Program PWSCF v.5.1.1 starts on 23Jul2015 at 13:17: 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: ./ZrGe2.save/ file Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 44 30 9 1110 625 103 Max 45 31 10 1115 639 106 Sum 2147 1479 445 53387 30337 4969 bravais-lattice index = 14 lattice parameter (alat) = 14.5839 a.u. unit-cell volume = 719.8058 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 268.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.583938 celldm(2)= 1.000000 celldm(3)= 0.491092 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.881316 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.881316 0.472528 0.000000 ) a(3) = ( 0.000000 0.000000 0.491092 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.865107 -0.000000 ) b(2) = ( 0.000000 2.116276 -0.000000 ) b(3) = ( 0.000000 0.000000 2.036277 ) PseudoPot. # 1 for Ge read from file: /home/autes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Zr read from file: /home/autes/Pseudo/Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8b6e13b1b49db219b5566974d4b37ab4 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Zr 12.00 91.22400 Zr( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.2455462 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.2455462 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 414 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 2) = ( 0.0059060 0.0235142 -0.0000000), wk = 0.0024155 k( 3) = ( 0.0118121 0.0470284 -0.0000000), wk = 0.0024155 k( 4) = ( 0.0177181 0.0705425 -0.0000000), wk = 0.0024155 k( 5) = ( 0.0236241 0.0940567 -0.0000000), wk = 0.0024155 k( 6) = ( 0.0295302 0.1175709 -0.0000000), wk = 0.0024155 k( 7) = ( 0.0354362 0.1410851 -0.0000000), wk = 0.0024155 k( 8) = ( 0.0413422 0.1645993 -0.0000000), wk = 0.0024155 k( 9) = ( 0.0472483 0.1881134 -0.0000000), wk = 0.0024155 k( 10) = ( 0.0531543 0.2116276 -0.0000000), wk = 0.0024155 k( 11) = ( 0.0590603 0.2351418 -0.0000000), wk = 0.0024155 k( 12) = ( 0.0649664 0.2586560 -0.0000000), wk = 0.0024155 k( 13) = ( 0.0708724 0.2821701 -0.0000000), wk = 0.0024155 k( 14) = ( 0.0767784 0.3056843 -0.0000000), wk = 0.0024155 k( 15) = ( 0.0826845 0.3291985 -0.0000000), wk = 0.0024155 k( 16) = ( 0.0885905 0.3527127 -0.0000000), wk = 0.0024155 k( 17) = ( 0.0944965 0.3762268 -0.0000000), wk = 0.0024155 k( 18) = ( 0.1004025 0.3997410 -0.0000000), wk = 0.0024155 k( 19) = ( 0.1063086 0.4232552 -0.0000000), wk = 0.0024155 k( 20) = ( 0.1122146 0.4467694 -0.0000000), wk = 0.0024155 k( 21) = ( 0.1181206 0.4702835 -0.0000000), wk = 0.0024155 k( 22) = ( 0.1240267 0.4937977 -0.0000000), wk = 0.0024155 k( 23) = ( 0.1299327 0.5173119 -0.0000000), wk = 0.0024155 k( 24) = ( 0.1358388 0.5408261 -0.0000000), wk = 0.0024155 k( 25) = ( 0.1417448 0.5643403 -0.0000000), wk = 0.0024155 k( 26) = ( 0.1476508 0.5878545 -0.0000000), wk = 0.0024155 k( 27) = ( 0.1535568 0.6113686 -0.0000000), wk = 0.0024155 k( 28) = ( 0.1594629 0.6348828 -0.0000000), wk = 0.0024155 k( 29) = ( 0.1653689 0.6583970 -0.0000000), wk = 0.0024155 k( 30) = ( 0.1712750 0.6819112 -0.0000000), wk = 0.0024155 k( 31) = ( 0.1771810 0.7054253 -0.0000000), wk = 0.0024155 k( 32) = ( 0.1830870 0.7289395 -0.0000000), wk = 0.0024155 k( 33) = ( 0.1889930 0.7524537 -0.0000000), wk = 0.0024155 k( 34) = ( 0.1948991 0.7759679 -0.0000000), wk = 0.0024155 k( 35) = ( 0.2008051 0.7994820 -0.0000000), wk = 0.0024155 k( 36) = ( 0.2067111 0.8229962 -0.0000000), wk = 0.0024155 k( 37) = ( 0.2126172 0.8465104 -0.0000000), wk = 0.0024155 k( 38) = ( 0.2185232 0.8700246 -0.0000000), wk = 0.0024155 k( 39) = ( 0.2244292 0.8935388 -0.0000000), wk = 0.0024155 k( 40) = ( 0.2303353 0.9170529 -0.0000000), wk = 0.0024155 k( 41) = ( 0.2362413 0.9405671 -0.0000000), wk = 0.0024155 k( 42) = ( 0.2421473 0.9640813 -0.0000000), wk = 0.0024155 k( 43) = ( 0.2480534 0.9875955 -0.0000000), wk = 0.0024155 k( 44) = ( 0.2539594 1.0111096 -0.0000000), wk = 0.0024155 k( 45) = ( 0.2598654 1.0346238 -0.0000000), wk = 0.0024155 k( 46) = ( 0.2657715 1.0581380 -0.0000000), wk = 0.0024155 k( 47) = ( 0.2657715 1.0581380 -0.0000000), wk = 0.0024155 k( 48) = ( 0.2416104 1.0581380 -0.0000000), wk = 0.0024155 k( 49) = ( 0.2174494 1.0581380 -0.0000000), wk = 0.0024155 k( 50) = ( 0.1932883 1.0581380 -0.0000000), wk = 0.0024155 k( 51) = ( 0.1691273 1.0581380 -0.0000000), wk = 0.0024155 k( 52) = ( 0.1449662 1.0581380 -0.0000000), wk = 0.0024155 k( 53) = ( 0.1208052 1.0581380 -0.0000000), wk = 0.0024155 k( 54) = ( 0.0966442 1.0581380 -0.0000000), wk = 0.0024155 k( 55) = ( 0.0724831 1.0581380 -0.0000000), wk = 0.0024155 k( 56) = ( 0.0483221 1.0581380 -0.0000000), wk = 0.0024155 k( 57) = ( 0.0241610 1.0581380 -0.0000000), wk = 0.0024155 k( 58) = ( 0.0000000 1.0581380 -0.0000000), wk = 0.0024155 k( 59) = ( 0.0000000 1.0581380 -0.0000000), wk = 0.0024155 k( 60) = ( 0.0000000 1.0581380 0.0242414), wk = 0.0024155 k( 61) = ( 0.0000000 1.0581380 0.0484828), wk = 0.0024155 k( 62) = ( 0.0000000 1.0581380 0.0727242), wk = 0.0024155 k( 63) = ( 0.0000000 1.0581380 0.0969656), wk = 0.0024155 k( 64) = ( 0.0000000 1.0581380 0.1212069), wk = 0.0024155 k( 65) = ( 0.0000000 1.0581380 0.1454483), wk = 0.0024155 k( 66) = ( 0.0000000 1.0581380 0.1696897), wk = 0.0024155 k( 67) = ( 0.0000000 1.0581380 0.1939311), wk = 0.0024155 k( 68) = ( 0.0000000 1.0581380 0.2181725), wk = 0.0024155 k( 69) = ( 0.0000000 1.0581380 0.2424139), wk = 0.0024155 k( 70) = ( 0.0000000 1.0581380 0.2666553), wk = 0.0024155 k( 71) = ( 0.0000000 1.0581380 0.2908966), wk = 0.0024155 k( 72) = ( 0.0000000 1.0581380 0.3151380), wk = 0.0024155 k( 73) = ( 0.0000000 1.0581380 0.3393794), wk = 0.0024155 k( 74) = ( 0.0000000 1.0581380 0.3636208), wk = 0.0024155 k( 75) = ( 0.0000000 1.0581380 0.3878622), wk = 0.0024155 k( 76) = ( 0.0000000 1.0581380 0.4121036), wk = 0.0024155 k( 77) = ( 0.0000000 1.0581380 0.4363450), wk = 0.0024155 k( 78) = ( 0.0000000 1.0581380 0.4605864), wk = 0.0024155 k( 79) = ( 0.0000000 1.0581380 0.4848278), wk = 0.0024155 k( 80) = ( 0.0000000 1.0581380 0.5090691), wk = 0.0024155 k( 81) = ( 0.0000000 1.0581380 0.5333105), wk = 0.0024155 k( 82) = ( 0.0000000 1.0581380 0.5575519), wk = 0.0024155 k( 