.5901 -2.5717 -2.5717 -2.0370 -2.0370 -2.0202 -2.0202 -1.6483 -1.6483 -1.6364 -1.6364 -0.6536 -0.6536 -0.6369 -0.6369 0.7640 0.7640 0.8339 0.8339 1.5522 1.5522 1.7150 1.7150 1.8635 1.8635 1.9447 1.9447 2.1554 2.1554 2.1939 2.1939 2.3743 2.3743 2.5111 2.5111 5.6860 5.6860 5.7028 5.7028 8.2644 8.2644 8.2863 8.2863 8.9135 8.9135 k = 0.1172 0.1719 0.1665 ( 8018 PWs) bands (ev): -11.0811 -11.0811 -11.0800 -11.0800 -10.6940 -10.6940 -10.6928 -10.6928 -4.0394 -4.0394 -4.0302 -4.0302 -3.5641 -3.5641 -3.5621 -3.5621 -2.5927 -2.5927 -2.5751 -2.5751 -2.0382 -2.0382 -2.0219 -2.0219 -1.6505 -1.6505 -1.6386 -1.6386 -0.6446 -0.6446 -0.6280 -0.6280 0.7799 0.7799 0.8512 0.8512 1.5818 1.5818 1.7492 1.7492 1.8831 1.8831 1.9629 1.9629 2.1785 2.1785 2.2328 2.2328 2.3836 2.3836 2.5104 2.5104 5.6631 5.6631 5.6792 5.6792 8.2194 8.2194 8.2316 8.2316 8.8918 8.8918 k = 0.1099 0.1611 0.1665 ( 8014 PWs) bands (ev): -11.0881 -11.0881 -11.0871 -11.0871 -10.6949 -10.6949 -10.6937 -10.6937 -4.0417 -4.0417 -4.0329 -4.0329 -3.5665 -3.5665 -3.5646 -3.5646 -2.5952 -2.5952 -2.5783 -2.5783 -2.0393 -2.0393 -2.0235 -2.0235 -1.6528 -1.6528 -1.6409 -1.6409 -0.6357 -0.6357 -0.6194 -0.6194 0.7960 0.7960 0.8681 0.8681 1.6092 1.6092 1.7814 1.7814 1.9057 1.9057 1.9823 1.9823 2.1955 2.1955 2.2688 2.2688 2.3972 2.3972 2.5106 2.5106 5.6398 5.6398 5.6552 5.6552 8.1658 8.1658 8.1753 8.1753 8.8804 8.8804 k = 0.1025 0.1504 0.1665 ( 8012 PWs) bands (ev): -11.0948 -11.0948 -11.0939 -11.0939 -10.6958 -10.6958 -10.6946 -10.6946 -4.0438 -4.0438 -4.0355 -4.0355 -3.5687 -3.5687 -3.5669 -3.5669 -2.5976 -2.5976 -2.5815 -2.5815 -2.0401 -2.0401 -2.0250 -2.0250 -1.6550 -1.6550 -1.6432 -1.6432 -0.6271 -0.6271 -0.6113 -0.6113 0.8121 0.8121 0.8842 0.8842 1.6345 1.6345 1.8116 1.8116 1.9308 1.9308 2.0030 2.0030 2.2063 2.2063 2.3004 2.3004 2.4148 2.4148 2.5128 2.5128 5.6164 5.6164 5.6310 5.6310 8.1059 8.1059 8.1178 8.1178 8.8783 8.8783 k = 0.0952 0.1397 0.1665 ( 8006 PWs) bands (ev): -11.1012 -11.1012 -11.1003 -11.1003 -10.6966 -10.6966 -10.6955 -10.6955 -4.0458 -4.0458 -4.0379 -4.0379 -3.5709 -3.5709 -3.5691 -3.5691 -2.5998 -2.5998 -2.5846 -2.5846 -2.0409 -2.0409 -2.0265 -2.0265 -1.6572 -1.6572 -1.6457 -1.6457 -0.6188 -0.6188 -0.6035 -0.6035 0.8282 0.8282 0.8997 0.8997 1.6580 1.6580 1.8398 1.8398 1.9576 1.9576 2.0249 2.0249 2.2120 2.2120 2.3261 2.3261 2.4357 2.4357 2.5182 2.5182 5.5930 5.5930 5.6069 5.6069 8.0439 8.0439 8.0583 8.0583 8.8840 8.8840 k = 0.0879 0.1289 0.1665 ( 8002 PWs) bands (ev): -11.1072 -11.1072 -11.1064 -11.1064 -10.6974 -10.6974 -10.6964 -10.6964 -4.0475 -4.0475 -4.0402 -4.0402 -3.5729 -3.5729 -3.5713 -3.5713 -2.6018 -2.6018 -2.5875 -2.5875 -2.0414 -2.0414 -2.0278 -2.0278 -1.6593 -1.6593 -1.6481 -1.6481 -0.6108 -0.6108 -0.5963 -0.5963 0.8442 0.8442 0.9142 0.9142 1.6799 1.6799 1.8659 1.8659 1.9852 1.9852 2.0474 2.0474 2.2143 2.2143 2.3443 2.3443 2.4587 2.4587 2.5279 2.5279 5.5699 5.5699 5.5829 5.5829 7.9817 7.9817 7.9976 7.9976 8.8960 8.8960 k = 0.0806 0.1182 0.1665 ( 8014 PWs) bands (ev): -11.1127 -11.1127 -11.1120 -11.1120 -10.6981 -10.6981 -10.6972 -10.6972 -4.0492 -4.0492 -4.0424 -4.0424 -3.5749 -3.5749 -3.5733 -3.5733 -2.6036 -2.6036 -2.5904 -2.5904 -2.0419 -2.0419 -2.0291 -2.0291 -1.6613 -1.6613 -1.6505 -1.6505 -0.6033 -0.6033 -0.5897 -0.5897 0.8599 0.8599 0.9277 0.9277 1.7007 1.7007 1.8900 1.8900 2.0129 2.0129 2.0691 2.0691 2.2152 2.2152 2.3547 2.3547 2.4829 2.4829 2.5420 2.5420 5.5473 5.5473 5.5595 5.5595 7.9207 7.9207 7.9372 7.9372 8.9129 8.9129 k = 0.0732 0.1074 0.1665 ( 8016 PWs) bands (ev): -11.1179 -11.1179 -11.1172 -11.1172 -10.6989 -10.6989 -10.6980 -10.6980 -4.0506 -4.0506 -4.0444 -4.0444 -3.5767 -3.5767 -3.5752 -3.5752 -2.6053 -2.6053 -2.5931 -2.5931 -2.0421 -2.0421 -2.0304 -2.0304 -1.6632 -1.6632 -1.6529 -1.6529 -0.5962 -0.5962 -0.5836 -0.5836 0.8754 0.8754 0.9402 0.9402 1.7209 1.7209 1.9120 1.9120 2.0397 2.0397 2.0885 2.0885 2.2170 2.2170 2.3582 2.3582 2.5073 2.5073 2.5593 2.5593 5.5256 5.5256 5.5369 5.5369 7.8621 7.8621 7.8784 7.8784 8.9335 8.9335 k = 0.0659 0.0967 0.1665 ( 8024 PWs) bands (ev): -11.1226 -11.1226 -11.1220 -11.1220 -10.6995 -10.6995 -10.6988 -10.6988 -4.0519 -4.0519 -4.0463 -4.0463 -3.5783 -3.5783 -3.5770 -3.5770 -2.6067 -2.6067 -2.5956 -2.5956 -2.0423 -2.0423 -2.0315 -2.0315 -1.6648 -1.6648 -1.6553 -1.6553 -0.5897 -0.5897 -0.5781 -0.5781 0.8903 0.8903 0.9513 0.9513 1.7407 1.7407 1.9318 1.9318 2.0642 2.0642 2.1046 2.1046 2.2217 2.2217 2.3566 2.3566 2.5313 2.5313 2.5782 2.5782 5.5049 5.5049 5.5153 5.5153 7.8066 7.8066 7.8222 7.8222 8.9566 8.9566 k = 0.0586 0.0859 0.1665 ( 8028 PWs) bands (ev): -11.1268 -11.1268 -11.1263 -11.1263 -10.7001 -10.7001 -10.6994 -10.6994 -4.0530 -4.0530 -4.0480 -4.0480 -3.5798 -3.5798 -3.5787 -3.5787 -2.6080 -2.6080 -2.5980 -2.5980 -2.0424 -2.0424 -2.0326 -2.0326 -1.6663 -1.6663 -1.6575 -1.6575 -0.5837 -0.5837 -0.5733 -0.5733 0.9047 0.9047 0.9611 0.9611 1.7605 1.7605 1.9490 1.9490 2.0835 2.0835 2.1184 2.1184 2.2306 2.2306 2.3516 2.3516 2.5544 2.5544 2.5970 2.5970 5.4855 5.4855 5.4950 5.4950 7.7551 7.7551 7.7696 7.7696 8.9813 8.9813 k = 0.0513 0.0752 0.1665 ( 8022 PWs) bands (ev): -11.1306 -11.1306 -11.1301 -11.1301 -10.7006 -10.7006 -10.7001 -10.7001 -4.0540 -4.0540 -4.0495 -4.0495 -3.5812 -3.5812 -3.5801 -3.5801 -2.6090 -2.6090 -2.6002 -2.6002 -2.0423 -2.0423 -2.0337 -2.0337 -1.6676 -1.6676 -1.6596 -1.6596 -0.5783 -0.5783 -0.5690 -0.5690 0.9183 0.9183 0.9695 0.9695 1.7803 1.7803 1.9630 1.9630 2.0946 2.0946 2.1335 2.1335 2.2427 2.2427 2.3449 2.3449 2.5759 2.5759 2.6146 2.6146 5.4678 5.4678 5.4762 5.4762 7.7083 7.7083 7.7213 7.7213 9.0066 9.0066 k = 0.0439 0.0645 0.1665 ( 8034 PWs) bands (ev): -11.1339 -11.1339 -11.1335 -11.1335 -10.7011 -10.7011 -10.7006 -10.7006 -4.0548 -4.0548 -4.0509 -4.0509 -3.5823 -3.5823 -3.5814 -3.5814 -2.6098 -2.6098 -2.6022 -2.6022 -2.0422 -2.0422 -2.0347 -2.0347 -1.6686 -1.6686 -1.6616 -1.6616 -0.5735 -0.5735 -0.5655 -0.5655 0.9311 0.9311 0.9763 0.9763 1.8003 1.8003 1.9725 1.9725 2.0999 2.0999 2.1494 2.1494 2.2564 2.2564 2.3376 2.3376 2.5957 2.5957 2.6303 2.6303 5.4519 5.4519 5.4592 5.4592 7.6666 7.6666 7.6781 7.6781 9.0318 9.0318 k = 0.0366 0.0537 0.1665 ( 8024 PWs) bands (ev): -11.1367 -11.1367 -11.1364 -11.1364 -10.7015 -10.7015 -10.7011 -10.7011 -4.0554 -4.0554 -4.0521 -4.0521 -3.5833 -3.5833 -3.5826 -3.5826 -2.6104 -2.6104 -2.6040 -2.6040 -2.0419 -2.0419 -2.0356 -2.0356 -1.6694 -1.6694 -1.6635 -1.6635 -0.5693 -0.5693 -0.5626 -0.5626 0.9428 0.9428 0.9815 0.9815 1.8205 1.8205 1.9764 1.9764 2.1043 2.1043 2.1630 2.1630 2.2699 2.2699 2.3310 2.3310 2.6135 2.6135 2.6435 2.6435 5.4381 5.4381 5.4443 5.4443 7.6307 7.6307 7.6404 7.6404 9.0559 9.0559 k = 0.0293 0.0430 0.1665 ( 8014 PWs) bands (ev): -11.1390 -11.1390 -11.1387 -11.1387 -10.7018 -10.7018 -10.7015 -10.7015 -4.0558 -4.0558 -4.0532 -4.0532 -3.5841 -3.5841 -3.5835 -3.5835 -2.6107 -2.6107 -2.6056 -2.6056 -2.0416 -2.0416 -2.0365 -2.0365 -1.6699 -1.6699 -1.6651 -1.6651 -0.5657 -0.5657 -0.5603 -0.5603 0.9534 0.9534 0.9851 0.9851 1.8408 1.8408 1.9741 1.9741 2.1109 2.1109 2.1719 2.1719 2.2821 2.2821 2.3257 2.3257 2.6290 2.6290 2.6540 2.6540 5.4266 5.4266 5.4316 5.4316 7.6010 7.6010 7.6088 7.6088 9.0783 9.0783 k = 0.0220 0.0322 0.1665 ( 8020 PWs) bands (ev): -11.1408 -11.1408 -11.1406 -11.1406 -10.7021 -10.7021 -10.7018 -10.7018 -4.0561 -4.0561 -4.0541 -4.0541 -3.5848 -3.5848 -3.5843 -3.5843 -2.6109 -2.6109 -2.6070 -2.6070 -2.0412 -2.0412 -2.0374 -2.0374 -1.6702 -1.6702 -1.6665 -1.6665 -0.5627 -0.5627 -0.5587 -0.5587 0.9628 0.9628 0.9869 0.9869 1.8612 1.8612 1.9659 1.9659 2.1204 2.1204 2.1751 2.1751 2.2926 2.2926 2.3221 2.3221 2.6421 2.6421 2.6615 2.6615 5.4176 5.4176 5.4214 5.4214 7.5777 7.5777 7.5836 7.5836 9.0981 9.0981 k = 0.0146 0.0215 0.1665 ( 8024 PWs) bands (ev): -11.1421 -11.1421 -11.1419 -11.1419 -10.7022 -10.7022 -10.7021 -10.7021 -4.0562 -4.0562 -4.0549 -4.0549 -3.5852 -3.5852 -3.5849 -3.5849 -2.6108 -2.6108 -2.6082 -2.6082 -2.0407 -2.0407 -2.0381 -2.0381 -1.6702 -1.6702 -1.6677 -1.6677 -0.5604 -0.5604 -0.5577 -0.5577 0.9707 0.9707 0.9870 0.9870 1.8814 1.8814 1.9534 1.9534 2.1318 2.1318 2.1727 2.1727 2.3012 2.3012 2.3195 2.3195 2.6526 2.6526 2.6659 2.6659 5.4112 5.4112 5.4138 5.4138 7.5611 7.5611 7.5651 7.5651 9.1149 9.1149 k = 0.0073 0.0107 0.1665 ( 8024 PWs) bands (ev): -11.1428 -11.1428 -11.1428 -11.1428 -10.7023 -10.7023 -10.7022 -10.7022 -4.0561 -4.0561 -4.0554 -4.0554 -3.5854 -3.5854 -3.5852 -3.5852 -2.6105 -2.6105 -2.6092 -2.6092 -2.0402 -2.0402 -2.0389 -2.0389 -1.6700 -1.6700 -1.6687 -1.6687 -0.5588 -0.5588 -0.5574 -0.5574 0.9772 0.9772 0.9854 0.9854 1.9012 1.9012 1.9378 1.9378 2.1440 2.1440 2.1658 2.1658 2.3081 2.3081 2.3169 2.3169 2.6604 2.6604 2.6671 2.6671 5.4076 5.4076 5.4089 5.4089 7.5515 7.5515 7.5535 7.5535 9.1281 9.1281 k = 0.0000 0.0000 0.1665 ( 8032 PWs) bands (ev): -11.1431 -11.1431 -11.1431 -11.1431 -10.7023 -10.7023 -10.7023 -10.7023 -4.0559 -4.0559 -4.0559 -4.0559 -3.5854 -3.5854 -3.5854 -3.5854 -2.6099 -2.6099 -2.6099 -2.6099 -2.0395 -2.0395 -2.0395 -2.0395 -1.6695 -1.6695 -1.6695 -1.6695 -0.5578 -0.5578 -0.5578 -0.5578 0.9821 0.9821 0.9821 0.9821 1.9201 1.9201 1.9201 1.9201 2.1558 2.1558 2.1558 2.1558 2.3133 2.3133 2.3133 2.3133 2.6653 2.6653 2.6653 2.6653 5.4068 5.4068 5.4068 5.4068 7.5490 7.5490 7.5490 7.5490 9.1373 9.1373 k = 0.0000 0.0000 0.1665 ( 8032 PWs) bands (ev): -11.1431 -11.1431 -11.1431 -11.1431 -10.7023 -10.7023 -10.7023 -10.7023 -4.0559 -4.0559 -4.0559 -4.0559 -3.5854 -3.5854 -3.5854 -3.5854 -2.6099 -2.6099 -2.6099 -2.6099 -2.0395 -2.0395 -2.0395 -2.0395 -1.6695 -1.6695 -1.6695 -1.6695 -0.5578 -0.5578 -0.5578 -0.5578 0.9821 0.9821 0.9821 0.9821 1.9201 1.9201 1.9201 1.9201 2.1558 2.1558 2.1558 2.1558 2.3133 2.3133 2.3133 2.3133 2.6653 2.6653 2.6653 2.6653 5.4068 5.4068 5.4068 5.4068 7.5490 7.5490 7.5490 7.5490 9.1373 9.1373 k = 0.0000 0.0000 0.1537 ( 8029 PWs) bands (ev): -11.1525 -11.1525 -11.1332 -11.1332 -10.7141 -10.7141 -10.6910 -10.6910 -4.0584 -4.0584 -4.0533 -4.0533 -3.5857 -3.5857 -3.5851 -3.5851 -2.6159 -2.6159 -2.6040 -2.6040 -2.0405 -2.0405 -2.0385 -2.0385 -1.6702 -1.6702 -1.6687 -1.6687 -0.5708 -0.5708 -0.5440 -0.5440 0.9508 0.9508 1.0115 1.0115 1.9044 1.9044 1.9367 1.9367 2.1501 2.1501 2.1629 2.1629 2.3078 2.3078 2.3194 2.3194 2.6612 2.6612 2.6685 2.6685 5.3419 5.3419 5.4719 5.4719 7.5425 7.5425 7.5545 7.5545 9.1331 9.1331 k = 0.0000 0.0000 0.1409 ( 8023 PWs) bands (ev): -11.1613 -11.1613 -11.1228 -11.1228 -10.7263 -10.7263 -10.6803 -10.6803 -4.0609 -4.0609 -4.0509 -4.0509 -3.5860 -3.5860 -3.5848 -3.5848 -2.6217 -2.6217 -2.5981 -2.5981 -2.0415 -2.0415 -2.0375 -2.0375 -1.6710 -1.6710 -1.6679 -1.6679 -0.5829 -0.5829 -0.5296 -0.5296 0.9182 0.9182 1.0386 1.0386 1.8898 1.8898 1.9533 1.9533 2.1460 2.1460 2.1715 2.1715 2.3030 2.3030 2.3261 2.3261 2.6564 2.6564 2.6708 2.6708 5.2779 5.2779 5.5363 5.5363 7.5351 7.5351 7.5589 7.5589 9.1288 9.1288 k = 0.0000 0.0000 0.1281 ( 8031 PWs) bands (ev): -11.1695 -11.1695 -11.1122 -11.1122 -10.7387 -10.7387 -10.6703 -10.6703 -4.0633 -4.0633 -4.0485 -4.0485 -3.5863 -3.5863 -3.5845 -3.5845 -2.6274 -2.6274 -2.5924 -2.5924 -2.0424 -2.0424 -2.0365 -2.0365 -1.6717 -1.6717 -1.6671 -1.6671 -0.5942 -0.5942 -0.5147 -0.5147 0.8847 0.8847 1.0633 1.0633 1.8769 1.8769 1.9691 1.9691 2.1432 2.1432 2.1813 2.1813 2.2989 2.2989 2.3337 2.3337 2.6512 2.6512 2.6719 2.6719 5.2157 5.2157 5.5993 5.5993 7.5271 7.5271 7.5621 7.5621 9.1244 9.1244 k = 0.0000 0.0000 0.1153 ( 8015 PWs) bands (ev): -11.1771 -11.1771 -11.1013 -11.1013 -10.7513 -10.7513 -10.6610 -10.6610 -4.0657 -4.0657 -4.0463 -4.0463 -3.5866 -3.5866 -3.5842 -3.5842 -2.6328 -2.6328 -2.5869 -2.5869 -2.0432 -2.0432 -2.0355 -2.0355 -1.6723 -1.6723 -1.6664 -1.6664 -0.6044 -0.6044 -0.4996 -0.4996 0.8511 0.8511 1.0852 1.0852 1.8658 1.8658 1.9833 1.9833 2.1420 2.1420 2.1923 2.1923 2.2956 2.2956 2.3425 2.3425 2.6456 2.6456 2.6718 2.6718 5.1559 5.1559 5.6600 5.6600 7.5186 7.5186 7.5642 7.5642 9.1201 9.1201 k = 0.0000 0.0000 0.1024 ( 8011 PWs) bands (ev): -11.1840 -11.1840 -11.0904 -11.0904 -10.7639 -10.7639 -10.6525 -10.6525 -4.0679 -4.0679 -4.0442 -4.0442 -3.5868 -3.5868 -3.5840 -3.5840 -2.6379 -2.6379 -2.5818 -2.5818 -2.0440 -2.0440 -2.0346 -2.0346 -1.6729 -1.6729 -1.6656 -1.6656 -0.6135 -0.6135 -0.4845 -0.4845 0.8181 0.8181 1.1045 1.1045 1.8564 1.8564 1.9952 1.9952 2.1419 2.1419 2.2038 2.2038 2.2934 2.2934 2.3529 2.3529 2.6399 2.6399 2.6702 2.6702 5.0995 5.0995 5.7177 5.7177 7.5098 7.5098 7.5652 7.5652 9.1159 9.1159 k = 0.0000 0.0000 0.0896 ( 8011 PWs) bands (ev): -11.1901 -11.1901 -11.0795 -11.0795 -10.7762 -10.7762 -10.6449 -10.6449 -4.0700 -4.0700 -4.0423 -4.0423 -3.5871 -3.5871 -3.5837 -3.5837 -2.6425 -2.6425 -2.5771 -2.5771 -2.0447 -2.0447 -2.0337 -2.0337 -1.6735 -1.6735 -1.6650 -1.6650 -0.6216 -0.6216 -0.4697 -0.4697 0.7863 0.7863 1.1210 1.1210 1.8488 1.8488 2.0045 2.0045 2.1427 2.1427 2.2150 2.2150 2.2923 2.2923 2.3654 2.3654 2.6340 2.6340 2.6671 2.6671 5.0471 5.0471 5.7714 5.7714 7.5011 7.5011 7.5652 7.5652 9.1118 