83) = ( 0.0000000 1.0581380 0.5817933), wk = 0.0024155 k( 84) = ( 0.0000000 1.0581380 0.6060347), wk = 0.0024155 k( 85) = ( 0.0000000 1.0581380 0.6302761), wk = 0.0024155 k( 86) = ( 0.0000000 1.0581380 0.6545175), wk = 0.0024155 k( 87) = ( 0.0000000 1.0581380 0.6787589), wk = 0.0024155 k( 88) = ( 0.0000000 1.0581380 0.7030003), wk = 0.0024155 k( 89) = ( 0.0000000 1.0581380 0.7272416), wk = 0.0024155 k( 90) = ( 0.0000000 1.0581380 0.7514830), wk = 0.0024155 k( 91) = ( 0.0000000 1.0581380 0.7757244), wk = 0.0024155 k( 92) = ( 0.0000000 1.0581380 0.7999658), wk = 0.0024155 k( 93) = ( 0.0000000 1.0581380 0.8242072), wk = 0.0024155 k( 94) = ( 0.0000000 1.0581380 0.8484486), wk = 0.0024155 k( 95) = ( 0.0000000 1.0581380 0.8726900), wk = 0.0024155 k( 96) = ( 0.0000000 1.0581380 0.8969314), wk = 0.0024155 k( 97) = ( 0.0000000 1.0581380 0.9211727), wk = 0.0024155 k( 98) = ( 0.0000000 1.0581380 0.9454141), wk = 0.0024155 k( 99) = ( 0.0000000 1.0581380 0.9696555), wk = 0.0024155 k( 100) = ( 0.0000000 1.0581380 0.9938969), wk = 0.0024155 k( 101) = ( 0.0000000 1.0581380 1.0181383), wk = 0.0024155 k( 102) = ( 0.0000000 1.0581380 1.0181383), wk = 0.0024155 k( 103) = ( 0.0241610 1.0581380 1.0181383), wk = 0.0024155 k( 104) = ( 0.0483221 1.0581380 1.0181383), wk = 0.0024155 k( 105) = ( 0.0724831 1.0581380 1.0181383), wk = 0.0024155 k( 106) = ( 0.0966442 1.0581380 1.0181383), wk = 0.0024155 k( 107) = ( 0.1208052 1.0581380 1.0181383), wk = 0.0024155 k( 108) = ( 0.1449662 1.0581380 1.0181383), wk = 0.0024155 k( 109) = ( 0.1691273 1.0581380 1.0181383), wk = 0.0024155 k( 110) = ( 0.1932883 1.0581380 1.0181383), wk = 0.0024155 k( 111) = ( 0.2174494 1.0581380 1.0181383), wk = 0.0024155 k( 112) = ( 0.2416104 1.0581380 1.0181383), wk = 0.0024155 k( 113) = ( 0.2657715 1.0581380 1.0181383), wk = 0.0024155 k( 114) = ( 0.2657715 1.0581380 1.0181383), wk = 0.0024155 k( 115) = ( 0.2598654 1.0346238 1.0181383), wk = 0.0024155 k( 116) = ( 0.2539594 1.0111096 1.0181383), wk = 0.0024155 k( 117) = ( 0.2480534 0.9875955 1.0181383), wk = 0.0024155 k( 118) = ( 0.2421473 0.9640813 1.0181383), wk = 0.0024155 k( 119) = ( 0.2362413 0.9405671 1.0181383), wk = 0.0024155 k( 120) = ( 0.2303353 0.9170529 1.0181383), wk = 0.0024155 k( 121) = ( 0.2244292 0.8935388 1.0181383), wk = 0.0024155 k( 122) = ( 0.2185232 0.8700246 1.0181383), wk = 0.0024155 k( 123) = ( 0.2126172 0.8465104 1.0181383), wk = 0.0024155 k( 124) = ( 0.2067111 0.8229962 1.0181383), wk = 0.0024155 k( 125) = ( 0.2008051 0.7994820 1.0181383), wk = 0.0024155 k( 126) = ( 0.1948991 0.7759679 1.0181383), wk = 0.0024155 k( 127) = ( 0.1889930 0.7524537 1.0181383), wk = 0.0024155 k( 128) = ( 0.1830870 0.7289395 1.0181383), wk = 0.0024155 k( 129) = ( 0.1771810 0.7054253 1.0181383), wk = 0.0024155 k( 130) = ( 0.1712750 0.6819112 1.0181383), wk = 0.0024155 k( 131) = ( 0.1653689 0.6583970 1.0181383), wk = 0.0024155 k( 132) = ( 0.1594629 0.6348828 1.0181383), wk = 0.0024155 k( 133) = ( 0.1535568 0.6113686 1.0181383), wk = 0.0024155 k( 134) = ( 0.1476508 0.5878545 1.0181383), wk = 0.0024155 k( 135) = ( 0.1417448 