9.1118 k = 0.0000 0.0000 0.0768 ( 8023 PWs) bands (ev): -11.1955 -11.1955 -11.0689 -11.0689 -10.7881 -10.7881 -10.6382 -10.6382 -4.0719 -4.0719 -4.0406 -4.0406 -3.5873 -3.5873 -3.5835 -3.5835 -2.6467 -2.6467 -2.5728 -2.5728 -2.0453 -2.0453 -2.0329 -2.0329 -1.6740 -1.6740 -1.6643 -1.6643 -0.6287 -0.6287 -0.4557 -0.4557 0.7566 0.7566 1.1350 1.1350 1.8427 1.8427 2.0114 2.0114 2.1442 2.1442 2.2249 2.2249 2.2923 2.2923 2.3803 2.3803 2.6282 2.6282 2.6626 2.6626 4.9997 4.9997 5.8204 5.8204 7.4926 7.4926 7.5645 7.5645 9.1081 9.1081 k = 0.0000 0.0000 0.0640 ( 8009 PWs) bands (ev): -11.2000 -11.2000 -11.0589 -11.0589 -10.7993 -10.7993 -10.6324 -10.6324 -4.0735 -4.0735 -4.0391 -4.0391 -3.5874 -3.5874 -3.5833 -3.5833 -2.6503 -2.6503 -2.5691 -2.5691 -2.0459 -2.0459 -2.0322 -2.0322 -1.6744 -1.6744 -1.6638 -1.6638 -0.6346 -0.6346 -0.4427 -0.4427 0.7298 0.7298 1.1464 1.1464 1.8379 1.8379 2.0162 2.0162 2.1457 2.1457 2.2328 2.2328 2.2933 2.2933 2.3976 2.3976 2.6223 2.6223 2.6569 2.6569 4.9580 4.9580 5.8637 5.8637 7.4846 7.4846 7.5633 7.5633 9.1047 9.1047 k = 0.0000 0.0000 0.0512 ( 8009 PWs) bands (ev): -11.2038 -11.2038 -11.0498 -11.0498 -10.8093 -10.8093 -10.6276 -10.6276 -4.0749 -4.0749 -4.0379 -4.0379 -3.5876 -3.5876 -3.5832 -3.5832 -2.6533 -2.6533 -2.5660 -2.5660 -2.0463 -2.0463 -2.0316 -2.0316 -1.6747 -1.6747 -1.6633 -1.6633 -0.6395 -0.6395 -0.4313 -0.4313 0.7065 0.7065 1.1555 1.1555 1.8344 1.8344 2.0194 2.0194 2.1472 2.1472 2.2386 2.2386 2.2947 2.2947 2.4164 2.4164 2.6163 2.6163 2.6505 2.6505 4.9226 4.9226 5.9005 5.9005 7.4776 7.4776 7.5618 7.5618 9.1019 9.1019 k = 0.0000 0.0000 0.0384 ( 8021 PWs) bands (ev): -11.2068 -11.2068 -11.0420 -11.0420 -10.8179 -10.8179 -10.6239 -10.6239 -4.0760 -4.0760 -4.0369 -4.0369 -3.5877 -3.5877 -3.5831 -3.5831 -2.6557 -2.6557 -2.5635 -2.5635 -2.0467 -2.0467 -2.0311 -2.0311 -1.6750 -1.6750 -1.6630 -1.6630 -0.6432 -0.6432 -0.4219 -0.4219 0.6876 0.6876 1.1624 1.1624 1.8319 1.8319 2.0214 2.0214 2.1485 2.1485 2.2426 2.2426 2.2962 2.2962 2.4353 2.4353 2.6100 2.6100 2.6442 2.6442 4.8944 4.8944 5.9301 5.9301 7.4717 7.4717 7.5604 7.5604 9.0995 9.0995 k = 0.0000 0.0000 0.0256 ( 8011 PWs) bands (ev): -11.2089 -11.2089 -11.0360 -11.0360 -10.8245 -10.8245 -10.6212 -10.6212 -4.0768 -4.0768 -4.0362 -4.0362 -3.5878 -3.5878 -3.5830 -3.5830 -2.6575 -2.6575 -2.5617 -2.5617 -2.0469 -2.0469 -2.0308 -2.0308 -1.6752 -1.6752 -1.6627 -1.6627 -0.6459 -0.6459 -0.4148 -0.4148 0.6736 0.6736 1.1672 1.1672 1.8302 1.8302 2.0226 2.0226 2.1493 2.1493 2.2452 2.2452 2.2975 2.2975 2.4521 2.4521 2.6038 2.6038 2.6390 2.6390 4.8738 4.8738 5.9518 5.9518 7.4672 7.4672 7.5591 7.5591 9.0978 9.0978 k = 0.0000 0.0000 0.0128 ( 8017 PWs) bands (ev): -11.2102 -11.2102 -11.0322 -11.0322 -10.8287 -10.8287 -10.6196 -10.6196 -4.0773 -4.0773 -4.0358 -4.0358 -3.5879 -3.5879 -3.5829 -3.5829 -2.6585 -2.6585 -2.5607 -2.5607 -2.0471 -2.0471 -2.0305 -2.0305 -1.6753 -1.6753 -1.6625 -1.6625 -0.6476 -0.6476 -0.4104 -0.4104 0.6650 0.6650 1.1701 1.1701 1.8293 1.8293 2.0232 2.0232 2.1498 2.1498 2.2466 2.2466 2.2983 2.2983 2.4641 2.4641 2.5986 2.5986 2.6357 2.6357 4.8612 4.8612 5.9651 5.9651 7.4644 7.4644 7.5583 7.5583 9.0968 9.0968 k = 0.0000 0.0000 0.0000 ( 8023 PWs) bands (ev): -11.2106 -11.2106 -11.0308 -11.0308 -10.8301 -10.8301 -10.6191 -10.6191 -4.0774 -4.0774 -4.0356 -4.0356 -3.5879 -3.5879 -3.5829 -3.5829 -2.6589 -2.6589 -2.5603 -2.5603 -2.0471 -2.0471 -2.0305 -2.0305 -1.6754 -1.6754 -1.6625 -1.6625 -0.6481 -0.6481 -0.4089 -0.4089 0.6621 0.6621 1.1710 1.1710 1.8290 1.8290 2.0234 2.0234 2.1500 2.1500 2.2471 2.2471 2.2986 2.2986 2.4686 2.4686 2.5965 2.5965 2.6346 2.6346 4.8570 4.8570 5.9695 5.9695 7.4635 7.4635 7.5581 7.5581 9.0964 9.0964 k = 0.0000 0.0000 0.0000 ( 8023 PWs) bands (ev): -11.2106 -11.2106 -11.0308 -11.0308 -10.8301 -10.8301 -10.6191 -10.6191 -4.0774 -4.0774 -4.0356 -4.0356 -3.5879 -3.5879 -3.5829 -3.5829 -2.6589 -2.6589 -2.5603 -2.5603 -2.0471 -2.0471 -2.0305 -2.0305 -1.6754 -1.6754 -1.6625 -1.6625 -0.6481 -0.6481 -0.4089 -0.4089 0.6621 0.6621 1.1710 1.1710 1.8290 1.8290 2.0234 2.0234 2.1500 2.1500 2.2471 2.2471 2.2986 2.2986 2.4686 2.4686 2.5965 2.5965 2.6346 2.6346 4.8570 4.8570 5.9695 5.9695 7.4635 7.4635 7.5581 7.5581 9.0964 9.0964 k =-0.0109 0.0074 0.0000 ( 8013 PWs) bands (ev): -11.2101 -11.2101 -11.0305 -11.0305 -10.8300 -10.8300 -10.6191 -10.6191 -4.0774 -4.0770 -4.0356 -4.0352 -3.5878 -3.5878 -3.5828 -3.5828 -2.6588 -2.6583 -2.5604 -2.5598 -2.0470 -2.0469 -2.0303 -2.0303 -1.6756 -1.6754 -1.6628 -1.6625 -0.6483 -0.6482 -0.4103 -0.4101 0.6619 0.6628 1.1671 1.1728 1.8221 1.8321 2.0210 2.0249 2.1481 2.1482 2.2453 2.2472 2.2968 2.2970 2.4681 2.4686 2.5898 2.6004 2.6294 2.6368 4.8609 4.8610 5.9690 5.9696 7.4651 7.4695 7.5593 7.5638 9.0931 9.1023 k =-0.0217 0.0148 0.0000 ( 8017 PWs) bands (ev): -11.2089 -11.2089 -11.0294 -11.0294 -10.8297 -10.8297 -10.6192 -10.6192 -4.0770 -4.0762 -4.0351 -4.0344 -3.5875 -3.5875 -3.5826 -3.5826 -2.6580 -2.6570 -2.5600 -2.5589 -2.0465 -2.0464 -2.0298 -2.0298 -1.6762 -1.6757 -1.6634 -1.6629 -0.6489 -0.6487 -0.4143 -0.4138 0.6623 0.6641 1.1610 1.1724 1.8117 1.8316 2.0174 2.0256 2.1425 2.1428 2.2418 2.2460 2.2916 2.2923 2.4670 2.4681 2.5804 2.6009 2.6221 2.6362 4.8728 4.8728 5.9679 5.9692 7.4742 7.4830 7.5677 7.5766 9.0930 9.1097 k =-0.0326 0.0222 0.0000 ( 8015 PWs) bands (ev): -11.2067 -11.2067 -11.0277 -11.0277 -10.8293 -10.8293 -10.6195 -10.6195 -4.0762 -4.0750 -4.0342 -4.0331 -3.5871 -3.5871 -3.5822 -3.5822 -2.6566 -2.6550 -2.5591 -2.5575 -2.0456 -2.0455 -2.0289 -2.0289 -1.6771 -1.6764 -1.6644 -1.6637 -0.6498 -0.6496 -0.4207 -0.4201 0.6631 0.6659 1.1527 1.1698 1.7977 1.8275 2.0125 2.0256 2.1335 2.1340 2.2367 2.2437 2.2831 2.2845 2.4651 2.4670 2.5684 2.5958 2.6149 2.6329 4.8922 4.8922 5.9664 5.9683 7.4907 7.5037 7.5829 7.5960 9.0968 9.1185 k =-0.0435 0.0296 0.0000 ( 8003 PWs) bands (ev): -11.2037 -11.2037 -11.0253 -11.0253 -10.8287 -10.8286 -10.6198 -10.6198 -4.0749 -4.0734 -4.0329 -4.0314 -3.5865 -3.5865 -3.5816 -3.5816 -2.6544 -2.6523 -2.5579 -2.5556 -2.0445 -2.0444 -2.0276 -2.0276 -1.6783 -1.6773 -1.6658 -1.6648 -0.6511 -0.6507 -0.4295 -0.4288 0.6641 0.6680 1.1422 1.1649 1.7805 1.8199 2.0061 2.0248 2.1213 2.1223 2.2300 2.2406 2.2712 2.2737 2.4620 2.4650 2.5537 2.5831 2.6102 2.6273 4.9189 4.9190 5.9643 5.9669 7.5143 7.5313 7.6050 7.6218 9.1047 9.1291 k =-0.0543 0.0371 0.0000 ( 8009 PWs) bands (ev): -11.1999 -11.1999 -11.0222 -11.0222 -10.8278 -10.8278 -10.6201 -10.6201 -4.0733 -4.0714 -4.0311 -4.0293 -3.5858 -3.5858 -3.5809 -3.5809 -2.6517 -2.6491 -2.5562 -2.5534 -2.0430 -2.0428 -2.0261 -2.0260 -1.6797 -1.6785 -1.6675 -1.6662 -0.6527 -0.6521 -0.4405 -0.4398 0.6652 0.6702 1.1297 1.1579 1.7605 1.8088 1.9980 2.0230 2.1063 2.1080 2.2219 2.2367 2.2564 2.2605 2.4574 2.4616 2.5362 2.5645 2.6066 2.6202 4.9524 4.9527 5.9615 5.9648 7.5448 7.5653 7.6335 7.6536 9.1169 9.1422 k =-0.0652 0.0445 0.0000 ( 8023 PWs) bands (ev): -11.1953 -11.1953 -11.0185 -11.0185 -10.8268 -10.8268 -10.6206 -10.6206 -4.0712 -4.0690 -4.0289 -4.0268 -3.5849 -3.5849 -3.5801 -3.5800 -2.6483 -2.6452 -2.5541 -2.5507 -2.0412 -2.0410 -2.0242 -2.0241 -1.6814 -1.6799 -1.6695 -1.6680 -0.6547 -0.6538 -0.4536 -0.4530 0.6660 0.6722 1.1151 1.1486 1.7380 1.7946 1.9881 2.0192 2.0890 2.0921 2.2117 2.2302 2.2397 2.2472 2.4504 2.4563 2.5163 2.5420 2.6033 2.6123 4.9921 4.9927 5.9580 5.9620 7.5815 7.6051 7.6680 7.6908 9.1333 9.1582 k =-0.0761 0.0519 0.0000 ( 8013 PWs) bands (ev): -11.1898 -11.1898 -11.0141 -11.0141 -10.8257 -10.8257 -10.6212 -10.6212 -4.0688 -4.0662 -4.0263 -4.0239 -3.5839 -3.5839 -3.5791 -3.5791 -2.6444 -2.6407 -2.5516 -2.5477 -2.0391 -2.0389 -2.0220 -2.0219 -1.6834 -1.6816 -1.6717 -1.6700 -0.6570 -0.6558 -0.4685 -0.4681 0.6662 0.6736 1.0986 1.1371 1.7139 1.7775 1.9763 2.0123 2.0700 2.0759 2.1977 2.2150 2.2236 2.2399 2.4404 2.4482 2.4940 2.5164 2.6003 2.6045 5.0374 5.0383 5.9536 5.9585 7.6241 7.6501 7.7081 7.7326 9.1540 9.1774 k =-0.0870 0.0593 0.0000 ( 7987 PWs) bands (ev): -11.1836 -11.1836 -11.0091 -11.0091 -10.8243 -10.8243 -10.6218 -10.6218 -4.0660 -4.0631 -4.0233 -4.0205 -3.5828 -3.5827 -3.5780 -3.5780 -2.6399 -2.6357 -2.5487 -2.5442 -2.0366 -2.0364 -2.0194 -2.0193 -1.6855 -1.6835 -1.6743 -1.6722 -0.6597 -0.6579 -0.4849 -0.4849 0.6653 0.6741 1.0803 1.1233 1.6890 1.7581 1.9621 1.9999 2.0504 2.0616 2.1776 2.1923 2.2108 2.2374 2.4265 2.4360 2.4698 2.4891 2.5978 2.5981 5.0875 5.0888 5.9482 5.9540 7.6719 7.6996 7.7529 7.7782 9.1787 9.1997 k =-0.0978 0.0667 0.0000 ( 7989 PWs) bands (ev): -11.1766 -11.1766 -11.0035 -11.0035 -10.8228 -10.8228 -10.6225 -10.6225 -4.0629 -4.0596 -4.0200 -4.0169 -3.5815 -3.5815 -3.5768 -3.5768 -2.6350 -2.6302 -2.5455 -2.5404 -2.0339 -2.0337 -2.0166 -2.0165 -1.6879 -1.6856 -1.6770 -1.6747 -0.6627 -0.6602 -0.5033 -0.5027 0.6631 0.6731 1.0605 1.1072 1.6639 1.7370 1.9446 1.9805 2.0312 2.0508 2.1523 2.1653 2.2008 2.2368 2.4078 2.4180 2.4445 2.4621 2.5928 2.5970 5.1417 5.1435 5.9418 5.9485 7.7241 7.7528 7.8017 7.8267 9.2074 9.2249 k =-0.1087 0.0741 0.0000 ( 7985 PWs) bands (ev): -11.1688 -11.1688 -10.9973 -10.9973 -10.8211 -10.8211 -10.6233 -10.6233 -4.0594 -4.0558 -4.0162 -4.0128 -3.5801 -3.5801 -3.5755 -3.5755 -2.6296 -2.6243 -2.5419 -2.5363 -2.0308 -2.0306 -2.0135 -2.0133 -1.6905 -1.6878 -1.6799 -1.6773 -0.6661 -0.6627 -0.5229 -0.5215 0.6590 0.6700 1.0394 1.0889 1.6397 1.7152 1.9231 1.9547 2.0138 2.0425 2.1238 2.1348 2.1922 2.2370 2.3841 2.3925 2.4189 2.4374 2.5897 2.5972 5.1991 5.2016 5.9341 5.9419 7.7802 7.8087 7.8535 7.8768 9.2397 9.2526 k =-0.1196 0.0815 0.0000 ( 7981 PWs) bands (ev): -11.1604 -11.1604 -10.9906 -10.9906 -10.8193 -10.8193 -10.6242 -10.6242 -4.0555 -4.0517 -4.0121 -4.0084 -3.5787 -3.5786 -3.5741 -3.5741 -2.6238 -2.6179 -2.5381 -2.5320 -2.0275 -2.0274 -2.0101 -2.0099 -1.6932 -1.6902 -1.6830 -1.6801 -0.6698 -0.6653 -0.5435 -0.5410 0.6525 0.6643 1.0173 1.0684 1.6171 1.6934 1.8971 1.9239 1.9986 2.0349 2.0937 2.1009 2.1839 2.2375 2.3559 2.3606 2.3932 2.4149 2.5886 2.5987 5.2589 5.2621 5.9252 5.9341 7.8391 7.8665 7.9072 7.9274 9.2753 9.2826 k =-0.1304 0.0889 0.0000 ( 7997 PWs) bands (ev): -11.1513 -11.1512 -10.9834 -10.9834 -10.8173 -10.8173 -10.6251 -10.6251 -4.0514 -4.0473 -4.0077 -4.0038 -3.5772 -3.5771 -3.5726 -3.5726 -2.6177 -2.6113 -2.5341 -2.5273 -2.0240 -2.0238 -2.0065 -2.0062 -1.6960 -1.6927 -1.6862 -1.6830 -0.6741 -0.6679 -0.5649 -0.5607 0.6435 0.6555 0.9943 1.0456 1.5969 1.6726 1.8669 1.8892 1.9856 2.0249 2.0639 2.0642 2.1751 2.2374 2.3248 2.3255 2.3674 2.3930 2.5892 2.6013 5.3202 5.3244 5.9150 5.9250 7.9001 7.9245 7.9621 7.9771 9.3137 9.3143 k =-0.1413 0.0963 0.0000 ( 7991 PWs) bands (ev): -11.1415 -11.1414 -10.9757 -10.9757 -10.8152 -10.8151 -10.6262 -10.6261 -4.0469 -4.0425 -4.0030 -3.9988 -3.5756 -3.5755 -3.5712 -3.5711 -2.6114 -2.6045 -2.5298 -2.5225 -2.0202 -2.0200 -2.0027 -2.0024 -1.6988 -1.6953 -1.6895 -1.6860 -0.6789 -0.6705 -0.5866 -0.5803 0.6314 0.6432 0.9707 1.0207 1.5799 1.6534 1.8332 1.8514 1.9740 2.0062 2.0243 2.0413 2.1645 2.2351 2.2900 2.2927 2.3420 2.3708 2.5911 2.6050 5.3821 5.3874 5.9033 5.9147 7.9620 7.9806 8.0180 8.0246 9.3472 9.3544 k =-0.1522 0.1037 0.0000 ( 8005 PWs) bands (ev): -11.1310 -11.1310 -10.9676 -10.9676 -10.8129 -10.8128 -10.6273 -10.6272 -4.0422 -4.0375 -3.9980 -3.9935 -3.5740 -3.5738 -3.5696 -3.5695 -2.6049 -2.5974 -2.5254 -2.5175 -2.0162 -2.0160 -1.9987 -1.9983 -1.7017 -1.6980 -1.6927 -1.6890 -0.6846 -0.6731 -0.6086 -0.5992 0.6163 0.6272 0.9464 0.9936 1.5664 1.6367 1.7968 1.8110 1.9625 1.9761 1.9830 2.0274 2.1505 2.2255 2.2567 2.2637 2.3186 2.3486 2.5942 2.6094 5.4437 5.4504 5.8903 5.9030 8.0232 8.0314 8.0690 8.0755 9.3810 9.3965 k =-0.1630 0.1112 0.0000 ( 7999 PWs) bands (ev): -11.1201 -11.1200 -10.9591 -10.9590 -10.8104 -10.8104 -10.6284 -10.6284 -4.0372 -4.0323 -3.9927 -3.9880 -3.5723 -3.5721 -3.5681 -3.5680 -2.5983 -2.5902 -2.5209 -2.5124 -2.0120 -2.0119 -1.9945 -1.9940 -1.7046 -1.7007 -1.6959 -1.6920 -0.6914 -0.6756 -0.6303 -0.6167 0.5981 0.6075 0.9213 0.9644 1.5567 1.6229 1.7582 1.7682 1.9343 1.9408 1.9565 2.0153 2.1317 2.2021 2.2279 2.2416 2.3009 2.3271 2.5980 2.6144 5.5040 5.5125 5.8758 5.8902 8.0744 8.0794 8.1121 8.1347 9.4152 9.4388 k =-0.1739 0.1186 0.0000 ( 7987 PWs) bands (ev): -11.1085 -11.1085 -10.9502 -10.9502 -10.8079 -10.8078 -10.6297 -10.6296 -4.0319 -4.0268 -3.9873 -3.9823 -3.5707 -3.5704 -3.5666 -3.5664 -2.5917 -2.5830 -2.5164 -2.5073 -2.0076 -2.0075 -1.9902 -1.9896 -1.7074 -1.7034 -1.6990 -1.6949 -0.6999 -0.6779 -0.6517 -0.6319 0.5769 0.5843 0.8952 0.9332 1.5509 1.6125 1.7178 1.7234 1.8889 1.9036 1.9453 2.0003 2.1092 2.1699 2.2036 2.2190 2.2919 2.3074 2.6025 2.6198 5.5620 5.5727 5.8600 5.8764 8.1087 8.1210 8.1614 8.1943 9.4494 9.4796 k =-0.1848 0.1260 0.0000 ( 7985 PWs) bands (ev): -11.0965 -11.0965 -10.9410 -10.9410 -10.8051 -10.8051 -10.6310 -10.6309 -4.0264 -4.0211 -3.9816 -3.9765 -3.5690 -3.5687 -3.5650 -3.5648 -2.5851 -2.5759 -2.5120 -2.5022 -2.0032 -2.0030 -1.9857 -1.9852 -1.7101 -1.7061 -1.7019 -1.6978 -0.7103 -0.6808 -0.6716 -0.6444 