0.5643403 1.0181383), wk = 0.0024155 k( 136) = ( 0.1358388 0.5408261 1.0181383), wk = 0.0024155 k( 137) = ( 0.1299327 0.5173119 1.0181383), wk = 0.0024155 k( 138) = ( 0.1240267 0.4937977 1.0181383), wk = 0.0024155 k( 139) = ( 0.1181206 0.4702835 1.0181383), wk = 0.0024155 k( 140) = ( 0.1122146 0.4467694 1.0181383), wk = 0.0024155 k( 141) = ( 0.1063086 0.4232552 1.0181383), wk = 0.0024155 k( 142) = ( 0.1004025 0.3997410 1.0181383), wk = 0.0024155 k( 143) = ( 0.0944965 0.3762268 1.0181383), wk = 0.0024155 k( 144) = ( 0.0885905 0.3527127 1.0181383), wk = 0.0024155 k( 145) = ( 0.0826845 0.3291985 1.0181383), wk = 0.0024155 k( 146) = ( 0.0767784 0.3056843 1.0181383), wk = 0.0024155 k( 147) = ( 0.0708724 0.2821701 1.0181383), wk = 0.0024155 k( 148) = ( 0.0649664 0.2586560 1.0181383), wk = 0.0024155 k( 149) = ( 0.0590603 0.2351418 1.0181383), wk = 0.0024155 k( 150) = ( 0.0531543 0.2116276 1.0181383), wk = 0.0024155 k( 151) = ( 0.0472483 0.1881134 1.0181383), wk = 0.0024155 k( 152) = ( 0.0413422 0.1645993 1.0181383), wk = 0.0024155 k( 153) = ( 0.0354362 0.1410851 1.0181383), wk = 0.0024155 k( 154) = ( 0.0295302 0.1175709 1.0181383), wk = 0.0024155 k( 155) = ( 0.0236241 0.0940567 1.0181383), wk = 0.0024155 k( 156) = ( 0.0177181 0.0705425 1.0181383), wk = 0.0024155 k( 157) = ( 0.0118121 0.0470284 1.0181383), wk = 0.0024155 k( 158) = ( 0.0059060 0.0235142 1.0181383), wk = 0.0024155 k( 159) = ( 0.0000000 0.0000000 1.0181383), wk = 0.0024155 k( 160) = ( 0.0000000 0.0000000 1.0181383), wk = 0.0024155 k( 161) = ( 0.0000000 0.0000000 0.9938969), wk = 0.0024155 k( 162) = ( 0.0000000 0.0000000 0.9696555), wk = 0.0024155 k( 163) = ( 0.0000000 0.0000000 0.9454141), wk = 0.0024155 k( 164) = ( 0.0000000 0.0000000 0.9211727), wk = 0.0024155 k( 165) = ( 0.0000000 0.0000000 0.8969314), wk = 0.0024155 k( 166) = ( 0.0000000 0.0000000 0.8726900), wk = 0.0024155 k( 167) = ( 0.0000000 0.0000000 0.8484486), wk = 0.0024155 k( 168) = ( 0.0000000 0.0000000 0.8242072), wk = 0.0024155 k( 169) = ( 0.0000000 0.0000000 0.7999658), wk = 0.0024155 k( 170) = ( 0.0000000 0.0000000 0.7757244), wk = 0.0024155 k( 171) = ( 0.0000000 0.0000000 0.7514830), wk = 0.0024155 k( 172) = ( 0.0000000 0.0000000 0.7272416), wk = 0.0024155 k( 173) = ( 0.0000000 0.0000000 0.7030003), wk = 0.0024155 k( 174) = ( 0.0000000 0.0000000 0.6787589), wk = 0.0024155 k( 175) = ( 0.0000000 0.0000000 0.6545175), wk = 0.0024155 k( 176) = ( 0.0000000 0.0000000 0.6302761), wk = 0.0024155 k( 177) = ( 0.0000000 0.0000000 0.6060347), wk = 0.0024155 k( 178) = ( 0.0000000 0.0000000 0.5817933), wk = 0.0024155 k( 179) = ( 0.0000000 0.0000000 0.5575519), wk = 0.0024155 k( 180) = ( 0.0000000 0.0000000 0.5333105), wk = 0.0024155 k( 181) = ( 0.0000000 0.0000000 0.5090691), wk = 0.0024155 k( 182) = ( 0.0000000 0.0000000 0.4848278), wk = 0.0024155 k( 183) = ( 0.0000000 0.0000000 0.4605864), wk = 0.0024155 k( 184) = ( 0.0000000 0.0000000 0.4363450), wk = 0.0024155 k( 185) = ( 0.0000000 0.0000000 0.4121036), wk = 0.0024155 k( 186) = ( 0.0000000 0.0000000 0.3878622), wk = 0.0024155 k( 187) = ( 0.0000000 0.0000000 0.3636208), wk = 0.0024155 k( 188) = ( 0.0000000 0.0000000 0.3393794), wk = 0.0024155 k( 189) = ( 0.0000000 0.0000000 0.3151380), wk = 0.0024155 k( 190) = ( 0.0000000 0.0000000 0.2908966), wk = 0.0024155 k( 191) = ( 0.0000000 0.0000000 0.2666553), wk = 0.0024155 k( 192) = ( 0.0000000 0.0000000 0.2424139), wk = 0.0024155 k( 193) = ( 0.0000000 0.0000000 0.2181725), wk = 0.0024155 k( 194) = ( 0.0000000 0.0000000 0.1939311), wk = 0.0024155 k( 195) = ( 0.0000000 0.0000000 0.1696897), wk = 0.0024155 k( 196) = ( 0.0000000 0.0000000 0.1454483), wk = 0.0024155 k( 197) = ( 0.0000000 0.0000000 0.1212069), wk = 0.0024155 k( 198) = ( 0.0000000 0.0000000 0.0969656), wk = 0.0024155 k( 199) = ( 0.0000000 0.0000000 0.0727242), wk = 0.0024155 k( 200) = ( 0.0000000 0.0000000 0.0484828), wk = 0.0024155 k( 201) = ( 0.0000000 0.0000000 0.0242414), wk = 0.0024155 k( 202) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 203) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 204) = ( -0.0238095 0.0059802 0.0000000), wk = 0.0024155 k( 205) = ( -0.0476191 0.0119604 0.0000000), wk = 0.0024155 k( 206) = ( -0.0714286 0.0179406 0.0000000), wk = 0.0024155 k( 207) = ( -0.0952381 0.0239209 0.0000000), wk = 0.0024155 k( 208) = ( -0.1190476 0.0299011 0.0000000), wk = 0.0024155 k( 209) = ( -0.1428571 0.0358813 0.0000000), wk = 0.0024155 k( 210) = ( -0.1666667 0.0418615 0.0000000), wk = 0.0024155 k( 211) = ( -0.1904762 0.0478417 0.0000000), wk = 0.0024155 k( 212) = ( -0.2142857 0.0538219 0.0000000), wk = 0.0024155 k( 213) = ( -0.2380952 0.0598021 0.0000000), wk = 0.0024155 k( 214) = ( -0.2619048 0.0657824 0.0000000), wk = 0.0024155 k( 215) = ( -0.2857143 0.0717626 0.0000000), wk = 0.0024155 k( 216) = ( -0.3095238 0.0777428 0.0000000), wk = 0.0024155 k( 217) = ( -0.3333333 0.0837230 0.0000000), wk = 0.0024155 k( 218) = ( -0.3571429 0.0897032 0.0000000), wk = 0.0024155 k( 219) = ( -0.3809524 0.0956834 0.0000000), wk = 0.0024155 k( 220) = ( -0.4047619 0.1016636 0.0000000), wk = 0.0024155 k( 221) = ( -0.4285714 0.1076439 0.0000000), wk = 0.0024155 k( 222) = ( -0.4523810 0.1136241 0.0000000), wk = 0.0024155 k( 223) = ( -0.4761905 0.1196043 0.0000000), wk = 0.0024155 k( 224) = ( -0.5000000 0.1255845 0.0000000), wk = 0.0024155 k( 225) = ( -0.5000000 0.1255845 0.0000000), wk = 0.0024155 k( 226) = ( -0.4941443 0.1488983 -0.0000000), wk = 0.0024155 k( 227) = ( -0.4882886 0.1722122 -0.0000000), wk = 0.0024155 k( 228) = ( -0.4824329 0.1955260 -0.0000000), wk = 0.0024155 k( 229) = ( -0.4765772 0.2188398 -0.0000000), wk = 0.0024155 k( 230) = ( -0.4707214 0.2421537 -0.0000000), wk = 0.0024155 k( 231) = ( -0.4648657 0.2654675 -0.0000000), wk = 0.0024155 k( 232) = ( -0.4590100 0.2887814 -0.0000000), wk = 0.0024155 k( 233) = ( -0.4531543 0.3120952 -0.0000000), wk = 0.0024155 k( 234) = ( -0.4472986 0.3354090 -0.0000000), wk = 0.0024155 k( 235) = ( -0.4414429 0.3587229 -0.0000000), wk = 0.0024155 k( 236) = ( -0.4355871 0.3820367 -0.0000000), wk = 0.0024155 k( 237) = ( -0.4297314 0.4053506 -0.0000000), wk = 0.0024155 k( 238) = ( -0.4238757 