0.5530 0.5581 0.8676 0.9001 1.5486 1.6054 1.6760 1.6770 1.8413 1.8654 1.9341 1.9792 2.0872 2.1357 2.1814 2.1918 2.2897 2.2909 2.6074 2.6254 5.6165 5.6301 5.8431 5.8621 8.1337 8.1470 8.2161 8.2528 9.4833 9.5172 k =-0.1957 0.1334 0.0000 ( 7979 PWs) bands (ev): -11.0841 -11.0840 -10.9315 -10.9315 -10.8023 -10.8022 -10.6323 -10.6323 -4.0208 -4.0152 -3.9759 -3.9705 -3.5674 -3.5670 -3.5635 -3.5632 -2.5786 -2.5688 -2.5076 -2.4972 -1.9986 -1.9985 -1.9812 -1.9806 -1.7126 -1.7087 -1.7047 -1.7006 -0.7225 -0.6936 -0.6804 -0.6538 0.5269 0.5296 0.8384 0.8653 1.5492 1.6010 1.6292 1.6332 1.7931 1.8269 1.9215 1.9504 2.0697 2.1024 2.1581 2.1616 2.2784 2.2910 2.6125 2.6312 5.6656 5.6835 5.8255 5.8483 8.1495 8.1625 8.2697 8.3090 9.5163 9.5509 k =-0.2065 0.1408 0.0000 ( 7985 PWs) bands (ev): -11.0712 -11.0712 -10.9218 -10.9218 -10.7993 -10.7993 -10.6338 -10.6337 -4.0149 -4.0091 -3.9700 -3.9644 -3.5658 -3.5653 -3.5620 -3.5617 -2.5724 -2.5620 -2.5035 -2.4924 -1.9939 -1.9938 -1.9766 -1.9759 -1.7150 -1.7112 -1.7072 -1.7032 -0.7359 -0.7119 -0.6821 -0.6606 0.4989 0.4992 0.8072 0.8288 1.5510 1.5812 1.5883 1.5996 1.7460 1.7886 1.9064 1.9151 2.0576 2.0715 2.1298 2.1325 2.2699 2.2941 2.6178 2.6369 5.7062 5.7305 5.8090 5.8374 8.1566 8.1697 8.3197 8.3618 9.5478 9.5806 k =-0.2174 0.1482 0.0000 ( 8005 PWs) bands (ev): -11.0580 -11.0579 -10.9120 -10.9120 -10.7962 -10.7962 -10.6353 -10.6352 -4.0090 -4.0029 -3.9641 -3.9582 -3.5642 -3.5637 -3.5606 -3.5602 -2.5665 -2.5554 -2.4997 -2.4878 -1.9892 -1.9891 -1.9720 -1.9713 -1.7172 -1.7135 -1.7094 -1.7056 -0.7495 -0.7293 -0.6830 -0.6654 0.4676 0.4696 0.7742 0.7910 1.5273 1.5446 1.5584 1.5943 1.7037 1.7515 1.8763 1.8875 2.0443 2.0492 2.0972 2.1045 2.2647 2.2981 2.6230 2.6425 5.7321 5.7590 5.8049 5.8353 8.1560 8.1699 8.3648 8.4104 9.5765 9.6074 k =-0.2283 0.1556 0.0000 ( 8019 PWs) bands (ev): -11.0445 -11.0444 -10.9021 -10.9021 -10.7930 -10.7930 -10.6368 -10.6368 -4.0029 -3.9966 -3.9581 -3.9520 -3.5626 -3.5621 -3.5593 -3.5588 -2.5609 -2.5491 -2.4962 -2.4836 -1.9845 -1.9843 -1.9673 -1.9666 -1.7190 -1.7156 -1.7114 -1.7078 -0.7627 -0.7451 -0.6834 -0.6685 0.4353 0.4393 0.7392 0.7520 1.4777 1.4999 1.5592 1.5789 1.6745 1.7167 1.8367 1.8645 2.0215 2.0428 2.0645 2.0751 2.2619 2.3026 2.6282 2.6480 5.7372 5.7511 5.8309 5.8473 8.1494 8.1646 8.4042 8.4541 9.6015 9.6318 k =-0.2391 0.1630 0.0000 ( 8013 PWs) bands (ev): -11.0307 -11.0307 -10.8921 -10.8921 -10.7897 -10.7897 -10.6384 -10.6384 -3.9967 -3.9901 -3.9522 -3.9458 -3.5612 -3.5605 -3.5580 -3.5574 -2.5557 -2.5431 -2.4932 -2.4797 -1.9798 -1.9795 -1.9626 -1.9620 -1.7206 -1.7175 -1.7130 -1.7097 -0.7749 -0.7592 -0.6832 -0.6704 0.4028 0.4085 0.7025 0.7122 1.4269 1.4549 1.5460 1.5555 1.6650 1.6859 1.7996 1.8375 2.0021 2.0320 2.0331 2.0503 2.2608 2.3074 2.6331 2.6531 5.7270 5.7314 5.8619 5.8678 8.1382 8.1553 8.4374 8.4921 9.6216 9.6541 k =-0.2500 0.1704 0.0000 ( 8009 PWs) bands (ev): -11.0168 -11.0168 -10.8821 -10.8821 -10.7863 -10.7862 -10.6400 -10.6400 -3.9904 -3.9836 -3.9463 -3.9396 -3.5597 -3.5590 -3.5567 -3.5561 -2.5510 -2.5376 -2.4907 -2.4764 -1.9751 -1.9748 -1.9580 -1.9574 -1.7218 -1.7190 -1.7144 -1.7113 -0.7858 -0.7715 -0.6824 -0.6711 0.3706 0.3775 0.6644 0.6718 1.3758 1.4099 1.5020 1.5424 1.6594 1.6677 1.7690 1.8079 1.9812 2.0040 2.0078 2.0432 2.2609 2.3125 2.6377 2.6578 5.7093 5.7098 5.8882 5.8883 8.1241 8.1434 8.4642 8.5242 9.6363 9.6735 k =-0.2609 0.1778 0.0000 ( 8017 PWs) bands (ev): -11.0028 -11.0028 -10.8723 -10.8722 -10.7828 -10.7827 -10.6417 -10.6417 -3.9842 -3.9771 -3.9406 -3.9336 -3.5584 -3.5576 -3.5556 -3.5549 -2.5469 -2.5326 -2.4888 -2.4735 -1.9705 -1.9700 -1.9534 -1.9528 -1.7227 -1.7201 -1.7154 -1.7126 -0.7950 -0.7818 -0.6810 -0.6708 0.3390 0.3467 0.6251 0.6312 1.3249 1.3650 1.4541 1.5190 1.6326 1.6733 1.7505 1.7783 1.9534 1.9704 1.9934 2.0423 2.2618 2.3177 2.6419 2.6621 5.6862 5.6894 5.9046 5.9085 8.1084 8.1302 8.4847 8.5500 9.6455 9.6891 k =-0.2717 0.1853 0.0000 ( 8015 PWs) bands (ev): -10.9887 -10.9887 -10.8625 -10.8625 -10.7791 -10.7791 -10.6434 -10.6434 -3.9779 -3.9705 -3.9350 -3.9277 -3.5571 -3.5562 -3.5545 -3.5538 -2.5433 -2.5280 -2.4876 -2.4711 -1.9660 -1.9653 -1.9488 -1.9483 -1.7232 -1.7208 -1.7160 -1.7135 -0.8025 -0.7900 -0.6789 -0.6696 0.3082 0.3161 0.5850 0.5906 1.2745 1.3205 1.4051 1.4882 1.6006 1.6742 1.7460 1.7535 1.9230 1.9354 1.9858 2.0436 2.2631 2.3229 2.6456 2.6659 5.6627 5.6676 5.9156 5.9222 8.0924 8.1167 8.4990 8.5696 9.6495 9.7000 k =-0.2826 0.1927 0.0000 ( 8009 PWs) bands (ev): -10.9746 -10.9746 -10.8529 -10.8529 -10.7754 -10.7753 -10.6451 -10.6451 -3.9717 -3.9640 -3.9296 -3.9219 -3.5559 -3.5549 -3.5535 -3.5527 -2.5404 -2.5240 -2.4870 -2.4694 -1.9615 -1.9607 -1.9443 -1.9440 -1.7233 -1.7211 -1.7163 -1.7139 -0.8081 -0.7962 -0.6762 -0.6674 0.2785 0.2860 0.5444 0.5505 1.2247 1.2766 1.3564 1.4536 1.5639 1.6616 1.7400 1.7513 1.8941 1.8997 1.9818 2.0469 2.2647 2.3283 2.6487 2.6691 5.6392 5.6451 5.9207 5.9294 8.0767 8.1034 8.5077 8.5832 9.6489 9.7055 k =-0.2935 0.2001 0.0000 ( 8008 PWs) bands (ev): -10.9606 -10.9605 -10.8436 -10.8435 -10.7716 -10.7715 -10.6469 -10.6468 -3.9655 -3.9575 -3.9243 -3.9164 -3.5548 -3.5537 -3.5526 -3.5517 -2.5380 -2.5205 -2.4871 -2.4682 -1.9571 -1.9561 -1.9399 -1.9397 -1.7230 -1.7209 -1.7162 -1.7140 -0.8118 -0.8003 -0.6730 -0.6645 0.2501 0.2565 0.5036 0.5111 1.1759 1.2334 1.3086 1.4173 1.5246 1.6357 1.7344 1.7614 1.8640 1.8702 1.9807 2.0522 2.2666 2.3336 2.6513 2.6717 5.6157 5.6223 5.9201 5.9303 8.0619 8.0908 8.5114 8.5910 9.6445 9.7053 k =-0.3043 0.2075 0.0000 ( 8020 PWs) bands (ev): -10.9467 -10.9467 -10.8346 -10.8345 -10.7677 -10.7676 -10.6487 -10.6486 -3.9594 -3.9511 -3.9194 -3.9110 -3.5537 -3.5526 -3.5517 -3.5508 -2.5364 -2.5176 -2.4879 -2.4676 -1.9529 -1.9516 -1.9356 -1.9356 -1.7223 -1.7202 -1.7157 -1.7136 -0.8136 -0.8023 -0.6692 -0.6608 0.2231 0.2277 0.4630 0.4728 1.1284 1.1911 1.2620 1.3807 1.4844 1.6038 1.7249 1.7720 1.8297 1.8556 1.9822 2.0596 2.2684 2.3390 2.6531 2.6735 5.5927 5.5995 5.9140 5.9254 8.0481 8.0789 8.5109 8.5938 9.6368 9.6997 k =-0.3152 0.2149 0.0000 ( 8016 PWs) bands (ev): -10.9330 -10.9330 -10.8259 -10.8259 -10.7636 -10.7636 -10.6504 -10.6504 -3.9535 -3.9448 -3.9147 -3.9060 -3.5527 -3.5516 -3.5509 -3.5500 -2.5353 -2.5152 -2.4893 -2.4676 -1.9487 -1.9472 -1.9316 -1.9314 -1.7212 -1.7191 -1.7148 -1.7127 -0.8136 -0.8023 -0.6650 -0.6564 0.1975 0.1995 0.4229 0.4359 1.0824 1.1501 1.2170 1.3444 1.4444 1.5701 1.7057 1.7712 1.8072 1.8514 1.9867 2.0694 2.2703 2.3444 2.6543 2.6747 5.5702 5.5771 5.9031 5.9152 8.0353 8.0676 8.5068 8.5920 9.6265 9.6897 k =-0.3261 0.2223 0.0000 ( 8010 PWs) bands (ev): -10.9196 -10.9195 -10.8177 -10.8177 -10.7595 -10.7595 -10.6522 -10.6521 -3.9477 -3.9386 -3.9104 -3.9012 -3.5518 -3.5508 -3.5500 -3.5492 -2.5348 -2.5134 -2.4914 -2.4682 -1.9447 -1.9429 -1.9279 -1.9275 -1.7196 -1.7175 -1.7134 -1.7113 -0.8117 -0.8004 -0.6605 -0.6515 0.1719 0.1733 0.3837 0.4007 1.0382 1.1103 1.1739 1.3090 1.4049 1.5363 1.6782 1.7435 1.8107 1.8543 1.9943 2.0817 2.2720 2.3498 2.6547 2.6751 5.5484 5.5553 5.8881 5.9006 8.0234 8.0568 8.5000 8.5864 9.6142 9.6760 k =-0.3370 0.2297 0.0000 ( 8010 PWs) bands (ev): -10.9065 -10.9065 -10.8100 -10.8100 -10.7553 -10.7553 -10.6540 -10.6539 -3.9422 -3.9327 -3.9063 -3.8968 -3.5510 -3.5501 -3.5492 -3.5485 -2.5349 -2.5120 -2.4940 -2.4693 -1.9408 -1.9387 -1.9243 -1.9237 -1.7176 -1.7154 -1.7116 -1.7095 -0.8082 -0.7967 -0.6557 -0.6462 0.1450 0.1507 0.3458 0.3676 0.9960 1.0721 1.1329 1.2747 1.3664 1.5029 1.6457 1.7081 1.8208 1.8600 2.0052 2.0964 2.2736 2.3553 2.6542 2.6747 5.5275 5.5341 5.8696 5.8822 8.0123 8.0462 8.4913 8.5777 9.6005 9.6596 k =-0.3478 0.2371 0.0000 ( 8018 PWs) bands (ev): -10.8938 -10.8938 -10.8029 -10.8028 -10.7510 -10.7510 -10.6557 -10.6556 -3.9368 -3.9270 -3.9026 -3.8927 -3.5502 -3.5495 -3.5483 -3.5479 -2.5354 -2.5111 -2.4970 -2.4708 -1.9371 -1.9348 -1.9210 -1.9202 -1.7153 -1.7130 -1.7094 -1.7073 -0.8032 -0.7914 -0.6509 -0.6407 0.1187 0.1293 0.3095 0.3367 0.9562 1.0357 1.0942 1.2419 1.3291 1.4706 1.6108 1.6716 1.8307 1.8656 2.0194 2.1135 2.2750 2.3608 2.6530 2.6735 5.5075 5.5137 5.8484 5.8609 8.0016 8.0355 8.4813 8.5665 9.5859 9.6414 k =-0.3587 0.2445 0.0000 ( 8022 PWs) bands (ev): -10.8816 -10.8816 -10.7963 -10.7963 -10.7467 -10.7466 -10.6574 -10.6573 -3.9317 -3.9215 -3.8993 -3.8890 -3.5495 -3.5490 -3.5476 -3.5473 -2.5363 -2.5105 -2.5005 -2.4728 -1.9335 -1.9310 -1.9180 -1.9170 -1.7125 -1.7102 -1.7068 -1.7046 -0.7967 -0.7847 -0.6461 -0.6350 0.0931 0.1092 0.2752 0.3081 0.9188 1.0010 1.0580 1.2107 1.2932 1.4394 1.5747 1.6351 1.8393 1.8703 2.0361 2.1326 2.2762 2.3663 2.6509 2.6715 5.4886 5.4944 5.8254 5.8375 7.9912 8.0246 8.4707 8.5536 9.5707 9.6221 k =-0.3696 0.2520 0.0000 ( 8030 PWs) bands (ev): -10.8699 -10.8699 -10.7904 -10.7904 -10.7422 -10.7422 -10.6592 -10.6591 -3.9268 -3.9163 -3.8963 -3.8856 -3.5489 -3.5486 -3.5468 -3.5468 -2.5375 -2.5104 -2.5042 -2.4751 -1.9301 -1.9274 -1.9153 -1.9141 -1.7095 -1.7071 -1.7038 -1.7016 -0.7891 -0.7767 -0.6416 -0.6295 0.0684 0.0900 0.2433 0.2819 0.8843 0.9684 1.0248 1.1812 1.2592 1.4097 1.5382 1.5989 1.8467 1.8738 2.0548 2.1534 2.2770 2.3719 2.6479 2.6687 5.4709 5.4762 5.8012 5.8127 7.9811 8.0134 8.4598 8.5394 9.5553 9.6023 k =-0.3804 0.2594 0.0000 ( 8026 PWs) bands (ev): -10.8588 -10.8587 -10.7852 -10.7852 -10.7377 -10.7377 -10.6609 -10.6608 -3.9223 -3.9115 -3.8936 -3.8826 -3.5483 -3.5482 -3.5463 -3.5462 -2.5389 -2.5107 -2.5078 -2.4778 -1.9269 -1.9240 -1.9129 -1.9115 -1.7061 -1.7038 -1.7005 -1.6984 -0.7805 -0.7677 -0.6375 -0.6244 0.0447 0.0716 0.2144 0.2581 0.8529 0.9376 0.9947 1.1534 1.2273 1.3815 1.5019 1.5635 1.8527 1.8761 2.0747 2.1756 2.2776 2.3776 2.6442 2.6650 5.4544 5.4591 5.7766 5.7874 7.9712 8.0019 8.4491 8.5246 9.5402 9.5826 k =-0.3913 0.2668 0.0000 ( 8034 PWs) bands (ev): -10.8483 -10.8483 -10.7807 -10.7806 -10.7332 -10.7332 -10.6626 -10.6625 -3.9180 -3.9070 -3.8912 -3.8800 -3.5478 -3.5478 -3.5458 -3.5456 -2.5404 -2.5131 -2.5098 -2.4806 -1.9239 -1.9208 -1.9107 -1.9093 -1.7026 -1.7003 -1.6970 -1.6949 -0.7710 -0.7579 -0.6338 -0.6197 0.0223 0.0537 0.1887 0.2365 0.8247 0.9089 0.9681 1.1273 1.1979 1.3548 1.4666 1.5292 1.8576 1.8777 2.0950 2.1986 2.2777 2.3832 2.6397 2.6606 5.4392 5.4433 5.7522 5.7620 7.9614 7.9902 8.4390 8.5094 9.5255 9.5634 k =-0.4022 0.2742 0.0000 ( 8026 PWs) bands (ev): -10.8385 -10.8384 -10.7769 -10.7769 -10.7286 -10.7286 -10.6643 -10.6642 -3.9140 -3.9029 -3.8891 -3.8778 -3.5475 -3.5474 -3.5454 -3.5450 -2.5419 -2.5169 -2.5104 -2.4836 -1.9211 -1.9179 -1.9089 -1.9073 -1.6989 -1.6967 -1.6935 -1.6914 -0.7609 -0.7475 -0.6308 -0.6158 0.0015 0.0360 0.1667 0.2169 0.7999 0.8820 0.9453 1.1025 1.1716 1.3295 1.4327 1.4961 1.8615 1.8786 2.1153 2.2220 2.2775 2.3888 2.6346 2.6554 5.4253 5.4288 5.7285 5.7374 7.9520 7.9785 8.4297 8.4944 9.5116 9.5451 k =-0.4130 0.2816 0.0000 ( 8022 PWs) bands (ev): -10.8294 -10.8293 -10.7739 -10.7739 -10.7241 -10.7240 -10.6660 -10.6659 -3.9103 -3.8992 -3.8872 -3.8760 -3.5473 -3.5470 -3.5450 -3.5445 -2.5433 -2.5210 -2.5107 -2.4867 -1.9184 -1.9153 -1.9074 -1.9057 -1.6952 -1.6931 -1.6899 -1.6880 -0.7505 -0.7369 -0.6285 -0.6128 -0.0174 0.0186 0.1484 0.1991 0.7786 0.8571 0.9265 1.0786 1.1491 1.3053 1.4011 1.4647 1.8647 1.8790 2.1349 2.2454 2.2769 2.3943 2.6289 2.6496 5.4129 5.4157 5.7060 5.7139 7.9429 7.9669 8.4213 8.4797 9.4987 9.5278 k =-0.4239 0.2890 0.0000 ( 8022 PWs) bands (ev): -10.8210 -10.8209 -10.7717 -10.7716 -10.7196 -10.7195 -10.6677 -10.6676 -3.9069 -3.8962 -3.8855 -3.8745 -3.5470 -3.5467 -3.5446 -3.5441 -2.5446 -2.5249 -2.5110 -2.4898 -1.9160 -1.9129 -1.9061 -1.9045 -1.6915 -1.6896 -1.6865 -1.6847 -0.7398 -0.7262 -0.6270 -0.6107 -0.0342 0.0016 0.1338 0.1830 0.7610 0.8340 0.9120 1.0554 1.1310 1.2818 1.3728 1.4351 1.8672 1.8791 2.1536 2.2679 2.2763 2.3994 2.6229 2.6433 5.4018 5.4041 5.6853 5.6921 7.9345 7.9558 8.4140 8.4658 9.4870 9.5120 k =-0.4348 0.2964 0.0000 ( 8038 PWs) bands (ev): -10.8134 -10.8133 -10.7701 -10.7701 -10.7152 -10.7150 -10.6695 -10.6694 -3.9039 -3.8937 -3.8838 -3.8735 -3.5468 -3.5465 -3.5443 -3.5438 -2.5456 -2.5287 -2.5112 -2.4928 -1.9138 -1.9108 -1.9052 -1.9035 -1.6880 -1.6861 -1.6833 -1.6816 -0.7293 -0.7157 -0.6261 -0.6098 -0.0486 -0.0147 0.1227 0.1684 0.7469 0.8129 0.9017 1.0326 1.1176 1.2584 1.3485 1.4078 1.8693 1.8790 2.1712 2.2730 2.2920 2.4040 2.6168 2.6365 5.3922 5.3939 5.6667 5.6724 7.9269 7.9453 8.4079 8.4527 9.4767 9.4977 k =-0.4457 0.3038 0.0000 ( 8038 PWs) bands (ev): -10.8065 -10.8064 -10.7693 -10.7692 -10.7109 -10.7108 -10.6714 -10.6712 -3.9011 -3.8920 -3.8820 -3.8727 -3.5466 -3.5463 -3.5440 -3.5435 -2.5464 -2.5322 -2.5112 -2.4958 -1.9118 -1.9089 -1.9045 -1.9028 -1.6847 -1.6830 -1.6806 -1.6789 -0.7191 -0.7059 -0.6259 -0.6100 -0.0603 -0.0299 0.1147 0.1553 0.7364 0.7938 0.8955 1.0105 1.1090 1.2350 1.3293 1.3830 1.8709 1.8787 2.1873 2.2707 2.3134 2.4076 2.6110 2.6295 5.3840 5.3853 5.6504 5.6551 7.9204 7.9357 8.4032 8.4408 9.4680 9.4852 k =-0.4565 0.3112 0.0000 ( 8034 PWs) bands (ev): -10.8005 -10.8004 -10.7691 -10.7690 -10.7069 -10.7068 -10.6733 -10.6731 -3.8987 -3.8910 -3.8802 -3.8724 -3.5464 -3.5461 -3.5437 -3.5433 -2.5468 -2.5354 -2.5109 -2.4985 -1.9100 -1.9073 -1.9041 -1.9023 -1.6818 -1.6801 -1.6782 -1.6766 -0.7094 -0.6971 -0.6260 -0.6113 -0.0693 -0.0436 0.1095 0.1436 0.7293 0.7768 0.8934 0.9893 1.1052 1.2117 1.3152 1.3611 1.8723 1.8783 2.2019 2.2675 2.3336 2.4098 2.6059 2.6225 5.3773 5.3782 5.6369 5.6405 7.9150 7.9273 8.3999 8.4301 9.4609 9.4745 k =-0.4674 0.3186 0.0000 ( 8026 PWs) bands (ev): -10.7954 -10.7953 -10.7694 -10.7693 -10.7033 -10.7032 -10.6751 -10.6750 -3.8966 -3.8906 -3.8784 -3.8723 -3.5463 -3.5460 -3.5435 -3.5431 -2.5468 -2.5383 -2.5104 -2.5011 -1.9085 -1.9059 -1.9040 -1.9022 -1.6793 -1.6778 -1.6764 -1.6749 -0.7006 -0.6899 -0.6263 -0.6135 -0.0756 -0.0554 0.1068 0.1333 0.7255 0.7621 0.8951 0.9693 1.1059 1.1891 1.3061 1.3422 1.8735 1.8779 2.2149 2.2634 2.3522 2.4100 2.6020 2.6157 5.3720 5.3726 5.6262 5.6289 7.9109 7.9202 8.3981 8.4208 9.4557 9.4658 k =-0.4783 0.3261 0.0000 ( 8022 PWs) bands (ev): -10.7913 -10.7912 -10.7700 -10.7700 -10.7003 -10.7002 -10.6768 -10.6767 -3.8947 -3.8906 -3.8768 -3.8726 -3.5462 -3.5460 -3.5433 -3.5431 -2.5465 -2.5408 -2.5096 -2.5034 -1.9071 -1.9047 -1.9041 -1.9022 -1.6773 -1.6760 -1.6751 -1.6738 -0.6931 -0.6849 -0.6260 -0.6164 -0.0789 -0.0651 0.1064 0.1245 0.7248 0.7496 0.9003 0.9509 1.1110 1.1679 1.3018 1.3266 1.8745 1.8773 2.2264 2.2584 2.3688 2.4077 2.5998 2.6097 5.3683 5.3686 5.6185 5.6203 7.9084 7.9145 8.3978 8.4130 9.4523 9.4590 k =-0.4891 0.3335 0.0000 ( 8010 PWs) bands (ev): -10.7885 -10.7885 -10.7707 -10.7707 -10.6982 -10.6981 -10.6781 -10.6780 -3.8932 -3.8911 -3.8753 -3.8732 -3.5461 -3.5460 -3.5431 -3.5430 -2.5457 -2.5428 -2.5085 -2.5054 -1.9060 -1.9045 -1.9038 -1.9025 -1.6759 -1.6751 -1.6740 -1.6732 -0.6872 -0.6827 -0.6249 -0.6197 -0.0795 -0.0725 0.1081 0.1173 0.7270 0.7395 0.9089 0.9345 1.1201 1.1490 1.3020 1.3146 1.8753 1.8767 2.2364 2.2522 2.3829 2.4026 2.5995 2.6047 5.3661 5.3662 5.6141 5.6150 7.9074 7.9105 8.3992 8.4068 9.4510 9.4543 k =-0.5000 0.3409 0.0000 ( 8004 PWs) bands (ev): -10.7875 -10.7875 -10.7710 -10.7710 -10.6974 -10.6974 -10.6785 -10.6785 -3.8920 -3.8920 -3.8741 -3.8741 -3.5460 -3.5460 -3.5431 -3.5431 -2.5445 -2.5445 -2.5071 -2.5071 -1.9052 -1.9052 -1.9030 -1.9030 -1.6752 -1.6752 -1.6733 -1.6733 -0.6836 -0.6836 -0.6227 -0.6227 -0.0773 -0.0773 0.1118 0.1118 0.7320 0.7320 0.9204 0.9204 1.1329 1.1329 1.3063 1.3063 1.8761 1.8761 2.2450 2.2450 2.3943 2.3943 2.6012 2.6012 5.3654 5.3654 5.6129 5.6129 7.9081 7.9081 8.4022 8.4022 9.4516 9.4516 k =-0.5000 0.3409 0.0000 ( 8004 PWs) bands (ev): -10.7875 -10.7875 -10.7710 -10.7710 -10.6974 -10.6974 -10.6785 -10.6785 -3.8920 -3.8920 -3.8741 -3.8741 -3.5460 -3.5460 -3.5431 -3.5431 -2.5445 -2.5445 -2.5071 -2.5071 -1.9052 -1.9052 -1.9030 -1.9030 -1.6752 -1.6752 -1.6733 -1.6733 -0.6836 -0.6836 -0.6227 -0.6227 -0.0773 -0.0773 0.1118 0.1118 0.7320 0.7320 0.9204 0.9204 1.1329 1.1329 1.3063 1.3063 1.8761 1.8761 2.2450 2.2450 2.3943 2.3943 2.6012 2.6012 5.3654 5.3654 5.6129 5.6129 7.9081 7.9081 8.4022 8.4022 9.4516 9.4516 k =-0.4930 0.3512-0.0000 ( 8000 PWs) bands (ev): -10.7876 -10.7876 -10.7712 -10.7712 -10.6973 -10.6973 -10.6786 -10.6786 -3.8921 -3.8919 -3.8743 -3.8741 -3.5460 -3.5458 -3.5431 -3.5429 -2.5447 -2.5441 -2.5074 -2.5067 -1.9053 -1.9052 -1.9031 -1.9031 -1.6753 -1.6748 -1.6734 -1.6731 -0.6852 -0.6822 -0.6246 -0.6214 -0.0784 -0.0753 0.1105 0.1139 0.7320 0.7331 0.9180 0.9226 1.1325 1.1327 1.2998 1.3082 1.8754 1.8793 2.2423 2.2466 2.3945 2.3953 2.5986 2.6008 5.3653 5.3674 5.6129 5.6149 7.9103 7.9125 8.4030 8.4050 9.4423 9.4597 k =-0.4859 0.3615-0.0000 ( 8012 PWs) bands (ev): -10.7877 -10.7877 -10.7716 -10.7716 -10.6971 -10.6971 -10.6787 -10.6787 -3.8924 -3.8920 -3.8747 -3.8743 -3.5459 -3.5456 -3.5430 -3.5427 -2.5448 -2.5436 -2.5076 -2.5062 -1.9056 -1.9054 -1.9033 -1.9033 -1.6754 -1.6744 -1.6733 -1.6728 -0.6870 -0.6812 -0.6271 -0.6207 -0.0784 -0.0723 0.1099 0.1167 0.7333 0.7354 0.9154 0.9248 1.1316 1.1321 1.2890 1.3056 1.8773 1.8849 2.2385 2.2468 2.3963 2.3978 2.5932 2.5974 5.3672 5.3714 5.6151 5.6191 7.9189 7.9234 8.4076 8.4115 9.4319 9.4665 k =-0.4789 0.3719-0.0000 ( 8014 PWs) bands (ev): -10.7879 -10.7879 -10.7724 -10.7724 -10.6968 -10.6968 -10.6789 -10.6789 -3.8928 -3.8922 -3.8752 -3.8747 -3.5457 -3.5452 -3.5427 -3.5423 -2.5448 -2.5429 -2.5077 -2.5056 -1.9060 -1.9058 -1.9037 -1.9037 -1.6753 -1.6738 -1.6731 -1.6724 -0.6891 -0.6804 -0.6301 -0.6207 -0.0774 -0.0684 0.1101 0.1202 0.7358 0.7389 0.9126 0.9268 1.1303 1.1313 1.2743 1.2988 1.8817 1.8926 2.2331 2.2453 2.3999 2.4021 2.5849 2.5912 5.3710 5.3773 5.6194 5.6253 7.9338 7.9407 8.4157 8.4217 9.4207 9.4719 k =-0.4718 0.3822-0.0000 ( 8012 PWs) bands (ev): -10.7882 -10.7882 -10.7734 -10.7734 -10.6963 -10.6963 -10.6792 -10.6792 -3.8933 -3.8925 -3.8760 -3.8752 -3.5453 -3.5447 -3.5424 -3.5418 -2.5446 -2.5421 -2.5077 -2.5049 -1.9066 -1.9063 -1.9042 -1.9042 -1.6750 -1.6731 -1.6728 -1.6718 -0.6914 -0.6800 -0.6337 -0.6215 -0.0752 -0.0636 0.1111 0.1243 0.7395 0.7435 0.9094 0.9286 1.1286 1.1303 1.2563 1.2883 1.8882 1.9021 2.2255 2.2414 2.4059 2.4084 2.5738 2.5821 5.3768 5.3850 5.6256 5.6334 7.9549 7.9643 8.4271 8.4353 9.4089 9.4758 k =-0.4648 0.3925-0.0000 ( 8012 PWs) bands (ev): -10.7886 -10.7886 -10.7747 -10.7747 -10.6957 -10.6957 -10.6795 -10.6795 -3.8939 -3.8929 -3.8769 -3.8760 -3.5449 -3.5440 -3.5420 -3.5412 -2.5443 -2.5412 -2.5077 -2.5041 -1.9074 -1.9071 -1.9048 -1.9048 -1.6746 -1.6724 -1.6722 -1.6710 -0.6939 -0.6800 -0.6377 -0.6229 -0.0719 -0.0579 0.1128 0.1291 0.7444 0.7492 0.9056 0.9303 1.1265 1.1294 1.2358 1.2749 1.8965 1.9130 2.2155 2.2345 2.4146 2.4172 2.5600 2.5703 5.3843 5.3945 5.6338 5.6434 7.9819 7.9939 8.4417 8.4522 9.3967 9.4785 k =-0.4577 0.4029-0.0000 ( 8028 PWs) bands (ev): -10.7891 -10.7891 -10.7763 -10.7763 -10.6950 -10.6950 -10.6800 -10.6799 -3.8947 -3.8935 -3.8780 -3.8769 -3.5443 -3.5433 -3.5414 -3.5405 -2.5439 -2.5402 -2.5075 -2.5033 -1.9083 -1.9080 -1.9056 -1.9055 -1.6740 -1.6716 -1.6715 -1.6700 -0.6967 -0.6804 -0.6420 -0.6251 -0.0674 -0.0513 0.1153 0.1343 0.7504 0.7559 0.9013 0.9318 1.1239 1.1288 1.2140 1.2593 1.9062 1.9248 2.2026 2.2243 2.4257 2.4283 2.5439 2.5560 5.3936 5.4057 5.6437 5.6551 8.0145 8.0293 8.4592 8.4721 9.3844 9.4798 k =-0.4507 0.4132-0.0000 ( 8022 PWs) bands (ev): -10.7897 -10.7896 -10.7783 -10.7783 -10.6941 -10.6941 -10.6805 -10.6805 -3.8956 -3.8942 -3.8793 -3.8780 -3.5436 -3.5424 -3.5407 -3.5397 -2.5433 -2.5390 -2.5072 -2.5024 -1.9094 -1.9091 -1.9066 -1.9064 -1.6733 -1.6708 -1.6707 -1.6689 -0.6996 -0.6812 -0.6468 -0.6279 -0.0616 -0.0437 0.1186 0.1401 0.7575 0.7636 0.8963 0.9329 1.1200 1.1287 1.1925 1.2425 1.9171 1.9374 2.1868 2.2110 2.4391 2.4416 2.5256 2.5391 5.4045 5.4184 5.6554 5.6684 8.0522 8.0701 8.4792 8.4947 9.3724 9.4800 k =-0.4437 0.4235-0.0000 ( 8018 PWs) bands (ev): -10.7903 -10.7903 -10.7805 -10.7805 -10.6932 -10.6932 -10.6811 -10.6811 -3.8966 -3.8950 -3.8807 -3.8793 -3.5429 -3.5415 -3.5400 -3.5388 -2.5427 -2.5378 -2.5069 -2.5014 -1.9107 -1.9104 -1.9076 -1.9074 -1.6726 -1.6699 -1.6696 -1.6676 -0.7027 -0.6825 -0.6518 -0.6314 -0.0544 -0.0352 0.1226 0.1463 0.7656 0.7722 0.8907 0.9338 1.1129 1.1290 1.1741 1.2254 1.9287 1.9505 2.1683 2.1947 2.4533 2.4566 2.5060 2.5202 5.4170 5.4325 5.6685 5.6831 8.0947 8.1158 8.5013 8.5195 9.3608 9.4793 k =-0.4366 0.4338-0.0000 ( 8030 PWs) bands (ev): -10.7911 -10.7911 -10.7830 -10.7830 -10.6921 -10.6921 -10.6818 -10.6818 -3.8977 -3.8960 -3.8823 -3.8807 -3.5420 -3.5405 -3.5392 -3.5378 -2.5419 -2.5365 -2.5065 -2.5005 -1.9122 -1.9118 -1.9088 -1.9085 -1.6716 -1.6691 -1.6684 -1.6662 -0.7061 -0.6843 -0.6570 -0.6356 -0.0460 -0.0257 0.1272 0.1528 0.7747 0.7815 0.8846 0.9345 1.0996 1.1293 1.1625 1.2094 1.9410 1.9639 2.1474 2.1759 2.4625 2.4716 2.4909 2.5005 5.4308 5.4479 5.6829 5.6990 8.1414 8.1661 8.5250 8.5461 9.3499 9.4777 k =-0.4296 0.4442-0.0000 ( 8030 PWs) bands (ev): -10.7920 -10.7920 -10.7858 -10.7858 -10.6909 -10.6909 -10.6826 -10.6825 -3.8989 -3.8971 -3.8841 -3.8823 -3.5411 -3.5394 -3.5382 -3.5368 -2.5410 -2.5351 -2.5061 -2.4995 -1.9138 -1.9135 -1.9101 -1.9097 -1.6706 -1.6681 -1.6670 -1.6648 -0.7097 -0.6866 -0.6624 -0.6403 -0.0361 -0.0153 0.1326 0.1596 0.7847 0.7912 0.8784 0.9350 1.0800 1.1282 1.1585 1.1964 1.9535 1.9774 2.1244 2.1549 2.4486 2.4700 2.4963 2.4978 5.4458 5.4644 5.6985 5.7160 8.1918 8.2202 8.5498 8.5739 9.3400 9.4755 k =-0.4225 0.4545-0.0000 ( 8036 PWs) bands (ev): -10.7930 -10.7930 -10.7890 -10.7890 -10.6896 -10.6895 -10.6834 -10.6834 -3.9003 -3.8984 -3.8860 -3.8841 -3.5402 -3.5382 -3.5372 -3.5357 -2.5401 -2.5337 -2.5057 -2.4986 -1.9156 -1.9153 -1.9116 -1.9110 -1.6695 -1.6672 -1.6654 -1.6632 -0.7135 -0.6895 -0.6680 -0.6455 -0.0249 -0.0038 0.1386 0.1667 0.7954 0.8007 0.8728 0.9355 1.0570 1.1240 1.1598 1.1887 1.9663 1.9909 2.0997 2.1322 2.4235 2.4467 2.5123 2.5146 5.4618 5.4818 5.7150 5.7339 8.2451 8.2776 8.5751 8.6024 9.3314 9.4730 k =-0.4155 0.4648-0.0000 ( 8028 PWs) bands (ev): -10.7942 -10.7942 -10.7924 -10.7924 -10.6881 -10.6881 -10.6844 -10.6844 -3.9019 -3.8998 -3.8880 -3.8860 -3.5392 -3.5370 -3.5362 -3.5345 -2.5391 -2.5322 -2.5053 -2.4977 -1.9175 -1.9173 -1.9131 -1.9124 -1.6682 -1.6661 -1.6638 -1.6616 -0.7175 -0.6930 -0.6735 -0.6511 -0.0123 0.0086 0.1453 0.1738 0.8066 0.8092 0.8690 0.9362 1.0332 1.1157 1.1644 1.1879 1.9790 2.0043 2.0737 2.1083 2.3953 2.4199 2.5304 2.5328 5.4787 5.5000 5.7323 5.7524 8.3007 8.3375 8.6003 8.6308 9.3243 9.4702 k =-0.4085 0.4752-0.0000 ( 8004 PWs) bands (ev): -10.7962 -10.7962 -10.7955 -10.7954 -10.6866 -10.6866 -10.6854 -10.6854 -3.9036 -3.9014 -3.8902 -3.8880 -3.5381 -3.5358 -3.5351 -3.5333 -2.5380 -2.5307 -2.5049 -2.4968 -1.9196 -1.9194 -1.9148 -1.9139 -1.6668 -1.6651 -1.6620 -1.6600 -0.7218 -0.6970 -0.6790 -0.6569 0.0017 0.0221 0.1527 0.1811 0.8147 0.8180 0.8690 0.9370 1.0104 1.1046 1.1713 1.1929 1.9911 2.0173 2.0473 2.0837 2.3653 2.3912 2.5484 2.5510 5.4963 5.5188 5.7502 5.7714 8.3577 8.3989 8.6248 8.6585 9.3186 9.4673 k =-0.4014 0.4855-0.0000 ( 8012 PWs) bands (ev): -10.8003 -10.8003 -10.7969 -10.7969 -10.6866 -10.6866 -10.6850 -10.6850 -3.9055 -3.9032 -3.8925 -3.8902 -3.5370 -3.5345 -3.5340 -3.5321 -2.5369 -2.5292 -2.5045 -2.4961 -1.9218 -1.9217 -1.9165 -1.9155 -1.6654 -1.6640 -1.6602 -1.6585 -0.7263 -0.7017 -0.6844 -0.6630 0.0171 0.0366 0.1606 0.1884 0.8159 0.8290 0.8746 0.9375 0.9905 1.0928 1.1799 1.2017 1.9993 2.0240 2.0292 2.0596 2.3337 2.3610 2.5660 2.5688 5.5144 5.5380 5.7684 5.7907 8.4151 8.4608 8.6478 8.6847 9.3139 9.4195 k =-0.3944 0.4958-0.0000 ( 8016 PWs) bands (ev): -10.8046 -10.8046 -10.7984 -10.7984 -10.6878 -10.6878 -10.6834 -10.6833 -3.9076 -3.9052 -3.8949 -3.8925 -3.5359 -3.5333 -3.5329 -3.5308 -2.5358 -2.5277 -2.5042 -2.4954 -1.9242 -1.9241 -1.9184 -1.9173 -1.6638 -1.6629 -1.6582 -1.6569 -0.7310 -0.7068 -0.6897 -0.6692 0.0337 0.0521 0.1692 0.1958 0.8135 0.8388 0.8851 0.9363 0.9764 1.0817 1.1899 1.2132 1.9849 2.0230 2.0278 2.0486 2.3010 2.3296 2.5828 2.5858 5.5329 5.5574 5.7869 5.8101 8.4720 8.5216 8.6688 8.7088 9.3082 9.3781 k =-0.3873 0.5062-0.0000 ( 8022 PWs) bands (ev): -10.8093 -10.8093 -10.8002 -10.8001 -10.6892 -10.6892 -10.6816 -10.6816 -3.9098 -3.9074 -3.8973 -3.8949 -3.5349 -3.5320 -3.5317 -3.5296 -2.5347 -2.5263 -2.5039 -2.4948 -1.9267 -1.9266 -1.9204 -1.9191 -1.6622 -1.6618 -1.6563 -1.6554 -0.7358 -0.7125 -0.6947 -0.6753 0.0516 0.0685 0.1784 0.2031 0.8094 0.8456 0.8990 0.9322 0.9717 1.0724 1.2009 1.2265 1.9587 2.0053 2.0337 2.0587 2.2672 2.2972 2.5985 2.6018 5.5515 5.5769 5.8054 5.8294 8.5270 8.5794 8.6872 8.7301 9.2961 9.3521 k =-0.3803 0.5165-0.0000 ( 8034 PWs) bands (ev): -10.8143 -10.8143 -10.8020 -10.8020 -10.6906 -10.6906 -10.6798 -10.6797 -3.9123 -3.9098 -3.8999 -3.8973 -3.5338 -3.5308 -3.5306 -3.5283 -2.5337 -2.5250 -2.5037 -2.4943 -1.9294 -1.9293 -1.9225 -1.9210 -1.6607 -1.6605 -1.6543 -1.6540 -0.7409 -0.7187 -0.6994 -0.6813 0.0708 0.0860 0.1881 0.2104 0.8049 0.8473 0.9149 0.9287 0.9755 1.0653 1.2126 1.2410 1.9316 1.9815 2.0453 2.0705 2.2326 2.2641 2.6130 2.6164 5.5701 5.5963 5.8238 5.8485 8.5786 8.6319 8.7028 8.7484 9.2761 9.3448 k =-0.3732 0.5268-0.0000 ( 8046 PWs) bands (ev): -10.8197 -10.8197 -10.8041 -10.8041 -10.6922 -10.6922 -10.6779 -10.6779 -3.9150 -3.9125 -3.9025 -3.8998 -3.5327 -3.5296 -3.5295 -3.5271 -2.5326 -2.5237 -2.5036 -2.4940 -1.9321 -1.9320 -1.9247 -1.9231 -1.6596 -1.6587 -1.6527 -1.6524 -0.7461 -0.7253 -0.7038 -0.6871 0.0911 0.1044 0.1984 0.2177 0.8010 0.8429 0.9304 0.9321 0.9844 1.0609 1.2247 1.2564 1.9052 1.9586 2.0568 2.0822 2.1976 2.2306 2.6261 2.6296 5.5886 5.6155 5.8419 5.8672 8.6250 8.6756 8.7159 8.7639 9.2590 9.3479 k =-0.3662 0.5371-0.0000 ( 8052 PWs) bands (ev): -10.8253 -10.8253 -10.8063 -10.8063 -10.6939 -10.6938 -10.6760 -10.6759 -3.9179 -3.9153 -3.9052 -3.9024 -3.5317 -3.5284 -3.5284 -3.5259 -2.5317 -2.5225 -2.5035 -2.4938 -1.9349 -1.9349 -1.9269 -1.9252 -1.6585 -1.6569 -1.6514 -1.6504 -0.7515 -0.7322 -0.7077 -0.6926 0.1126 0.1237 0.2093 0.2250 0.7981 0.8343 0.9374 0.9502 0.9970 1.0597 