0.4286644 -0.0000000), wk = 0.0024155 k( 239) = ( -0.4180200 0.4519782 -0.0000000), wk = 0.0024155 k( 240) = ( -0.4121643 0.4752921 -0.0000000), wk = 0.0024155 k( 241) = ( -0.4063086 0.4986059 -0.0000000), wk = 0.0024155 k( 242) = ( -0.4004529 0.5219198 -0.0000000), wk = 0.0024155 k( 243) = ( -0.3945972 0.5452336 -0.0000000), wk = 0.0024155 k( 244) = ( -0.3887414 0.5685474 -0.0000000), wk = 0.0024155 k( 245) = ( -0.3828857 0.5918613 -0.0000000), wk = 0.0024155 k( 246) = ( -0.3770300 0.6151751 -0.0000000), wk = 0.0024155 k( 247) = ( -0.3711743 0.6384889 -0.0000000), wk = 0.0024155 k( 248) = ( -0.3653186 0.6618028 -0.0000000), wk = 0.0024155 k( 249) = ( -0.3594629 0.6851166 -0.0000000), wk = 0.0024155 k( 250) = ( -0.3536072 0.7084304 -0.0000000), wk = 0.0024155 k( 251) = ( -0.3477515 0.7317443 -0.0000000), wk = 0.0024155 k( 252) = ( -0.3418957 0.7550581 -0.0000000), wk = 0.0024155 k( 253) = ( -0.3360400 0.7783719 -0.0000000), wk = 0.0024155 k( 254) = ( -0.3301843 0.8016858 -0.0000000), wk = 0.0024155 k( 255) = ( -0.3243286 0.8249996 -0.0000000), wk = 0.0024155 k( 256) = ( -0.3184729 0.8483134 -0.0000000), wk = 0.0024155 k( 257) = ( -0.3126172 0.8716273 -0.0000000), wk = 0.0024155 k( 258) = ( -0.3067615 0.8949411 -0.0000000), wk = 0.0024155 k( 259) = ( -0.3009058 0.9182550 -0.0000000), wk = 0.0024155 k( 260) = ( -0.2950500 0.9415688 -0.0000000), wk = 0.0024155 k( 261) = ( -0.2891943 0.9648826 -0.0000000), wk = 0.0024155 k( 262) = ( -0.2833386 0.9881965 -0.0000000), wk = 0.0024155 k( 263) = ( -0.2774829 1.0115103 -0.0000000), wk = 0.0024155 k( 264) = ( -0.2716272 1.0348242 -0.0000000), wk = 0.0024155 k( 265) = ( -0.2657715 1.0581380 -0.0000000), wk = 0.0024155 k( 266) = ( -0.2657715 1.0581380 -0.0000000), wk = 0.0024155 k( 267) = ( -0.2657715 1.0581380 0.0242414), wk = 0.0024155 k( 268) = ( -0.2657715 1.0581380 0.0484828), wk = 0.0024155 k( 269) = ( -0.2657715 1.0581380 0.0727242), wk = 0.0024155 k( 270) = ( -0.2657715 1.0581380 0.0969656), wk = 0.0024155 k( 271) = ( -0.2657715 1.0581380 0.1212069), wk = 0.0024155 k( 272) = ( -0.2657715 1.0581380 0.1454483), wk = 0.0024155 k( 273) = ( -0.2657715 1.0581380 0.1696897), wk = 0.0024155 k( 274) = ( -0.2657715 1.0581380 0.1939311), wk = 0.0024155 k( 275) = ( -0.2657715 1.0581380 0.2181725), wk = 0.0024155 k( 276) = ( -0.2657715 1.0581380 0.2424139), wk = 0.0024155 k( 277) = ( -0.2657715 1.0581380 0.2666553), wk = 0.0024155 k( 278) = ( -0.2657715 1.0581380 0.2908966), wk = 0.0024155 k( 279) = ( -0.2657715 1.0581380 0.3151380), wk = 0.0024155 k( 280) = ( -0.2657715 1.0581380 0.3393794), wk = 0.0024155 k( 281) = ( -0.2657715 1.0581380 0.3636208), wk = 0.0024155 k( 282) = ( -0.2657715 1.0581380 0.3878622), wk = 0.0024155 k( 283) = ( -0.2657715 1.0581380 0.4121036), wk = 0.0024155 k( 284) = ( -0.2657715 1.0581380 0.4363450), wk = 0.0024155 k( 285) = ( -0.2657715 1.0581380 0.4605864), wk = 0.0024155 k( 286) = ( -0.2657715 1.0581380 0.4848278), wk = 0.0024155 k( 287) = ( -0.2657715 1.0581380 0.5090691), wk = 0.0024155 k( 288) = ( -0.2657715 1.0581380 0.5333105), wk = 0.0024155 k( 289) = ( -0.2657715 1.0581380 0.5575519), wk = 0.0024155 k( 290) = ( -0.2657715 1.0581380 0.5817933), wk = 0.0024155 k( 291) = ( -0.2657715 1.0581380 0.6060347), wk = 0.0024155 k( 292) = ( -0.2657715 1.0581380 0.6302761), wk = 0.0024155 k( 293) = ( -0.2657715 1.0581380 0.6545175), wk = 0.0024155 k( 294) = ( -0.2657715 1.0581380 0.6787589), wk = 0.0024155 k( 295) = ( -0.2657715 1.0581380 0.7030003), wk = 0.0024155 k( 296) = ( -0.2657715 1.0581380 0.7272416), wk = 0.0024155 k( 297) = ( -0.2657715 1.0581380 0.7514830), wk = 0.0024155 k( 298) = ( -0.2657715 1.0581380 0.7757244), wk = 0.0024155 k( 299) = ( -0.2657715 1.0581380 0.7999658), wk = 0.0024155 k( 300) = ( -0.2657715 1.0581380 0.8242072), wk = 0.0024155 k( 301) = ( -0.2657715 1.0581380 0.8484486), wk = 0.0024155 k( 302) = ( -0.2657715 1.0581380 0.8726900), wk = 0.0024155 k( 303) = ( -0.2657715 1.0581380 0.8969314), wk = 0.0024155 k( 304) = ( -0.2657715 1.0581380 0.9211727), wk = 0.0024155 k( 305) = ( -0.2657715 1.0581380 0.9454141), wk = 0.0024155 k( 306) = ( -0.2657715 1.0581380 0.9696555), wk = 0.0024155 k( 307) = ( -0.2657715 1.0581380 0.9938969), wk = 0.0024155 k( 308) = ( -0.2657715 1.0581380 1.0181383), wk = 0.0024155 k( 309) = ( -0.2657715 1.0581380 1.0181383), wk = 0.0024155 k( 310) = ( -0.2716272 1.0348242 1.0181383), wk = 0.0024155 k( 311) = ( -0.2774829 1.0115103 1.0181383), wk = 0.0024155 k( 312) = ( -0.2833386 0.9881965 1.0181383), wk = 0.0024155 k( 313) = ( -0.2891943 0.9648826 1.0181383), wk = 0.0024155 k( 314) = ( -0.2950500 0.9415688 1.0181383), wk = 0.0024155 k( 315) = ( -0.3009058 0.9182550 1.0181383), wk = 0.0024155 k( 316) = ( -0.3067615 0.8949411 1.0181383), wk = 0.0024155 k( 317) = ( -0.3126172 0.8716273 1.0181383), wk = 0.0024155 k( 318) = ( -0.3184729 0.8483134 1.0181383), wk = 0.0024155 k( 319) = ( -0.3243286 0.8249996 1.0181383), wk = 0.0024155 k( 320) = ( -0.3301843 0.8016858 1.0181383), wk = 0.0024155 k( 321) = ( -0.3360400 0.7783719 1.0181383), wk = 0.0024155 k( 322) = ( -0.3418957 0.7550581 1.0181383), wk = 0.0024155 k( 323) = ( -0.3477515 0.7317443 1.0181383), wk = 0.0024155 k( 324) = ( -0.3536072 0.7084304 1.0181383), wk = 0.0024155 k( 325) = ( -0.3594629 0.6851166 1.0181383), wk = 0.0024155 k( 326) = ( -0.3653186 0.6618028 1.0181383), wk = 0.0024155 k( 327) = ( -0.3711743 0.6384889 1.0181383), wk = 0.0024155 k( 328) = ( -0.3770300 0.6151751 1.0181383), wk = 0.0024155 k( 329) = ( -0.3828857 0.5918613 1.0181383), wk = 0.0024155 k( 330) = ( -0.3887414 0.5685474 1.0181383), wk = 0.0024155 k( 331) = ( -0.3945972 0.5452336 1.0181383), wk = 0.0024155 k( 332) = ( -0.4004529 0.5219198 1.0181383), wk = 0.0024155 k( 333) = ( -0.4063086 0.4986059 1.0181383), wk = 0.0024155 k( 334) = ( -0.4121643 0.4752921 1.0181383), wk = 0.0024155 k( 335) = ( -0.4180200 0.4519782 1.0181383), wk = 0.0024155 k( 336) = ( -0.4238757 0.4286644 1.0181383), wk = 0.0024155 k( 337) = ( -0.4297314 0.4053506 1.0181383), wk = 0.0024155 k( 338) = ( -0.4355871 0.3820367 1.0181383), wk = 0.0024155 k( 339) = ( -0.4414429 0.3587229 1.0181383), wk = 0.0024155 k( 