1.2370 1.2723 1.8800 1.9373 2.0675 2.0932 2.1624 2.1971 2.6376 2.6413 5.6068 5.6342 5.8595 5.8854 8.6630 8.7067 8.7280 8.7773 9.2524 9.3557 k =-0.3662 0.5371-0.0000 ( 8052 PWs) bands (ev): -10.8253 -10.8253 -10.8063 -10.8063 -10.6939 -10.6938 -10.6760 -10.6759 -3.9179 -3.9153 -3.9052 -3.9024 -3.5317 -3.5284 -3.5284 -3.5259 -2.5317 -2.5225 -2.5035 -2.4938 -1.9349 -1.9349 -1.9269 -1.9252 -1.6585 -1.6569 -1.6514 -1.6504 -0.7515 -0.7322 -0.7077 -0.6926 0.1126 0.1237 0.2093 0.2250 0.7981 0.8343 0.9374 0.9502 0.9970 1.0597 1.2370 1.2723 1.8800 1.9373 2.0675 2.0932 2.1624 2.1971 2.6376 2.6413 5.6068 5.6342 5.8595 5.8854 8.6630 8.7067 8.7280 8.7773 9.2524 9.3557 k =-0.3662 0.5371 0.0128 ( 8049 PWs) bands (ev): -10.8253 -10.8253 -10.8064 -10.8064 -10.6938 -10.6938 -10.6760 -10.6760 -3.9178 -3.9153 -3.9052 -3.9025 -3.5317 -3.5285 -3.5284 -3.5259 -2.5316 -2.5225 -2.5036 -2.4939 -1.9350 -1.9349 -1.9269 -1.9251 -1.6585 -1.6569 -1.6514 -1.6505 -0.7514 -0.7322 -0.7079 -0.6929 0.1134 0.1245 0.2092 0.2249 0.7993 0.8352 0.9366 0.9483 0.9952 1.0582 1.2381 1.2736 1.8782 1.9345 2.0678 2.0931 2.1670 2.2004 2.6363 2.6400 5.6077 5.6350 5.8586 5.8842 8.6610 8.7016 8.7297 8.7822 9.2485 9.3610 k =-0.3662 0.5371 0.0256 ( 8048 PWs) bands (ev): -10.8251 -10.8251 -10.8066 -10.8066 -10.6936 -10.6935 -10.6762 -10.6761 -3.9177 -3.9152 -3.9053 -3.9026 -3.5317 -3.5285 -3.5284 -3.5260 -2.5312 -2.5222 -2.5037 -2.4943 -1.9350 -1.9350 -1.9268 -1.9250 -1.6584 -1.6570 -1.6515 -1.6505 -0.7510 -0.7322 -0.7083 -0.6938 0.1158 0.1266 0.2090 0.2243 0.8027 0.8377 0.9344 0.9427 0.9901 1.0538 1.2409 1.2770 1.8736 1.9272 2.0685 2.0926 2.1799 2.2101 2.6323 2.6358 5.6104 5.6372 5.8557 5.8807 8.6557 8.6894 8.7340 8.7935 9.2390 9.3746 k =-0.3662 0.5371 0.0384 ( 8056 PWs) bands (ev): -10.8248 -10.8248 -10.8070 -10.8070 -10.6932 -10.6932 -10.6765 -10.6764 -3.9175 -3.9152 -3.9054 -3.9028 -3.5316 -3.5286 -3.5283 -3.5260 -2.5305 -2.5219 -2.5040 -2.4950 -1.9352 -1.9351 -1.9266 -1.9247 -1.6584 -1.6570 -1.6515 -1.6506 -0.7503 -0.7321 -0.7090 -0.6952 0.1198 0.1300 0.2088 0.2234 0.8081 0.8409 0.9312 0.9342 0.9832 1.0474 1.2442 1.2810 1.8678 1.9179 2.0689 2.0913 2.1991 2.2251 2.6258 2.6291 5.6149 5.6408 5.8510 5.8749 8.6481 8.6744 8.7401 8.8068 9.2279 9.3928 k =-0.3662 0.5371 0.0512 ( 8042 PWs) bands (ev): -10.8244 -10.8243 -10.8075 -10.8075 -10.6927 -10.6926 -10.6768 -10.6768 -3.9173 -3.9150 -3.9056 -3.9031 -3.5316 -3.5287 -3.5282 -3.5260 -2.5297 -2.5214 -2.5044 -2.4960 -1.9354 -1.9351 -1.9263 -1.9244 -1.6584 -1.6571 -1.6516 -1.6507 -0.7494 -0.7321 -0.7100 -0.6971 0.1251 0.1346 0.2084 0.2222 0.8145 0.8437 0.9240 0.9278 0.9764 1.0402 1.2464 1.2837 1.8630 1.9091 2.0685 2.0889 2.2225 2.2443 2.6170 2.6200 5.6211 5.6458 5.8446 5.8670 8.6393 8.6588 8.7470 8.8196 9.2177 9.4129 k =-0.3662 0.5371 0.0640 ( 8040 PWs) bands (ev): -10.8238 -10.8238 -10.8082 -10.8082 -10.6920 -10.6920 -10.6773 -10.6773 -3.9169 -3.9149 -3.9057 -3.9034 -3.5315 -3.5288 -3.5281 -3.5261 -2.5286 -2.5208 -2.5049 -2.4972 -1.9356 -1.9352 -1.9259 -1.9241 -1.6583 -1.6571 -1.6517 -1.6508 -0.7483 -0.7319 -0.7111 -0.6995 0.1316 0.1402 0.2079 0.2207 0.8209 0.8444 0.9136 0.9242 0.9727 1.0334 1.2462 1.2834 1.8609 1.9029 2.0669 2.0852 2.2482 2.2662 2.6060 2.6086 5.6289 5.6521 5.8366 5.8571 8.6299 8.6438 8.7545 8.8304 9.2103 9.4051 k =-0.3662 0.5371 0.0768 ( 8036 PWs) bands (ev): -10.8232 -10.8232 -10.8090 -10.8090 -10.6913 -10.6913 -10.6779 -10.6779 -3.9166 -3.9147 -3.9060 -3.9038 -3.5314 -3.5289 -3.5280 -3.5261 -2.5273 -2.5200 -2.5055 -2.4986 -1.9358 -1.9354 -1.9256 -1.9238 -1.6582 -1.6572 -1.6518 -1.6510 -0.7469 -0.7318 -0.7124 -0.7022 0.1389 0.1466 0.2073 0.2189 0.8256 0.8421 0.9046 0.9193 0.9751 1.0283 1.2423 1.2787 1.8630 1.9005 2.0637 2.0798 2.2750 2.2897 2.5931 2.5954 5.6383 5.6596 5.8271 5.8455 8.6206 8.6299 8.7622 8.8383 9.2066 9.3910 k =-0.3662 0.5371 0.0896 ( 8033 PWs) bands (ev): -10.8224 -10.8224 -10.8099 -10.8099 -10.6904 -10.6904 -10.6786 -10.6786 -3.9161 -3.9145 -3.9062 -3.9043 -3.5313 -3.5291 -3.5279 -3.5262 -2.5258 -2.5192 -2.5061 -2.5002 -1.9360 -1.9355 -1.9251 -1.9235 -1.6582 -1.6573 -1.6519 -1.6511 -0.7453 -0.7316 -0.7138 -0.7051 0.1469 0.1535 0.2065 0.2168 0.8270 0.8370 0.8984 0.9127 0.9851 1.0264 1.2342 1.2691 1.8697 1.9024 2.0588 2.0725 2.3020 2.3140 2.5786 2.5806 5.6491 5.6683 5.8165 5.8324 8.6117 8.6174 8.7700 8.8430 9.2071 9.3761 k =-0.3662 0.5371 0.1024 ( 8024 PWs) bands (ev): -10.8216 -10.8216 -10.8109 -10.8109 -10.6895 -10.6895 -10.6794 -10.6794 -3.9157 -3.9143 -3.9064 -3.9047 -3.5311 -3.5293 -3.5277 -3.5263 -2.5241 -2.5183 -2.5068 -2.5019 -1.9362 -1.9357 -1.9247 -1.9232 -1.6581 -1.6574 -1.6520 -1.6513 -0.7434 -0.7314 -0.7152 -0.7081 0.1552 0.1606 0.2054 0.2144 0.8246 0.8303 0.8949 0.9052 1.0015 1.0292 1.2218 1.2545 1.8810 1.9087 2.0518 2.0631 2.3285 2.3382 2.5628 2.5645 5.6612 5.6781 5.8049 5.8180 8.6035 8.6067 8.7779 8.8444 9.2116 9.3606 k =-0.3662 0.5371 0.1153 ( 8024 PWs) bands (ev): -10.8207 -10.8207 -10.8119 -10.8119 -10.6885 -10.6885 -10.6802 -10.6802 -3.9153 -3.9142 -3.9066 -3.9052 -3.5310 -3.5295 -3.5276 -3.5264 -2.5223 -2.5174 -2.5076 -2.5038 -1.9363 -1.9359 -1.9243 -1.9230 -1.6581 -1.6575 -1.6521 -1.6515 -0.7414 -0.7312 -0.7166 -0.7111 0.1635 0.1677 0.2040 0.2115 0.8198 0.8232 0.8924 0.8979 1.0224 1.0375 1.2055 1.2355 1.8961 1.9188 2.0428 2.0515 2.3541 2.3619 2.5461 2.5477 5.6744 5.6887 5.7925 5.8027 8.5964 8.5979 8.7859 8.8429 9.2199 9.3445 k =-0.3662 0.5371 0.1281 ( 8034 PWs) bands (ev): -10.8197 -10.8197 -10.8130 -10.8130 -10.6875 -10.6875 -10.6812 -10.6812 -3.9149 -3.9140 -3.9067 -3.9057 -3.5308 -3.5297 -3.5274 -3.5265 -2.5204 -2.5166 -2.5084 -2.5057 -1.9364 -1.9360 -1.9239 -1.9229 -1.6580 -1.6576 -1.6521 -1.6516 -0.7393 -0.7312 -0.7178 -0.7140 0.1715 0.1744 0.2022 0.2081 0.8146 0.8167 0.8899 0.8918 1.0465 1.0512 1.1860 1.2128 1.9140 1.9317 2.0319 2.0378 2.3783 2.3843 2.5290 2.5304 5.6886 5.7001 5.7796 5.7868 8.5906 8.5910 8.7940 8.8389 9.2313 9.3279 k =-0.3662 0.5371 0.1409 ( 8022 PWs) bands (ev): -10.8187 -10.8187 -10.8141 -10.8141 -10.6864 -10.6864 -10.6821 -10.6821 -3.9145 -3.9140 -3.9068 -3.9061 -3.5306 -3.5298 -3.5273 -3.5267 -2.5186 -2.5158 -2.5092 -2.5075 -1.9364 -1.9362 -1.9235 -1.9228 -1.6579 -1.6576 -1.6521 -1.6518 -0.7371 -0.7313 -0.7187 -0.7164 0.1790 0.1805 0.1998 0.2042 0.8102 0.8115 0.8872 0.8873 1.0692 1.0724 1.1644 1.1875 1.9333 1.9461 2.0195 2.0224 2.4002 2.4046 2.5123 2.5137 5.7036 5.7122 5.7664 5.7705 8.5862 8.5862 8.8022 8.8332 9.2451 9.3109 k =-0.3662 0.5371 0.1537 ( 8022 PWs) bands (ev): -10.8176 -10.8176 -10.8153 -10.8153 -10.6854 -10.6854 -10.6831 -10.6831 -3.9142 -3.9139 -3.9068 -3.9064 -3.5304 -3.5300 -3.5271 -3.5268 -2.5169 -2.5154 -2.5098 -2.5090 -1.9364 -1.9363 -1.9232 -1.9229 -1.6578 -1.6577 -1.6521 -1.6519 -0.7350 -0.7320 -0.7192 -0.7182 0.1854 0.1857 0.1973 0.1999 0.8074 0.8081 0.8847 0.8850 1.0898 1.0984 1.1428 1.1610 1.9519 1.9595 2.0069 2.0072 2.4178 2.4204 2.4984 2.4994 5.7189 5.7242 5.7535 5.7545 8.5833 8.5834 8.8104 8.8262 9.2605 9.2938 k =-0.3662 0.5371 0.1665 ( 8018 PWs) bands (ev): -10.8167 -10.8167 -10.8162 -10.8162 -10.6845 -10.6845 -10.6839 -10.6839 -3.9140 -3.9140 -3.9066 -3.9066 -3.5302 -3.5302 -3.5270 -3.5270 -2.5157 -2.5157 -2.5098 -2.5098 -1.9364 -1.9364 -1.9230 -1.9230 -1.6578 -1.6578 -1.6520 -1.6520 -0.7332 -0.7332 -0.7191 -0.7191 0.1885 0.1885 0.1964 0.1964 0.8067 0.8067 0.8840 0.8840 1.1085 1.1085 1.1372 1.1372 1.9641 1.9641 1.9994 1.9994 2.4262 2.4262 2.4927 2.4927 5.7312 5.7312 5.7442 5.7442 8.5825 8.5825 8.8185 8.8185 9.2769 9.2769 k =-0.3662 0.5371 0.1665 ( 8018 PWs) bands (ev): -10.8167 -10.8167 -10.8162 -10.8162 -10.6845 -10.6845 -10.6839 -10.6839 -3.9140 -3.9140 -3.9066 -3.9066 -3.5302 -3.5302 -3.5270 -3.5270 -2.5157 -2.5157 -2.5098 -2.5098 -1.9364 -1.9364 -1.9230 -1.9230 -1.6578 -1.6578 -1.6520 -1.6520 -0.7332 -0.7332 -0.7191 -0.7191 0.1885 0.1885 0.1964 0.1964 0.8067 0.8067 0.8840 0.8840 1.1085 1.1085 1.1372 1.1372 1.9641 1.9641 1.9994 1.9994 2.4262 2.4262 2.4927 2.4927 5.7312 5.7312 5.7442 5.7442 8.5825 8.5825 8.8185 8.8185 9.2769 9.2769 k =-0.3732 0.5268 0.1665 ( 8018 PWs) bands (ev): -10.8125 -10.8125 -10.8121 -10.8121 -10.6848 -10.6848 -10.6843 -10.6843 -3.9111 -3.9111 -3.9041 -3.9041 -3.5313 -3.5313 -3.5281 -3.5281 -2.5160 -2.5160 -2.5107 -2.5107 -1.9336 -1.9336 -1.9207 -1.9207 -1.6592 -1.6592 -1.6536 -1.6536 -0.7269 -0.7269 -0.7130 -0.7130 0.1672 0.1672 0.1754 0.1754 0.7955 0.7955 0.8782 0.8782 1.1225 1.1225 1.1558 1.1558 1.9570 1.9570 1.9891 1.9891 2.4355 2.4355 2.5035 2.5035 5.7163 5.7163 5.7288 5.7288 8.5516 8.5516 8.7845 8.7845 9.2857 9.2857 k =-0.3803 0.5165 0.1665 ( 8020 PWs) bands (ev): -10.8086 -10.8086 -10.8083 -10.8083 -10.6851 -10.6851 -10.6847 -10.6847 -3.9083 -3.9083 -3.9017 -3.9017 -3.5324 -3.5324 -3.5293 -3.5293 -2.5164 -2.5164 -2.5117 -2.5117 -1.9308 -1.9308 -1.9184 -1.9184 -1.6606 -1.6606 -1.6552 -1.6552 -0.7203 -0.7203 -0.7067 -0.7067 0.1465 0.1465 0.1549 0.1549 0.7864 0.7864 0.8744 0.8744 1.1339 1.1339 1.1767 1.1767 1.9501 1.9501 1.9816 1.9816 2.4432 2.4432 2.5128 2.5128 5.7014 5.7014 5.7134 5.7134 8.5185 8.5185 8.7430 8.7430 9.3015 9.3015 k =-0.3873 0.5062 0.1665 ( 8022 PWs) bands (ev): -10.8050 -10.8050 -10.8048 -10.8048 -10.6854 -10.6854 -10.6851 -10.6851 -3.9057 -3.9057 -3.8994 -3.8994 -3.5335 -3.5335 -3.5305 -3.5305 -2.5169 -2.5169 -2.5128 -2.5128 -1.9282 -1.9282 -1.9163 -1.9163 -1.6620 -1.6620 -1.6568 -1.6568 -0.7137 -0.7137 -0.7003 -0.7003 0.1265 0.1265 0.1350 0.1350 0.7793 0.7793 0.8723 0.8723 1.1433 1.1433 1.1984 1.1984 1.9433 1.9433 1.9779 1.9779 2.4493 2.4493 2.5206 2.5206 5.6864 5.6864 5.6980 5.6980 8.4835 8.4835 8.6964 8.6964 9.3227 9.3227 k =-0.3944 0.4958 0.1665 ( 8022 PWs) bands (ev): -10.8017 -10.8017 -10.8015 -10.8015 -10.6856 -10.6856 -10.6854 -10.6854 -3.9032 -3.9032 -3.8973 -3.8973 -3.5347 -3.5347 -3.5317 -3.5317 -2.5175 -2.5175 -2.5139 -2.5139 -1.9257 -1.9257 -1.9143 -1.9143 -1.6634 -1.6634 -1.6583 -1.6583 -0.7071 -0.7071 -0.6939 -0.6939 0.1072 0.1072 0.1158 0.1158 0.7742 0.7742 0.8719 0.8719 1.1512 1.1512 1.2198 1.2198 1.9370 1.9370 1.9779 1.9779 2.4537 2.4537 2.5265 2.5265 5.6716 5.6716 5.6827 5.6827 8.4473 8.4473 8.6465 8.6465 9.3477 9.3477 k =-0.4014 0.4855 0.1665 ( 8014 PWs) bands (ev): -10.7986 -10.7986 -10.7985 -10.7985 -10.6858 -10.6858 -10.6857 -10.6857 -3.9008 -3.9008 -3.8953 -3.8953 -3.5358 -3.5358 -3.5329 -3.5329 -2.5182 -2.5182 -2.5151 -2.5151 -1.9232 -1.9232 -1.9125 -1.9125 -1.6648 -1.6648 -1.6599 -1.6599 -0.7004 -0.7004 -0.6874 -0.6874 0.0887 0.0887 0.0974 0.0974 0.7711 0.7711 0.8729 0.8729 1.1579 1.1579 1.2399 1.2399 1.9319 1.9319 1.9813 1.9813 2.4563 2.4563 2.5306 2.5306 5.6570 5.6570 5.6677 5.6677 8.4103 8.4103 8.5949 8.5949 9.3754 9.3754 k =-0.4085 0.4752 0.1665 ( 8006 PWs) bands (ev): -10.7958 -10.7958 -10.7958 -10.7958 -10.6860 -10.6860 -10.6860 -10.6860 -3.8986 -3.8986 -3.8935 -3.8935 -3.5369 -3.5369 -3.5342 -3.5342 -2.5189 -2.5189 -2.5162 -2.5162 -1.9209 -1.9209 -1.9108 -1.9108 -1.6662 -1.6662 -1.6614 -1.6614 -0.6939 -0.6939 -0.6812 -0.6812 0.0712 0.0712 0.0799 0.0799 0.7699 0.7699 0.8751 0.8751 1.1633 1.1633 1.2582 1.2582 1.9289 1.9289 1.9878 1.9878 2.4572 2.4572 2.5328 2.5328 5.6427 5.6427 5.6529 5.6529 8.3731 8.3731 8.5428 8.5428 9.4050 9.4050 k =-0.4155 0.4648 0.1665 ( 8010 PWs) bands (ev): -10.7934 -10.7934 -10.7933 -10.7933 -10.6863 -10.6863 -10.6862 -10.6862 -3.8965 -3.8965 -3.8918 -3.8918 -3.5380 -3.5380 -3.5354 -3.5354 -2.5197 -2.5197 -2.5174 -2.5174 -1.9186 -1.9186 -1.9092 -1.9092 -1.6675 -1.6675 -1.6629 -1.6629 -0.6875 -0.6875 -0.6751 -0.6751 0.0546 0.0546 0.0633 0.0633 0.7705 0.7705 0.8782 0.8782 1.1677 1.1677 1.2740 1.2740 1.9285 1.9285 1.9967 1.9967 2.4562 2.4562 2.5330 2.5330 5.6289 5.6289 5.6386 5.6386 8.3364 8.3364 8.4911 8.4911 9.4357 9.4357 k =-0.4225 0.4545 0.1665 ( 8006 PWs) bands (ev): -10.7911 -10.7911 -10.7910 -10.7910 -10.6865 -10.6865 -10.6863 -10.6863 -3.8946 -3.8946 -3.8903 -3.8903 -3.5390 -3.5390 -3.5366 -3.5366 -2.5205 -2.5205 -2.5185 -2.5185 -1.9165 -1.9165 -1.9078 -1.9078 -1.6687 -1.6687 -1.6644 -1.6644 -0.6814 -0.6814 -0.6693 -0.6693 0.0392 0.0392 0.0477 0.0477 0.7728 0.7728 0.8818 0.8818 1.1712 1.1712 1.2869 1.2869 1.9312 1.9312 2.0079 2.0079 2.4537 2.4537 2.5312 2.5312 5.6156 5.6156 5.6249 5.6249 8.3007 8.3007 8.4406 8.4406 9.4672 9.4672 k =-0.4296 0.4442 0.1665 ( 8014 PWs) bands (ev): -10.7892 -10.7892 -10.7890 -10.7890 -10.6867 -10.6867 -10.6865 -10.6865 -3.8928 -3.8928 -3.8889 -3.8889 -3.5399 -3.5399 -3.5377 -3.5377 -2.5213 -2.5213 -2.5196 -2.5196 -1.9145 -1.9145 -1.9065 -1.9065 -1.6698 -1.6698 -1.6657 -1.6657 -0.6755 -0.6755 -0.6639 -0.6639 0.0249 0.0249 0.0332 0.0332 0.7767 0.7767 0.8857 0.8857 1.1743 1.1743 1.2965 1.2965 1.9371 1.9371 2.0208 2.0208 2.4496 2.4496 2.5275 2.5275 5.6031 5.6031 5.6118 5.6118 8.2666 8.2666 8.3921 8.3921 9.4989 9.4989 k =-0.4366 0.4338 0.1665 ( 8010 PWs) bands (ev): -10.7874 -10.7874 -10.7872 -10.7872 -10.6868 -10.6868 -10.6866 -10.6866 -3.8912 -3.8912 -3.8877 -3.8877 -3.5408 -3.5408 -3.5388 -3.5388 -2.5221 -2.5221 -2.5206 -2.5206 -1.9127 -1.9127 -1.9054 -1.9054 -1.6708 -1.6708 -1.6670 -1.6670 -0.6699 -0.6699 -0.6589 -0.6589 0.0118 0.0118 0.0197 0.0197 0.7820 0.7820 0.8894 0.8894 1.1771 1.1771 1.3026 1.3026 1.9461 1.9461 2.0350 2.0350 2.4442 2.4442 2.5219 2.5219 5.5914 5.5914 5.5995 5.5995 8.2346 8.2346 8.3461 8.3461 9.5305 9.5305 k =-0.4437 0.4235 0.1665 ( 8024 PWs) bands (ev): -10.7858 -10.7858 -10.7856 -10.7856 -10.6869 -10.6869 -10.6867 -10.6867 -3.8897 -3.8897 -3.8866 -3.8866 -3.5417 -3.5417 -3.5398 -3.5398 -2.5228 -2.5228 -2.5216 -2.5216 -1.9110 -1.9110 -1.9044 -1.9044 -1.6717 -1.6717 -1.6682 -1.6682 -0.6646 -0.6646 -0.6544 -0.6544 0.0001 0.0001 0.0075 0.0075 0.7886 0.7886 0.8924 0.8924 1.1802 1.1802 1.3054 1.3054 1.9583 1.9583 2.0497 2.0497 2.4379 2.4379 2.5145 2.5145 5.5806 5.5806 5.5881 5.5881 8.2052 8.2052 8.3031 8.3031 9.5616 9.5616 k =-0.4507 0.4132 0.1665 ( 8026 PWs) bands (ev): -10.7845 -10.7845 -10.7842 -10.7842 -10.6870 -10.6870 -10.6868 -10.6868 -3.8884 -3.8884 -3.8857 -3.8857 -3.5424 -3.5424 -3.5407 -3.5407 -2.5235 -2.5235 -2.5225 -2.5225 -1.9094 -1.9094 -1.9036 -1.9036 -1.6725 -1.6725 -1.6693 -1.6693 -0.6598 -0.6598 -0.6504 -0.6504 -0.0104 -0.0104 -0.0036 -0.0036 0.7964 0.7964 0.8944 0.8944 1.1840 1.1840 1.3048 1.3048 1.9730 1.9730 2.0643 2.0643 2.4312 2.4312 2.5056 2.5056 5.5709 5.5709 5.5776 5.5776 8.1787 8.1787 8.2635 8.2635 9.5920 9.5920 k =-0.4577 0.4029 0.1665 ( 8038 PWs) bands (ev): -10.7833 -10.7833 -10.7831 -10.7831 -10.6871 -10.6871 -10.6869 -10.6869 -3.8873 -3.8873 -3.8849 -3.8849 -3.5430 -3.5430 -3.5416 -3.5416 -2.5241 -2.5241 -2.5233 -2.5233 -1.9080 -1.9080 -1.9030 -1.9030 -1.6731 -1.6731 -1.6703 -1.6703 -0.6554 -0.6554 -0.6470 -0.6470 -0.0194 -0.0194 -0.0133 -0.0133 0.8051 0.8051 0.8951 0.8951 1.1887 1.1887 1.3013 1.3013 1.9898 1.9898 2.0780 2.0780 2.4245 2.4245 2.4952 2.4952 5.5624 5.5624 5.5682 5.5682 8.1558 8.1558 8.2277 8.2277 9.6211 9.6211 k =-0.4648 0.3925 0.1665 ( 8042 PWs) bands (ev): -10.7824 -10.7824 -10.7822 -10.7822 -10.6871 -10.6871 -10.6869 -10.6869 -3.8863 -3.8863 -3.8843 -3.8843 -3.5436 -3.5436 -3.5423 -3.5423 -2.5247 -2.5247 -2.5240 -2.5240 -1.9067 -1.9067 -1.9025 -1.9025 -1.6736 -1.6736 -1.6712 -1.6712 -0.6514 -0.6514 -0.6442 -0.6442 -0.0270 -0.0270 -0.0218 -0.0218 0.8146 0.8146 0.8942 0.8942 1.1947 1.1947 1.2952 1.2952 2.0080 2.0080 2.0897 2.0897 2.4186 2.4186 2.4837 2.4837 5.5551 5.5551 5.5601 5.5601 8.1366 8.1366 8.1961 8.1961 9.6487 9.6487 k =-0.4718 0.3822 0.1665 ( 8034 PWs) bands (ev): -10.7816 -10.7816 -10.7814 -10.7814 -10.6872 -10.6872 -10.6870 -10.6870 -3.8854 -3.8854 -3.8838 -3.8838 -3.5440 -3.5440 -3.5430 -3.5430 -2.5251 -2.5251 -2.5246 -2.5246 -1.9056 -1.9056 -1.9022 -1.9022 -1.6740 -1.6740 -1.6720 -1.6720 -0.6480 -0.6480 -0.6420 -0.6420 -0.0332 -0.0332 -0.0289 -0.0289 0.8246 0.8246 0.8915 0.8915 1.2021 1.2021 1.2871 1.2871 2.0268 2.0268 2.0985 2.0985 2.4144 2.4144 2.4715 2.4715 5.5491 5.5491 5.5531 5.5531 8.1215 8.1215 8.1688 8.1688 9.6742 9.6742 k =-0.4789 0.3719 0.1665 ( 8032 PWs) bands (ev): -10.7810 -10.7810 -10.7808 -10.7808 -10.6872 -10.6872 -10.6870 -10.6870 -3.8847 -3.8847 -3.8835 -3.8835 -3.5443 -3.5443 -3.5435 -3.5435 -2.5255 -2.5255 -2.5251 -2.5251 -1.9046 -1.9046 -1.9021 -1.9021 -1.6742 -1.6742 -1.6727 -1.6727 -0.6451 -0.6451 -0.6405 -0.6405 -0.0379 -0.0379 -0.0345 -0.0345 0.8349 0.8349 0.8870 0.8870 1.2108 1.2108 1.2774 1.2774 2.0455 2.0455 2.1036 2.1036 2.4126 2.4126 2.4590 2.4590 5.5445 5.5445 5.5476 5.5476 8.1108 8.1108 8.1460 8.1460 9.6972 9.6972 k =-0.4859 0.3615 0.1665 ( 8040 PWs) bands (ev): -10.7805 -10.7805 -10.7804 -10.7804 -10.6872 -10.6872 -10.6871 -10.6871 -3.8841 -3.8841 -3.8833 -3.8833 -3.5444 -3.5444 -3.5439 -3.5439 -2.5257 -2.5257 -2.5255 -2.5255 -1.9038 -1.9038 -1.9021 -1.9021 -1.6743 -1.6743 -1.6733 -1.6733 -0.6428 -0.6428 -0.6397 -0.6397 -0.0411 -0.0411 -0.0388 -0.0388 0.8452 0.8452 0.8809 0.8809 1.2208 1.2208 1.2665 1.2665 2.0630 2.0630 2.1041 2.1041 2.4138 2.4138 2.4467 2.4467 5.5413 5.5413 5.5434 5.5434 8.1046 8.1046 8.1280 8.1280 9.7171 9.7171 k =-0.4930 0.3512 0.1665 ( 8044 PWs) bands (ev): -10.7802 -10.7802 -10.7802 -10.7802 -10.6872 -10.6872 -10.6871 -10.6871 -3.8837 -3.8837 -3.8833 -3.8833 -3.5445 -3.5445 -3.5443 -3.5443 -2.5259 -2.5259 -2.5257 -2.5257 -1.9031 -1.9031 -1.9023 -1.9023 -1.6742 -1.6742 -1.6737 -1.6737 -0.6411 -0.6411 -0.6395 -0.6395 -0.0427 -0.0427 -0.0416 -0.0416 0.8553 0.8553 0.8734 0.8734 1.2317 1.2317 1.2550 1.2550 2.0786 2.0786 2.0999 2.0999 2.4182 2.4182 2.4353 2.4353 5.5396 5.5396 5.5406 5.5406 8.1032 8.1032 8.1149 8.1149 9.7334 9.7334 k =-0.5000 0.3409 0.1665 ( 8056 PWs) bands (ev): -10.7801 -10.7801 -10.7801 -10.7801 -10.6871 -10.6871 -10.6871 -10.6871 -3.8834 -3.8834 -3.8834 -3.8834 -3.5444 -3.5444 -3.5444 -3.5444 -2.5259 -2.5259 -2.5259 -2.5259 -1.9026 -1.9026 -1.9026 -1.9026 -1.6740 -1.6740 -1.6740 -1.6740 -0.6400 -0.6400 -0.6400 -0.6400 -0.0429 -0.0429 -0.0429 -0.0429 0.8648 0.8648 0.8648 0.8648 1.2432 1.2432 1.2432 1.2432 2.0911 2.0911 2.0911 2.0911 2.4255 2.4255 2.4255 2.4255 5.5394 5.5394 5.5394 5.5394 8.1066 8.1066 8.1066 8.1066 9.7454 9.7454 k =-0.5000 0.3409 0.1665 ( 8056 PWs) bands (ev): -10.7801 -10.7801 -10.7801 -10.7801 -10.6871 -10.6871 -10.6871 -10.6871 -3.8834 -3.8834 -3.8834 -3.8834 -3.5444 -3.5444 -3.5444 -3.5444 -2.5259 -2.5259 -2.5259 -2.5259 -1.9026 -1.9026 -1.9026 -1.9026 -1.6740 -1.6740 -1.6740 -1.6740 -0.6400 -0.6400 -0.6400 -0.6400 -0.0429 -0.0429 -0.0429 -0.0429 0.8648 0.8648 0.8648 0.8648 1.2432 1.2432 1.2432 1.2432 2.0911 2.0911 2.0911 2.0911 2.4255 2.4255 2.4255 2.4255 5.5394 5.5394 5.5394 5.5394 8.1066 8.1066 8.1066 8.1066 9.7454 9.7454 k =-0.5000 0.3409 0.1537 ( 8044 PWs) bands (ev): -10.7811 -10.7811 -10.7792 -10.7792 -10.6883 -10.6883 -10.6860 -10.6860 -3.8845 -3.8845 -3.8823 -3.8823 -3.5446 -3.5446 -3.5443 -3.5443 -2.5281 -2.5281 -2.5236 -2.5236 -1.9028 -1.9028 -1.9025 -1.9025 -1.6742 -1.6742 -1.6739 -1.6739 -0.6443 -0.6443 -0.6360 -0.6360 -0.0536 -0.0536 -0.0306 -0.0306 0.8504 0.8504 0.8784 0.8784 1.2336 1.2336 1.2516 1.2516 2.0701 2.0701 2.1115 2.1115 2.4117 2.4117 2.4414 2.4414 5.5232 5.5232 5.5541 5.5541 8.0774 8.0774 8.1372 8.1372 9.7076 9.7076 k =-0.5000 0.3409 0.1409 ( 8048 PWs) bands (ev): -10.7820 -10.7820 -10.7782 -10.7782 -10.6894 -10.6894 -10.6850 -10.6850 -3.8855 -3.8855 -3.8813 -3.8813 -3.5448 -3.5448 -3.5441 -3.5441 -2.5303 -2.5303 -2.5214 -2.5214 -1.9030 -1.9030 -1.9024 -1.9024 -1.6743 -1.6743 -1.6738 -1.6738 -0.6490 -0.6490 -0.6325 -0.6325 -0.0625 -0.0625 -0.0169 -0.0169 0.8357 0.8357 0.8909 0.8909 1.2231 1.2231 1.2587 1.2587 2.0486 2.0486 2.1311 2.1311 2.4002 2.4002 2.4589 2.4589 5.5058 5.5058 5.5672 5.5672 8.0501 8.0501 8.1687 8.1687 9.6710 9.6710 k =-0.5000 0.3409 0.1281 ( 8034 PWs) bands (ev): -10.7829 -10.7829 -10.7772 -10.7772 -10.6905 -10.6905 -10.6839 -10.6839 -3.8865 -3.8865 -3.8802 -3.8802 -3.5450 -3.5450 -3.5439 -3.5439 -2.5325 -2.5325 -2.5193 -2.5193 -1.9032 -1.9032 -1.9023 -1.9023 -1.6744 -1.6744 -1.6737 -1.6737 -0.6537 -0.6537 -0.6295 -0.6295 -0.0695 -0.0695 -0.0020 -0.0020 0.8210 0.8210 0.9019 0.9019 1.2119 1.2119 1.2648 1.2648 2.0268 2.0268 2.1495 2.1495 2.3915 2.3915 2.4773 2.4773 5.4877 5.4877 5.5784 5.5784 8.0248 8.0248 8.2005 8.2005 9.6361 9.6361 k =-0.5000 0.3409 0.1153 ( 8036 PWs) bands (ev): -10.7837 -10.7837 -10.7762 -10.7762 -10.6916 -10.6916 -10.6830 -10.6830 -3.8875 -3.8875 -3.8792 -3.8792 -3.5451 -3.5451 -3.5438 -3.5438 -2.5345 -2.5345 -2.5172 -2.5172 -1.9035 -1.9035 -1.9023 -1.9023 -1.6745 -1.6745 -1.6737 -1.6737 -0.6585 -0.6585 -0.6271 -0.6271 -0.0747 -0.0747 0.0136 0.0136 0.8067 0.8067 0.9110 0.9110 1.2003 1.2003 1.2700 1.2700 2.0050 2.0050 2.1668 2.1668 2.3856 2.3856 2.4961 2.4961 5.4694 5.4694 5.5878 5.5878 8.0020 8.0020 8.2321 8.2321 9.6033 9.6033 k =-0.5000 0.3409 0.1024 ( 8042 PWs) bands (ev): -10.7845 -10.7845 -10.7753 -10.7753 -10.6927 -10.6927 -10.6821 -10.6821 -3.8884 -3.8884 -3.8782 -3.8782 -3.5453 -3.5453 -3.5436 -3.5436 -2.5364 -2.5364 -2.5153 -2.5153 -1.9038 -1.9038 -1.9024 -1.9024 -1.6746 -1.6746 -1.6736 -1.6736 -0.6631 -0.6631 -0.6253 -0.6253 -0.0782 -0.0782 0.0296 0.0296 0.7929 0.7929 0.9179 0.9179 1.1888 1.1888 1.2748 1.2748 1.9834 1.9834 2.1826 2.1826 2.3823 2.3823 2.5147 2.5147 5.4511 5.4511 5.5953 5.5953 7.9816 7.9816 8.2629 8.2629 9.5729 9.5729 k =-0.5000 0.3409 0.0896 ( 8034 PWs) bands (ev): -10.7852 -10.7852 -10.7744 -10.7744 -10.6937 -10.6937 -10.6813 -10.6813 -3.8892 -3.8892 -3.8773 -3.8773 -3.5455 -3.5455 -3.5435 -3.5435 -2.5382 -2.5382 -2.5135 -2.5135 -1.9041 -1.9041 -1.9025 -1.9025 -1.6747 -1.6747 -1.6735 -1.6735 -0.6674 -0.6674 -0.6240 -0.6240 -0.0803 -0.0803 0.0455 0.0455 0.7800 0.7800 0.9225 0.9225 1.1776 1.1776 1.2794 1.2794 1.9624 1.9624 2.1967 2.1967 2.3814 2.3814 2.5325 2.5325 5.4336 5.4336 5.6012 5.6012 7.9638 7.9638 8.2920 8.2920 9.5455 9.5455 k =-0.5000 0.3409 0.0768 ( 8024 PWs) bands (ev): -10.7858 -10.7858 -10.7736 -10.7736 -10.6946 -10.6946 -10.6806 -10.6806 -3.8899 -3.8899 -3.8765 -3.8765 -3.5456 -3.5456 -3.5434 -3.5434 -2.5398 -2.5398 -2.5119 -2.5119 -1.9043 -1.9043 -1.9026 -1.9026 -1.6748 -1.6748 -1.6735 -1.6735 -0.6714 -0.6714 -0.6232 -0.6232 -0.0810 -0.0810 0.0607 0.0607 0.7682 0.7682 0.9250 0.9250 1.1671 1.1671 1.2843 1.2843 1.9425 1.9425 2.2092 2.2092 2.3823 2.3823 2.5492 2.5492 5.4172 5.4172 5.6055 5.6055 7.9486 7.9486 8.3189 8.3189 9.5212 9.5212 k =-0.5000 0.3409 0.0640 ( 8018 PWs) bands (ev): -10.7863 -10.7863 -10.7728 -10.7728 -10.6954 -10.6954 -10.6800 -10.6800 -3.8905 -3.8905 -3.8758 -3.8758 -3.5457 -3.5457 -3.5433 -3.5433 -2.5412 -2.5412 -2.5105 -2.5105 -1.9046 -1.9046 -1.9027 -1.9027 -1.6749 -1.6749 -1.6734 -1.6734 -0.6750 -0.6750 -0.6228 -0.6228 -0.0809 -0.0809 0.0749 0.0749 0.7577 0.7577 0.9256 0.9256 1.1576 1.1576 1.2893 1.2893 1.9242 1.9242 2.2200 2.2200 2.3844 2.3844 2.5641 2.5641 5.4023 5.4023 5.6085 5.6085 7.9360 7.9360 8.3430 8.3430 9.5002 9.5002 k =-0.5000 0.3409 0.0512 ( 8020 PWs) bands (ev): -10.7867 -10.7867 -10.7722 -10.7722 -10.6961 -10.6961 -10.6795 -10.6795 -3.8910 -3.8910 -3.8752 -3.8752 -3.5458 -3.5458 -3.5432 -3.5432 -2.5423 -2.5423 -2.5093 -2.5093 -1.9048 -1.9048 -1.9028 -1.9028 -1.6750 -1.6750 -1.6734 -1.6734 -0.6780 -0.6780 -0.6226 -0.6226 -0.0801 -0.0801 0.0873 0.0873 0.7488 0.7488 0.9248 0.9248 1.1492 1.1492 1.2944 1.2944 1.9080 1.9080 2.2288 2.2288 2.3871 2.3871 2.5770 2.5770 5.3896 5.3896 5.6105 5.6105 7.9258 7.9258 8.3635 8.3635 9.4829 9.4829 k =-0.5000 0.3409 0.0384 ( 8012 PWs) bands (ev): -10.7871 -10.7871 -10.7717 -10.7717 -10.6967 -10.6967 -10.6791 -10.6791 -3.8915 -3.8915 -3.8748 -3.8748 -3.5459 -3.5459 -3.5431 -3.5431 -2.5433 -2.5433 -2.5084 -2.5084 -1.9049 -1.9049 -1.9029 -1.9029 -1.6751 -1.6751 -1.6734 -1.6734 -0.6804 -0.6804 -0.6225 -0.6225 -0.0792 -0.0792 0.0977 0.0977 0.7416 0.7416 0.9234 0.9234 1.1423 1.1423 1.2991 1.2991 1.8946 1.8946 2.2358 2.2358 2.3899 2.3899 2.5873 2.5873 5.3792 5.3792 5.6117 5.6117 7.9180 7.9180 8.3801 8.3801 9.4693 9.4693 k =-0.5000 0.3409 0.0256 ( 8006 PWs) bands (ev): -10.7873 -10.7873 -10.7713 -10.7713 -10.6971 -10.6971 -10.6788 -10.6788 -3.8918 -3.8918 -3.8744 -3.8744 -3.5459 -3.5459 -3.5431 -3.5431 -2.5439 -2.5439 -2.5077 -2.5077 -1.9050 -1.9050 -1.9030 -1.9030 -1.6751 -1.6751 -1.6733 -1.6733 -0.6822 -0.6822 -0.6226 -0.6226 -0.0782 -0.0782 0.1054 0.1054 0.7363 0.7363 0.9219 0.9219 1.1371 1.1371 1.3029 1.3029 1.8845 1.8845 2.2409 2.2409 2.3922 2.3922 2.5949 2.5949 5.3716 5.3716 5.6124 5.6124 7.9125 7.9125 8.3923 8.3923 9.4595 9.4595 k =-0.5000 0.3409 0.0128 ( 8012 PWs) bands (ev): -10.7875 -10.7875 -10.7711 -10.7711 -10.6973 -10.6973 -10.6786 -10.6786 -3.8919 -3.8919 -3.8742 -3.8742 -3.5460 -3.5460 -3.5431 -3.5431 -2.5443 -2.5443 -2.5073 -2.5073 -1.9051 -1.9051 -1.9030 -1.9030 -1.6752 -1.6752 -1.6733 -1.6733 -0.6832 -0.6832 -0.6226 -0.6226 -0.0775 -0.0775 0.1102 0.1102 0.7330 0.7330 0.9208 0.9208 1.1339 1.1339 1.3054 1.3054 1.8782 1.8782 2.2439 2.2439 2.3937 2.3937 2.5996 2.5996 5.3669 5.3669 5.6128 5.6128 7.9092 7.9092 8.3997 8.3997 9.4536 9.4536 k =-0.5000 0.3409 0.0000 ( 8004 PWs) bands (ev): -10.7875 -10.7875 -10.7710 -10.7710 -10.6974 -10.6974 -10.6785 -10.6785 -3.8920 -3.8920 -3.8741 -3.8741 -3.5460 -3.5460 -3.5431 -3.5431 -2.5445 -2.5445 -2.5071 -2.5071 -1.9052 -1.9052 -1.9030 -1.9030 -1.6752 -1.6752 -1.6733 -1.6733 -0.6836 -0.6836 -0.6227 -0.6227 -0.0773 -0.0773 0.1118 0.1118 0.7320 0.7320 0.9204 0.9204 1.1329 1.1329 1.3063 1.3063 1.8761 1.8761 2.2450 2.2450 2.3943 2.3943 2.6012 2.6012 5.3654 5.3654 5.6129 5.6129 7.9081 7.9081 8.4022 8.4022 9.4516 9.4516 k = 0.0000 0.0000 0.1665 ( 8032 PWs) bands (ev): -11.1431 -11.1431 -11.1431 -11.1431 -10.7023 -10.7023 -10.7023 -10.7023 -4.0559 -4.0559 -4.0559 -4.0559 -3.5854 -3.5854 -3.5854 -3.5854 -2.6099 -2.6099 -2.6099 -2.6099 -2.0395 -2.0395 -2.0395 -2.0395 -1.6695 -1.6695 -1.6695 -1.6695 -0.5578 -0.5578 -0.5578 -0.5578 0.9821 0.9821 0.9821 0.9821 1.9201 1.9201 1.9201 1.9201 2.1558 2.1558 2.1558 2.1558 2.3133 2.3133 2.3133 2.3133 2.6653 2.6653 2.6653 2.6653 5.4068 5.4068 5.4068 5.4068 7.5490 7.5490 7.5490 7.5490 9.1373 9.1373 k =-0.0109 0.0074 0.1665 ( 8024 PWs) bands (ev): -11.1427 -11.1427 -11.1427 -11.1427 -10.7023 -10.7023 -10.7023 -10.7023 -4.0557 -4.0557 -4.0556 -4.0556 -3.5853 -3.5853 -3.5853 -3.5853 -2.6097 -2.6097 -2.6096 -2.6096 -2.0394 -2.0394 -2.0394 -2.0394 -1.6696 -1.6696 -1.6696 -1.6696 -0.5582 -0.5582 -0.5582 -0.5582 0.9803 0.9803 0.9809 0.9809 1.9193 1.9193 1.9211 1.9211 2.1539 2.1539 2.1554 2.1554 2.3121 2.3121 2.3132 2.3132 2.6626 2.6626 2.6635 2.6635 5.4089 5.4089 5.4090 5.4090 7.5521 7.5521 7.5523 7.5523 9.1393 9.1393 k =-0.0217 0.0148 0.1665 ( 8022 PWs) bands (ev): -11.1415 -11.1415 -11.1415 -11.1415 -10.7022 -10.7022 -10.7022 -10.7022 -4.0550 -4.0550 -4.0550 -4.0550 -3.5851 -3.5851 -3.5851 -3.5851 -2.6089 -2.6089 -2.6088 -2.6088 -2.0388 -2.0388 -2.0388 -2.0388 -1.6701 -1.6701 -1.6701 -1.6701 -0.5596 -0.5596 -0.5596 -0.5596 0.9756 0.9756 0.9767 0.9767 1.9185 1.9185 1.9221 1.9221 2.1497 2.1497 2.1528 2.1528 2.3097 2.3097 2.3120 2.3120 2.6557 2.6557 2.6575 2.6575 5.4151 5.4151 5.4153 5.4153 7.5615 7.5615 7.5619 7.5619 9.1457 9.1457 k =-0.0326 0.0222 0.1665 ( 8026 PWs) bands (ev): -11.1395 -11.1395 -11.1395 -11.1395 -10.7021 -10.7021 -10.7021 -10.7021 -4.0540 -4.0540 -4.0539 -4.0539 -3.5847 -3.5847 -3.5847 -3.5847 -2.6076 -2.6076 -2.6074 -2.6074 -2.0379 -2.0379 -2.0379 -2.0379 -1.6709 -1.6709 -1.6709 -1.6709 -0.5619 -0.5619 -0.5618 -0.5618 0.9680 0.9680 0.9697 0.9697 1.9176 1.9176 1.9232 1.9232 2.1430 2.1430 2.1480 2.1480 2.3061 2.3061 2.3100 2.3100 2.6446 2.6446 2.6474 2.6474 5.4252 5.4252 5.4256 5.4256 7.5771 7.5771 7.5777 7.5777 9.1562 9.1562 k =-0.0435 0.0296 0.1665 ( 8020 PWs) bands (ev): -11.1368 -11.1368 -11.1368 -11.1368 -10.7020 -10.7020 -10.7020 -10.7020 -4.0526 -4.0526 -4.0525 -4.0525 -3.5841 -3.5841 -3.5841 -3.5841 -2.6057 -2.6057 -2.6054 -2.6054 -2.0367 -2.0367 -2.0367 -2.0367 -1.6720 -1.6720 -1.6720 -1.6720 -0.5651 -0.5651 -0.5650 -0.5650 0.9577 0.9577 0.9599 0.9599 1.9164 1.9164 1.9242 1.9242 2.1334 2.1334 2.1410 2.1410 2.3015 2.3015 2.3072 2.3072 2.6297 2.6297 2.6337 2.6337 5.4391 5.4391 5.4396 5.4396 7.5986 7.5986 7.5995 7.5995 9.1709 9.1709 k =-0.0543 0.0371 0.1665 ( 8016 PWs) bands (ev): -11.1333 -11.1333 -11.1333 -11.1333 -10.7018 -10.7018 -10.7018 -10.7018 -4.0507 -4.0507 -4.0506 -4.0506 -3.5834 -3.5834 -3.5834 -3.5834 -2.6033 -2.6033 -2.6029 -2.6029 -2.0351 -2.0351 -2.0351 -2.0351 -1.6734 -1.6734 -1.6734 -1.6734 -0.5692 -0.5692 -0.5690 -0.5690 0.9449 0.9449 0.9476 0.9476 1.9147 1.9147 1.9249 1.9249 2.1209 2.1209 2.1315 2.1315 2.2958 2.2958 2.3041 2.3041 2.6114 2.6114 2.6167 2.6167 5.4564 5.4564 5.4570 5.4570 7.6258 7.6258 7.6268 7.6268 9.1895 9.1895 k =-0.0652 0.0445 0.1665 ( 8026 PWs) bands (ev): -11.1291 -11.1291 -11.1291 -11.1291 -10.7016 -10.7016 -10.7016 -10.7016 -4.0485 -4.0485 -4.0484 -4.0484 -3.5825 -3.5825 -3.5825 -3.5825 -2.6004 -2.6004 -2.6000 -2.6000 -2.0331 -2.0331 -2.0331 -2.0331 -1.6751 -1.6751 -1.6750 -1.6750 -0.5741 -0.5741 -0.5740 -0.5740 0.9298 0.9298 0.9329 0.9329 1.9121 1.9121 1.9252 1.9252 2.1051 2.1051 2.1198 2.1198 2.2892 2.2892 2.3006 2.3006 2.5902 2.5902 2.5971 2.5971 5.4768 5.4768 5.4774 5.4774 7.6581 7.6581 7.6593 7.6593 9.2118 9.2118 k =-0.0761 0.0519 0.1665 ( 8032 PWs) bands (ev): -11.1241 -11.1241 -11.1241 -11.1241 -10.7013 -10.7013 -10.7013 -10.7013 -4.0459 -4.0459 -4.0457 -4.0457 -3.5815 -3.5815 -3.5815 -3.5815 -2.5970 -2.5970 -2.5966 -2.5966 -2.0309 -2.0309 -2.0308 -2.0308 -1.6770 -1.6770 -1.6770 -1.6770 -0.5799 -0.5799 -0.5798 -0.5798 0.9125 0.9125 0.9161 0.9161 1.9082 1.9082 1.9248 1.9248 2.0862 2.0862 2.1059 2.1059 2.2816 2.2816 2.2969 2.2969 2.5668 2.5668 2.5756 2.5756 5.4996 5.4996 5.5004 5.5004 7.6952 7.6952 7.6964 7.6964 9.2376 9.2376 k =-0.0870 0.0593 0.1665 ( 8036 PWs) bands (ev): -11.1184 -11.1184 -11.1184 -11.1184 -10.7011 -10.7011 -10.7010 -10.7010 -4.0429 -4.0429 -4.0427 -4.0427 -3.5804 -3.5804 -3.5804 -3.5804 -2.5932 -2.5932 -2.5927 -2.5927 -2.0283 -2.0283 -2.0283 -2.0283 -1.6792 -1.6792 -1.6791 -1.6791 -0.5866 -0.5866 -0.5864 -0.5864 0.8935 0.8935 0.8975 0.8975 1.9023 1.9023 1.9232 1.9232 2.0644 2.0644 2.0903 2.0903 2.2729 2.2729 2.2928 2.2928 2.5421 2.5421 2.5532 2.5532 5.5246 5.5246 5.5254 5.5254 7.7364 7.7364 7.7376 7.7376 9.2665 9.2665 k =-0.0978 0.0667 0.1665 ( 8032 PWs) bands (ev): -11.1121 -11.1121 -11.1120 -11.1120 -10.7007 -10.7007 -10.7007 -10.7007 -4.0395 -4.0395 -4.0393 -4.0393 -3.5791 -3.5791 -3.5791 -3.5791 -2.5889 -2.5889 -2.5884 -2.5884 -2.0254 -2.0254 -2.0254 -2.0254 -1.6815 -1.6815 -1.6815 -1.6815 -0.5940 -0.5940 -0.5939 -0.5939 0.8729 0.8729 0.8773 0.8773 1.8936 1.8936 1.9199 1.9199 2.0399 2.0399 2.0736 2.0736 2.2625 2.2625 2.2880 2.2880 2.5168 2.5168 2.5307 2.5307 5.5510 5.5510 5.5519 5.5519 7.7810 7.7810 7.7821 7.7821 9.2982 9.2982 k =-0.1087 0.0741 0.1665 ( 8026 PWs) bands (ev): -11.1050 -11.1050 -11.1050 -11.1050 -10.7004 -10.7004 -10.7003 -10.7003 -4.0358 -4.0358 -4.0356 -4.0356 -3.5778 -3.5778 -3.5778 -3.5778 -2.5843 -2.5843 -2.5837 -2.5837 -2.0222 -2.0222 -2.0222 -2.0222 -1.6841 -1.6841 -1.6840 -1.6840 -0.6022 -0.6022 -0.6021 -0.6021 0.8510 0.8510 0.8557 0.8557 1.8814 1.8814 1.9139 1.9139 2.0139 2.0139 2.0564 2.0564 2.2503 2.2503 2.2820 2.2820 2.4921 2.4921 2.5092 2.5092 5.5784 5.5784 5.5793 5.5793 7.8283 7.8283 7.8292 7.8292 9.3323 9.3323 k =-0.1196 0.0815 0.1665 ( 8030 PWs) bands (ev): -11.0973 -11.0973 -11.0973 -11.0973 -10.7000 -10.7000 -10.7000 -10.7000 -4.0318 -4.0318 -4.0315 -4.0315 -3.5764 -3.5764 -3.5763 -3.5763 -2.5794 -2.5794 -2.5788 -2.5788 -2.0188 -2.0188 -2.0187 -2.0187 -1.6867 -1.6867 -1.6866 -1.6866 -0.6111 -0.6111 -0.6110 -0.6110 0.8279 0.8279 0.8330 0.8330 1.8648 1.8648 1.9034 1.9034 1.9878 1.9878 2.0394 2.0394 2.2359 2.2359 2.2742 2.2742 2.4691 2.4691 2.4896 2.4896 5.6061 5.6061 5.6071 5.6071 7.8776 7.8776 7.8781 7.8781 9.3684 9.3684 k =-0.1304 0.0889 0.1665 ( 8012 PWs) bands (ev): -11.0890 -11.0890 -11.0890 -11.0890 -10.6996 -10.6996 -10.6995 -10.6995 -4.0274 -4.0274 -4.0272 -4.0272 -3.5749 -3.5749 -3.5748 -3.5748 -2.5742 -2.5742 -2.5735 -2.5735 -2.0150 -2.0150 -2.0150 -2.0150 -1.6895 -1.6895 -1.6894 -1.6894 -0.6206 -0.6206 -0.6205 -0.6205 0.8040 0.8040 0.8094 0.8094 1.8433 1.8433 1.8863 1.8863 1.9640 1.9640 2.0230 2.0230 2.2193 2.2193 2.2641 2.2641 2.4491 2.4491 2.4726 2.4726 5.6337 5.6337 5.6348 5.6348 7.9278 7.9278 7.9279 7.9279 9.4061 9.4061 k =-0.1413 0.0963 0.1665 ( 8008 PWs) bands (ev): -11.0802 -11.0802 -11.0802 -11.0802 -10.6991 -10.6991 -10.6991 -10.6991 -4.0228 -4.0228 -4.0225 -4.0225 -3.5733 -3.5733 -3.5733 -3.5733 -2.5687 -2.5687 -2.5680 -2.5680 -2.0111 -2.0111 -2.0111 -2.0111 -1.6924 -1.6924 -1.6923 -1.6923 -0.6306 -0.6306 -0.6306 -0.6306 0.7794 0.7794 0.7850 0.7850 1.8170 1.8170 1.8607 1.8607 1.9440 1.9440 2.0069 2.0069 2.2008 2.2008 2.2515 2.2515 2.4327 2.4327 2.4586 2.4586 5.6606 5.6606 5.6616 5.6616 7.9777 7.9777 7.9782 7.9782 9.4447 9.4447 k =-0.1522 0.1037 0.1665 ( 8000 PWs) bands (ev): -11.0708 -11.0708 -11.0707 -11.0707 -10.6987 -10.6987 -10.6986 -10.6986 -4.0178 -4.0178 -4.0175 -4.0175 -3.5717 -3.5717 -3.5717 -3.5717 -2.5631 -2.5631 -2.5624 -2.5624 -2.0070 -2.0070 -2.0070 -2.0070 -1.6953 -1.6953 -1.6951 -1.6951 -0.6410 -0.6410 -0.6410 -0.6410 0.7541 0.7541 0.7600 0.7600 1.7863 1.7863 1.8279 1.8279 1.9267 1.9267 1.9903 1.9903 2.1815 2.1815 2.2365 2.2365 2.4204 2.4204 2.4477 2.4477 5.6862 5.6862 5.6872 5.6872 8.0265 8.0265 8.0278 8.0278 9.4838 9.4838 k =-0.1630 0.1112 0.1665 ( 7998 PWs) bands (ev): -11.0608 -11.0608 -11.0608 -11.0608 -10.6982 -10.6982 -10.6982 -10.6982 -4.0126 -4.0126 -4.0123 -4.0123 -3.5701 -3.5701 -3.5701 -3.5701 -2.5574 -2.5574 -2.5566 -2.5566 -2.0027 -2.0027 -2.0027 -2.0027 -1.6981 -1.6981 -1.6980 -1.6980 -0.6518 -0.6518 -0.6517 -0.6517 0.7284 0.7284 0.7345 0.7345 1.7518 1.7518 1.7900 1.7900 1.9098 1.9098 1.9720 1.9720 2.1625 2.1625 2.2202 2.2202 2.4118 2.4118 2.4395 2.4395 5.7100 5.7100 5.7111 5.7111 8.0734 8.0734 8.0757 8.0757 9.5230 9.5230 k =-0.1739 0.1186 0.1665 ( 7998 PWs) bands (ev): -11.0505 -11.0505 -11.0504 -11.0504 -10.6977 -10.6977 -10.6977 -10.6977 -4.0072 -4.0072 -4.0069 -4.0069 -3.5685 -3.5685 -3.5684 -3.5684 -2.5516 -2.5516 -2.5508 -2.5508 -1.9983 -1.9983 -1.9982 -1.9982 -1.7010 -1.7010 -1.7009 -1.7009 -0.6626 -0.6626 -0.6625 -0.6625 0.7023 0.7023 0.7085 0.7085 1.7144 1.7144 1.7490 1.7490 1.8913 1.8913 1.9509 1.9509 2.1451 2.1451 2.2035 2.2035 2.4063 2.4063 2.4335 2.4335 5.7317 5.7317 5.7327 5.7327 8.1176 8.1176 8.1211 8.1211 9.5614 9.5614 k =-0.1848 0.1260 0.1665 ( 7984 PWs) bands (ev): -11.0397 -11.0397 -11.0396 -11.0396 -10.6972 -10.6972 -10.6971 -10.6971 -4.0016 -4.0016 -4.0013 -4.0013 -3.5668 -3.5668 -3.5668 -3.5668 -2.5458 -2.5458 -2.5450 -2.5450 -1.9937 -1.9937 -1.9937 -1.9937 -1.7037 -1.7037 -1.7036 -1.7036 -0.6735 -0.6735 -0.6733 -0.6733 0.6759 0.6759 0.6822 0.6822 1.6747 1.6747 1.7060 1.7060 1.8705 1.8705 1.9265 1.9265 2.1303 2.1303 2.1877 2.1877 2.4031 2.4031 2.4295 2.4295 5.7507 5.7507 5.7517 5.7517 8.1583 8.1583 8.1632 8.1632 9.5987 9.5987 k =-0.1957 0.1334 0.1665 ( 7988 PWs) bands (ev): -11.0285 -11.0285 -11.0285 -11.0285 -10.6967 -10.6967 -10.6966 -10.6966 -3.9958 -3.9958 -3.9955 -3.9955 -3.5652 -3.5652 -3.5652 -3.5652 -2.5402 -2.5402 -2.5394 -2.5394 -1.9891 -1.9891 -1.9891 -1.9891 -1.7064 -1.7064 -1.7063 -1.7063 -0.6841 -0.6841 -0.6839 -0.6839 0.6491 0.6491 0.6555 0.6555 1.6334 1.6334 1.6616 1.6616 1.8469 1.8469 1.8985 1.8985 2.1183 2.1183 2.1733 2.1733 2.4017 2.4017 2.4268 2.4268 5.7669 5.7669 5.7678 5.7678 8.1950 8.1950 8.2013 8.2013 9.6339 9.6339 k =-0.2065 0.1408 0.1665 ( 7986 PWs) bands (ev): -11.0170 -11.0170 -11.0170 -11.0170 -10.6961 -10.6961 -10.6961 -10.6961 -3.9899 -3.9899 -3.9895 -3.9895 -3.5636 -3.5636 -3.5636 -3.5636 -2.5347 -2.5347 -2.5339 -2.5339 -1.9844 -1.9844 -1.9844 -1.9844 -1.7089 -1.7089 -1.7087 -1.7087 -0.6944 -0.6944 -0.6941 -0.6941 0.6220 0.6220 0.6284 0.6284 1.5911 1.5911 1.6165 1.6165 1.8206 1.8206 1.8675 1.8675 2.1091 2.1091 2.1609 2.1609 2.4014 2.4014 2.4252 2.4252 5.7799 5.7799 5.7807 5.7807 8.2270 8.2270 8.2350 8.2350 9.6657 9.6657 k =-0.2174 0.1482 0.1665 ( 7996 PWs) bands (ev): -11.0052 -11.0052 -11.0052 -11.0052 -10.6956 -10.6956 -10.6955 -10.6955 -3.9838 -3.9838 -3.9835 -3.9835 -3.5621 -3.5621 -3.5621 -3.5621 -2.5294 -2.5294 -2.5286 -2.5286 -1.9797 -1.9797 -1.9797 -1.9797 -1.7111 -1.7111 -1.7110 -1.7110 -0.7042 -0.7042 -0.7038 -0.7038 0.5945 0.5945 0.6009 0.6009 1.5482 1.5482 1.5712 1.5712 1.7919 1.7919 1.8340 1.8340 2.1022 2.1022 2.1503 2.1503 2.4019 2.4019 2.4244 2.4244 5.7896 5.7896 5.7902 5.7902 8.2543 8.2543 8.2639 8.2639 9.6944 9.6944 k =-0.2283 0.1556 0.1665 ( 7994 PWs) bands (ev): -10.9932 -10.9932 -10.9932 -10.9932 -10.6951 -10.6951 -10.6950 -10.6950 -3.9777 -3.9777 -3.9773 -3.9773 -3.5606 -3.5606 -3.5606 -3.5606 -2.5245 -2.5245 -2.5237 -2.5237 -1.9750 -1.9750 -1.9749 -1.9749 -1.7132 -1.7132 -1.7131 -1.7131 -0.7132 -0.7132 -0.7128 -0.7128 0.5667 0.5667 0.5730 0.5730 1.5051 1.5051 1.5259 1.5259 1.7613 1.7613 1.7990 1.7990 2.0971 2.0971 2.1416 2.1416 2.4030 2.4030 2.4242 2.4242 5.7960 5.7960 5.7964 5.7964 8.2766 8.2766 8.2879 8.2879 9.7199 9.7199 k =-0.2391 0.1630 0.1665 ( 8000 PWs) bands (ev): -10.9810 -10.9810 -10.9810 -10.9810 -10.6945 -10.6945 -10.6945 -10.6945 -3.9715 -3.9715 -3.9712 -3.9712 -3.5592 -3.5592 -3.5592 -3.5592 -2.5199 -2.5199 -2.5191 -2.5191 -1.9703 -1.9703 -1.9702 -1.9702 -1.7149 -1.7149 -1.7149 -1.7149 -0.7213 -0.7213 -0.7208 -0.7208 0.5385 0.5385 0.5445 0.5445 1.4622 1.4622 1.4809 1.4809 1.7293 1.7293 1.7629 1.7629 2.0934 2.0934 2.1345 2.1345 2.4045 2.4045 2.4243 2.4243 5.7989 5.7989 5.7992 5.7992 8.2940 8.2940 8.3068 8.3068 9.7420 9.7420 k =-0.2500 0.1704 0.1665 ( 8000 PWs) bands (ev): -10.9687 -10.9687 -10.9687 -10.9687 -10.6940 -10.6940 -10.6939 -10.6939 -3.9653 -3.9653 -3.9650 -3.9650 -3.5578 -3.5578 -3.5578 -3.5578 -2.5158 -2.5158 -2.5150 -2.5150 -1.9656 -1.9656 -1.9655 -1.9655 -1.7164 -1.7164 -1.7163 -1.7163 -0.7284 -0.7284 -0.7279 -0.7279 0.5097 0.5097 0.5156 0.5156 1.4197 1.4197 1.4367 1.4367 1.6965 1.6965 1.7264 1.7264 2.0907 2.0907 2.1287 2.1287 2.4061 2.4061 2.4247 2.4247 5.7986 5.7986 5.7986 5.7986 8.3067 8.3067 8.3209 8.3209 9.7606 9.7606 k =-0.2609 0.1778 0.1665 ( 7996 PWs) bands (ev): -10.9563 -10.9563 -10.9563 -10.9563 -10.6934 -10.6934 -10.6934 -10.6934 -3.9592 -3.9592 -3.9588 -3.9588 -3.5566 -3.5566 -3.5565 -3.5565 -2.5122 -2.5122 -2.5114 -2.5114 -1.9610 -1.9610 -1.9609 -1.9609 -1.7175 -1.7175 -1.7175 -1.7175 -0.7344 -0.7344 -0.7338 -0.7338 0.4805 0.4805 0.4862 0.4862 1.3781 1.3781 1.3933 1.3933 1.6632 1.6632 1.6899 1.6899 2.0887 2.0887 2.1239 2.1239 2.4079 2.4079 2.4253 2.4253 5.7950 5.7950 5.7952 5.7952 8.3150 8.3150 8.3303 8.3303 9.7760 9.7760 k =-0.2717 0.1853 0.1665 ( 7986 PWs) bands (ev): -10.9439 -10.9439 -10.9439 -10.9439 -10.6929 -10.6929 -10.6929 -10.6929 -3.9531 -3.9531 -3.9527 -3.9527 -3.5553 -3.5553 -3.5553 -3.5553 -2.5091 -2.5091 -2.5084 -2.5084 -1.9564 -1.9564 -1.9563 -1.9563 -1.7182 -1.7182 -1.7182 -1.7182 -0.7390 -0.7390 -0.7384 -0.7384 0.4508 0.4508 0.4562 0.4562 1.3374 1.3374 1.3510 1.3510 1.6299 1.6299 1.6538 1.6538 2.0874 2.0874 2.1200 2.1200 2.4096 2.4096 2.4259 2.4259 5.7885 5.7885 5.7889 5.7889 8.3191 8.3191 8.3353 8.3353 9.7882 9.7882 k =-0.2826 0.1927 0.1665 ( 7996 PWs) bands (ev): -10.9316 -10.9316 -10.9316 -10.9316 -10.6924 -10.6924 -10.6924 -10.6924 -3.9471 -3.9471 -3.9467 -3.9467 -3.5542 -3.5542 -3.5541 -3.5541 -2.5067 -2.5067 -2.5059 -2.5059 -1.9520 -1.9520 -1.9518 -1.9518 -1.7186 -1.7186 -1.7186 -1.7186 -0.7423 -0.7423 -0.7416 -0.7416 0.4206 0.4206 0.4257 0.4257 1.2979 1.2979 1.3100 1.3100 1.5969 1.5969 1.6184 1.6184 2.0864 2.0864 2.1168 2.1168 2.4113 2.4113 2.4266 2.4266 5.7793 5.7793 5.7800 5.7800 8.3195 8.3195 8.3363 8.3363 9.7974 9.7974 k =-0.2935 0.2001 0.1665 ( 8002 PWs) bands (ev): -10.9194 -10.9194 -10.9193 -10.9193 -10.6919 -10.6919 -10.6919 -10.6919 -3.9412 -3.9412 -3.9409 -3.9409 -3.5531 -3.5531 -3.5531 -3.5531 -2.5048 -2.5048 -2.5041 -2.5041 -1.9476 -1.9476 -1.9473 -1.9473 -1.7185 -1.7185 -1.7185 -1.7185 -0.7442 -0.7442 -0.7434 -0.7434 0.3899 0.3899 0.3947 0.3947 1.2596 1.2596 1.2703 1.2703 1.5647 1.5647 1.5840 1.5840 2.0857 2.0857 2.1141 2.1141 2.4129 2.4129 2.4272 2.4272 5.7679 5.7679 5.7689 5.7689 8.3165 8.3165 8.3336 8.3336 9.8039 9.8039 k =-0.3043 0.2075 0.1665 ( 7996 PWs) bands (ev): -10.9073 -10.9073 -10.9073 -10.9073 -10.6914 -10.6914 -10.6914 -10.6914 -3.9356 -3.9356 -3.9352 -3.9352 -3.5522 -3.5522 -3.5521 -3.5521 -2.5035 -2.5035 -2.5028 -2.5028 -1.9433 -1.9433 -1.9430 -1.9430 -1.7180 -1.7180 -1.7180 -1.7180 -0.7446 -0.7446 -0.7438 -0.7438 0.3589 0.3589 0.3633 0.3633 1.2227 1.2227 1.2320 1.2320 1.5333 1.5333 1.5507 1.5507 2.0853 2.0853 2.1117 2.1117 2.4144 2.4144 2.4277 2.4277 5.7546 5.7546 5.7558 5.7558 8.3104 8.3104 8.3275 8.3275 9.8079 9.8079 k =-0.3152 0.2149 0.1665 ( 7990 PWs) bands (ev): -10.8955 -10.8955 -10.8955 -10.8955 -10.6910 -10.6910 -10.6909 -10.6909 -3.9301 -3.9301 -3.9297 -3.9297 -3.5513 -3.5513 -3.5512 -3.5512 -2.5029 -2.5029 -2.5022 -2.5022 -1.9392 -1.9392 -1.9388 -1.9388 -1.7171 -1.7171 -1.7170 -1.7170 -0.7436 -0.7436 -0.7427 -0.7427 0.3276 0.3276 0.3316 0.3316 1.1872 1.1872 1.1954 1.1954 1.5031 1.5031 1.5188 1.5188 2.0850 2.0850 2.1097 2.1097 2.4158 2.4158 2.4282 2.4282 5.7398 5.7398 5.7412 5.7412 8.3017 8.3017 8.3186 8.3186 9.8097 9.8097 k =-0.3261 0.2223 0.1665 ( 7994 PWs) bands (ev): -10.8840 -10.8840 -10.8839 -10.8839 -10.6905 -10.6905 -10.6905 -10.6905 -3.9248 -3.9248 -3.9245 -3.9245 -3.5504 -3.5504 -3.5504 -3.5504 -2.5028 -2.5028 -2.5021 -2.5021 -1.9352 -1.9352 -1.9348 -1.9348 -1.7157 -1.7157 -1.7156 -1.7156 -0.7411 -0.7411 -0.7402 -0.7402 0.2961 0.2961 0.2998 0.2998 1.1532 1.1532 1.1603 1.1603 1.4742 1.4742 1.4883 1.4883 2.0849 2.0849 2.1080 2.1080 2.4171 2.4171 2.4286 2.4286 5.7238 5.7238 5.7254 5.7254 8.2908 8.2908 8.3071 8.3071 9.8095 9.8095 k =-0.3370 0.2297 0.1665 ( 8010 PWs) bands (ev): -10.8728 -10.8728 -10.8727 -10.8727 -10.6901 -10.6901 -10.6901 -10.6901 -3.9198 -3.9198 -3.9195 -3.9195 -3.5497 -3.5497 -3.5496 -3.5496 -2.5033 -2.5033 -2.5026 -2.5026 -1.9314 -1.9314 -1.9309 -1.9309 -1.7138 -1.7138 -1.7137 -1.7137 -0.7374 -0.7374 -0.7364 -0.7364 0.2647 0.2647 0.2679 0.2679 1.1209 1.1209 1.1268 1.1268 1.4467 1.4467 1.4594 1.4594 2.0849 2.0849 2.1064 2.1064 2.4182 2.4182 2.4288 2.4288 5.7070 5.7070 5.7089 5.7089 8.2780 8.2780 8.2936 8.2936 9.8077 9.8077 k =-0.3478 0.2371 0.1665 ( 8002 PWs) bands (ev): -10.8620 -10.8620 -10.8620 -10.8620 -10.6897 -10.6897 -10.6897 -10.6897 -3.9151 -3.9151 -3.9148 -3.9148 -3.5490 -3.5490 -3.5489 -3.5489 -2.5042 -2.5042 -2.5035 -2.5035 -1.9278 -1.9278 -1.9272 -1.9272 -1.7116 -1.7116 -1.7114 -1.7114 -0.7324 -0.7324 -0.7314 -0.7314 0.2334 0.2334 0.2363 0.2363 1.0901 1.0901 1.0951 1.0951 1.4208 1.4208 1.4322 1.4322 2.0849 2.0849 2.1050 2.1050 2.4191 2.4191 2.4290 2.4290 5.6898 5.6898 5.6918 5.6918 8.2638 8.2638 8.2785 8.2785 9.8045 9.8045 k =-0.3587 0.2445 0.1665 ( 8008 PWs) bands (ev): -10.8517 -10.8517 -10.8516 -10.8516 -10.6894 -10.6894 -10.6893 -10.6893 -3.9107 -3.9107 -3.9104 -3.9104 -3.5483 -3.5483 -3.5483 -3.5483 -2.5055 -2.5055 -2.5049 -2.5049 -1.9243 -1.9243 -1.9238 -1.9238 -1.7089 -1.7089 -1.7088 -1.7088 -0.7263 -0.7263 -0.7252 -0.7252 0.2026 0.2026 0.2052 0.2052 1.0610 1.0610 1.0652 1.0652 1.3965 1.3965 1.4068 1.4068 2.0851 2.0851 2.1037 2.1037 2.4200 2.4200 2.4291 2.4291 5.6725 5.6725 5.6746 5.6746 8.2485 8.2485 8.2622 8.2622 9.8002 9.8002 k =-0.3696 0.2520 0.1665 ( 8008 PWs) bands (ev): -10.8418 -10.8418 -10.8418 -10.8418 -10.6890 -10.6890 -10.6889 -10.6889 -3.9066 -3.9066 -3.9063 -3.9063 -3.5478 -3.5478 -3.5477 -3.5477 -2.5072 -2.5072 -2.5066 -2.5066 -1.9211 -1.9211 -1.9206 -1.9206 -1.7058 -1.7058 -1.7057 -1.7057 -0.7192 -0.7192 -0.7181 -0.7181 0.1724 0.1724 0.1747 0.1747 1.0336 1.0336 1.0370 1.0370 1.3738 1.3738 1.3831 1.3831 2.0853 2.0853 2.1024 2.1024 2.4208 2.4208 2.4290 2.4290 5.6554 5.6554 5.6576 5.6576 8.2326 8.2326 8.2451 8.2451 9.7950 9.7950 k =-0.3804 0.2594 0.1665 ( 8000 PWs) bands (ev): -10.8326 -10.8326 -10.8325 -10.8325 -10.6887 -10.6887 -10.6886 -10.6886 -3.9028 -3.9028 -3.9025 -3.9025 -3.5472 -3.5472 -3.5472 -3.5472 -2.5091 -2.5091 -2.5086 -2.5086 -1.9182 -1.9182 -1.9176 -1.9176 -1.7025 -1.7025 -1.7024 -1.7024 -0.7114 -0.7114 -0.7103 -0.7103 0.1431 0.1431 0.1451 0.1451 1.0079 1.0079 1.0107 1.0107 1.3530 1.3530 1.3612 1.3612 2.0855 2.0855 2.1013 2.1013 2.4214 2.4214 2.4289 2.4289 5.6387 5.6387 5.6410 5.6410 8.2163 8.2163 8.2277 8.2277 9.7893 9.7893 k =-0.3913 0.2668 0.1665 ( 8018 PWs) bands (ev): -10.8239 -10.8239 -10.8239 -10.8239 -10.6884 -10.6884 -10.6884 -10.6884 -3.8994 -3.8994 -3.8991 -3.8991 -3.5467 -3.5467 -3.5467 -3.5467 -2.5113 -2.5113 -2.5107 -2.5107 -1.9155 -1.9155 -1.9149 -1.9149 -1.6990 -1.6990 -1.6989 -1.6989 -0.7029 -0.7029 -0.7019 -0.7019 0.1149 0.1149 0.1166 0.1166 0.9841 0.9841 0.9863 0.9863 1.3338 1.3338 1.3412 1.3412 2.0858 2.0858 2.1002 2.1002 2.4220 2.4220 2.4288 2.4288 5.6228 5.6228 5.6251 5.6251 8.2001 8.2001 8.2104 8.2104 9.7832 9.7832 k =-0.4022 0.2742 0.1665 ( 8014 PWs) bands (ev): -10.8160 -10.8160 -10.8159 -10.8159 -10.6882 -10.6882 -10.6881 -10.6881 -3.8963 -3.8963 -3.8960 -3.8960 -3.5463 -3.5463 -3.5463 -3.5463 -2.5134 -2.5134 -2.5129 -2.5129 -1.9130 -1.9130 -1.9124 -1.9124 -1.6954 -1.6954 -1.6953 -1.6953 -0.6942 -0.6942 -0.6931 -0.6931 0.0881 0.0881 0.0896 0.0896 0.9623 0.9623 0.9640 0.9640 1.3165 1.3165 1.3230 1.3230 2.0862 2.0862 2.0991 2.0991 2.4224 2.4224 2.4285 2.4285 5.6079 5.6079 5.6101 5.6101 8.1844 8.1844 8.1935 8.1935 9.7771 9.7771 k =-0.4130 0.2816 0.1665 ( 8018 PWs) bands (ev): -10.8087 -10.8087 -10.8087 -10.8087 -10.6879 -10.6879 -10.6879 -10.6879 -3.8935 -3.8935 -3.8933 -3.8933 -3.5459 -3.5459 -3.5459 -3.5459 -2.5156 -2.5156 -2.5152 -2.5152 -1.9109 -1.9109 -1.9103 -1.9103 -1.6917 -1.6917 -1.6916 -1.6916 -0.6852 -0.6852 -0.6842 -0.6842 0.0631 0.0631 0.0644 0.0644 0.9424 0.9424 0.9437 0.9437 1.3010 1.3010 1.3066 1.3066 2.0865 2.0865 2.0981 2.0981 2.4229 2.4229 2.4283 2.4283 5.5941 5.5941 5.5962 5.5962 8.1694 8.1694 8.1773 8.1773 9.7710 9.7710 k =-0.4239 0.2890 0.1665 ( 8024 PWs) bands (ev): -10.8022 -10.8022 -10.8021 -10.8021 -10.6877 -10.6877 -10.6877 -10.6877 -3.8911 -3.8911 -3.8909 -3.8909 -3.5456 -3.5456 -3.5455 -3.5455 -2.5178 -2.5178 -2.5173 -2.5173 -1.9089 -1.9089 -1.9084 -1.9084 -1.6882 -1.6882 -1.6881 -1.6881 -0.6765 -0.6765 -0.6755 -0.6755 0.0400 0.0400 0.0411 0.0411 0.9246 0.9246 0.9256 0.9256 1.2872 1.2872 1.2921 1.2921 2.0870 2.0870 2.0971 2.0971 2.4233 2.4233 2.4280 2.4280 5.5816 5.5816 5.5835 5.5835 8.1555 8.1555 8.1623 8.1623 9.7653 9.7653 k =-0.4348 0.2964 0.1665 ( 8016 PWs) bands (ev): -10.7964 -10.7964 -10.7964 -10.7964 -10.6876 -10.6876 -10.6875 -10.6875 -3.8890 -3.8890 -3.8889 -3.8889 -3.5453 -3.5453 -3.5452 -3.5452 -2.5197 -2.5197 -2.5194 -2.5194 -1.9073 -1.9073 -1.9068 -1.9068 -1.6848 -1.6848 -1.6848 -1.6848 -0.6681 -0.6681 -0.6672 -0.6672 0.0192 0.0192 0.0201 0.0201 0.9090 0.9090 0.9097 0.9097 1.2753 1.2753 1.2794 1.2794 2.0874 2.0874 2.0962 2.0962 2.4236 2.4236 2.4276 2.4276 5.5705 5.5705 5.5723 5.5723 8.1429 8.1429 8.1486 8.1486 9.7600 9.7600 k =-0.4457 0.3038 0.1665 ( 8010 PWs) bands (ev): -10.7915 -10.7915 -10.7915 -10.7915 -10.6874 -10.6874 -10.6874 -10.6874 -3.8873 -3.8873 -3.8872 -3.8872 -3.5450 -3.5450 -3.5450 -3.5450 -2.5215 -2.5215 -2.5212 -2.5212 -1.9059 -1.9059 -1.9054 -1.9054 -1.6818 -1.6818 -1.6817 -1.6817 -0.6603 -0.6603 -0.6595 -0.6595 0.0009 0.0009 0.0017 0.0017 0.8957 0.8957 0.8962 0.8962 1.2653 1.2653 1.2687 1.2687 2.0880 2.0880 2.0953 2.0953 2.4240 2.4240 2.4273 2.4273 5.5611 5.5611 5.5626 5.5626 8.1319 8.1319 8.1366 8.1366 9.7554 9.7554 k =-0.4565 0.3112 0.1665 ( 8026 PWs) bands (ev): -10.7875 -10.7875 -10.7874 -10.7874 -10.6873 -10.6873 -10.6873 -10.6873 -3.8859 -3.8859 -3.8858 -3.8858 -3.5448 -3.5448 -3.5448 -3.5448 -2.5231 -2.5231 -2.5228 -2.5228 -1.9047 -1.9047 -1.9044 -1.9044 -1.6791 -1.6791 -1.6791 -1.6791 -0.6535 -0.6535 -0.6528 -0.6528 -0.0145 -0.0145 -0.0139 -0.0139 0.8846 0.8846 0.8850 0.8850 1.2571 1.2571 1.2598 1.2598 2.0885 2.0885 2.0944 2.0944 2.4243 2.4243 2.4269 2.4269 5.5532 5.5532 5.5544 5.5544 8.1227 8.1227 8.1264 8.1264 9.7515 9.7515 k =-0.4674 0.3186 0.1665 ( 8028 PWs) bands (ev): -10.7843 -10.7843 -10.7843 -10.7843 -10.6872 -10.6872 -10.6872 -10.6872 -3.8848 -3.8848 -3.8847 -3.8847 -3.5447 -3.5447 -3.5446 -3.5446 -2.5243 -2.5243 -2.5241 -2.5241 -1.9038 -1.9038 -1.9036 -1.9036 -1.6770 -1.6770 -1.6769 -1.6769 -0.6478 -0.6478 -0.6473 -0.6473 -0.0268 -0.0268 -0.0263 -0.0263 0.8760 0.8760 0.8762 0.8762 1.2508 1.2508 1.2528 1.2528 2.0891 2.0891 2.0935 2.0935 2.4246 2.4246 2.4266 2.4266 5.5471 5.5471 5.5480 5.5480 8.1154 8.1154 8.1181 8.1181 9.7485 9.7485 k =-0.4783 0.3261 0.1665 ( 8040 PWs) bands (ev): -10.7820 -10.7820 -10.7820 -10.7820 -10.6872 -10.6872 -10.6872 -10.6872 -3.8840 -3.8840 -3.8840 -3.8840 -3.5445 -3.5445 -3.5445 -3.5445 -2.5252 -2.5252 -2.5250 -2.5250 -1.9032 -1.9032 -1.9030 -1.9030 -1.6754 -1.6754 -1.6753 -1.6753 -0.6436 -0.6436 -0.6432 -0.6432 -0.0357 -0.0357 -0.0354 -0.0354 0.8697 0.8697 0.8699 0.8699 1.2464 1.2464 1.2477 1.2477 2.0897 2.0897 2.0927 2.0927 2.4249 2.4249 2.4262 2.4262 5.5427 5.5427 5.5433 5.5433 8.1102 8.1102 8.1120 8.1120 9.7464 9.7465 k =-0.4891 0.3335 0.1665 ( 8044 PWs) bands (ev): -10.7806 -10.7806 -10.7806 -10.7806 -10.6871 -10.6871 -10.6871 -10.6871 -3.8836 -3.8836 -3.8835 -3.8835 -3.5445 -3.5445 -3.5445 -3.5445 -2.5257 -2.5257 -2.5256 -2.5256 -1.9028 -1.9028 -1.9027 -1.9027 -1.6744 -1.6744 -1.6744 -1.6744 -0.6409 -0.6409 -0.6408 -0.6408 -0.0411 -0.0411 -0.0410 -0.0410 0.8660 0.8660 0.8661 0.8661 1.2438 1.2438 1.2445 1.2445 2.0904 2.0904 2.0919 2.0919 2.4252 2.4252 2.4259 2.4259 5.5401 5.5401 5.5404 5.5404 8.1073 8.1073 8.1082 8.1082 9.7454 9.7464 k =-0.5000 0.3409 0.1665 ( 8056 PWs) bands (ev): -10.7801 -10.7801 -10.7801 -10.7801 -10.6871 -10.6871 -10.6871 -10.6871 -3.8834 -3.8834 -3.8834 -3.8834 -3.5444 -3.5444 -3.5444 -3.5444 -2.5259 -2.5259 -2.5259 -2.5259 -1.9026 -1.9026 -1.9026 -1.9026 -1.6740 -1.6740 -1.6740 -1.6740 -0.6400 -0.6400 -0.6400 -0.6400 -0.0429 -0.0429 -0.0429 -0.0429 0.8648 0.8648 0.8648 0.8648 1.2432 1.2432 1.2432 1.2432 2.0911 2.0911 2.0911 2.0911 2.4255 2.4255 2.4255 2.4255 5.5394 5.5394 5.5394 5.5394 8.1066 8.1066 8.1066 8.1066 9.7454 9.7454 Writing output data file HgBr2.save init_run : 3.56s CPU 13.41s WALL ( 1 calls) electrons : 1919.81s CPU 1939.53s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.43s CPU 1.77s WALL ( 1 calls) Called by electrons: c_bands : 1919.79s CPU 1939.06s WALL ( 1 calls) v_of_rho : 0.08s CPU 1.06s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.07s CPU 0.65s WALL ( 1 calls) newd : 0.45s CPU 0.72s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.27s WALL ( 350 calls) cegterg : 1562.24s CPU 1570.90s WALL ( 924 calls) Called by sum_band: Called by *egterg: h_psi : 701.57s CPU 712.75s WALL ( 17424 calls) s_psi : 55.29s CPU 55.99s WALL ( 17424 calls) g_psi : 2.56s CPU 2.65s WALL ( 16150 calls) cdiaghg : 521.08s CPU 517.13s WALL ( 16500 calls) cegterg:over : 155.41s CPU 152.63s WALL ( 16150 calls) cegterg:upda : 54.10s CPU 59.02s WALL ( 16150 calls) cegterg:last : 44.96s CPU 46.16s WALL ( 2973 calls) Called by h_psi: h_psi:vloc : 577.99s CPU 586.78s WALL ( 17424 calls) h_psi:vnl : 122.32s CPU 123.46s WALL ( 17424 calls) add_vuspsi : 41.98s CPU 47.74s WALL ( 17424 calls) General routines calbec : 80.27s CPU 75.58s WALL ( 17424 calls) fft : 0.22s CPU 1.18s WALL ( 19 calls) ffts : 0.00s CPU 0.15s WALL ( 4 calls) fftw : 534.75s CPU 539.35s WALL ( 2186488 calls) interpolate : 0.04s CPU 0.20s WALL ( 4 calls) davcio : 0.05s CPU 19.39s WALL ( 700 calls) Parallel routines fft_scatter : 339.65s CPU 339.25s WALL ( 2186511 calls) PWSCF : 36m 2.40s CPU 45m22.45s WALL This run was terminated on: 2:43:28 28Jun2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=