340) = ( -0.4472986 0.3354090 1.0181383), wk = 0.0024155 k( 341) = ( -0.4531543 0.3120952 1.0181383), wk = 0.0024155 k( 342) = ( -0.4590100 0.2887814 1.0181383), wk = 0.0024155 k( 343) = ( -0.4648657 0.2654675 1.0181383), wk = 0.0024155 k( 344) = ( -0.4707214 0.2421537 1.0181383), wk = 0.0024155 k( 345) = ( -0.4765772 0.2188398 1.0181383), wk = 0.0024155 k( 346) = ( -0.4824329 0.1955260 1.0181383), wk = 0.0024155 k( 347) = ( -0.4882886 0.1722122 1.0181383), wk = 0.0024155 k( 348) = ( -0.4941443 0.1488983 1.0181383), wk = 0.0024155 k( 349) = ( -0.5000000 0.1255845 1.0181383), wk = 0.0024155 k( 350) = ( -0.5000000 0.1255845 1.0181383), wk = 0.0024155 k( 351) = ( -0.5000000 0.1255845 0.9938969), wk = 0.0024155 k( 352) = ( -0.5000000 0.1255845 0.9696555), wk = 0.0024155 k( 353) = ( -0.5000000 0.1255845 0.9454141), wk = 0.0024155 k( 354) = ( -0.5000000 0.1255845 0.9211727), wk = 0.0024155 k( 355) = ( -0.5000000 0.1255845 0.8969314), wk = 0.0024155 k( 356) = ( -0.5000000 0.1255845 0.8726900), wk = 0.0024155 k( 357) = ( -0.5000000 0.1255845 0.8484486), wk = 0.0024155 k( 358) = ( -0.5000000 0.1255845 0.8242072), wk = 0.0024155 k( 359) = ( -0.5000000 0.1255845 0.7999658), wk = 0.0024155 k( 360) = ( -0.5000000 0.1255845 0.7757244), wk = 0.0024155 k( 361) = ( -0.5000000 0.1255845 0.7514830), wk = 0.0024155 k( 362) = ( -0.5000000 0.1255845 0.7272416), wk = 0.0024155 k( 363) = ( -0.5000000 0.1255845 0.7030003), wk = 0.0024155 k( 364) = ( -0.5000000 0.1255845 0.6787589), wk = 0.0024155 k( 365) = ( -0.5000000 0.1255845 0.6545175), wk = 0.0024155 k( 366) = ( -0.5000000 0.1255845 0.6302761), wk = 0.0024155 k( 367) = ( -0.5000000 0.1255845 0.6060347), wk = 0.0024155 k( 368) = ( -0.5000000 0.1255845 0.5817933), wk = 0.0024155 k( 369) = ( -0.5000000 0.1255845 0.5575519), wk = 0.0024155 k( 370) = ( -0.5000000 0.1255845 0.5333105), wk = 0.0024155 k( 371) = ( -0.5000000 0.1255845 0.5090691), wk = 0.0024155 k( 372) = ( -0.5000000 0.1255845 0.4848278), wk = 0.0024155 k( 373) = ( -0.5000000 0.1255845 0.4605864), wk = 0.0024155 k( 374) = ( -0.5000000 0.1255845 0.4363450), wk = 0.0024155 k( 375) = ( -0.5000000 0.1255845 0.4121036), wk = 0.0024155 k( 376) = ( -0.5000000 0.1255845 0.3878622), wk = 0.0024155 k( 377) = ( -0.5000000 0.1255845 0.3636208), wk = 0.0024155 k( 378) = ( -0.5000000 0.1255845 0.3393794), wk = 0.0024155 k( 379) = ( -0.5000000 0.1255845 0.3151380), wk = 0.0024155 k( 380) = ( -0.5000000 0.1255845 0.2908966), wk = 0.0024155 k( 381) = ( -0.5000000 0.1255845 0.2666553), wk = 0.0024155 k( 382) = ( -0.5000000 0.1255845 0.2424139), wk = 0.0024155 k( 383) = ( -0.5000000 0.1255845 0.2181725), wk = 0.0024155 k( 384) = ( -0.5000000 0.1255845 0.1939311), wk = 0.0024155 k( 385) = ( -0.5000000 0.1255845 0.1696897), wk = 0.0024155 k( 386) = ( -0.5000000 0.1255845 0.1454483), wk = 0.0024155 k( 387) = ( -0.5000000 0.1255845 0.1212069), wk = 0.0024155 k( 388) = ( -0.5000000 0.1255845 0.0969656), wk = 0.0024155 k( 389) = ( -0.5000000 0.1255845 0.0727242), wk = 0.0024155 k( 390) = ( -0.5000000 0.1255845 0.0484828), wk = 0.0024155 k( 391) = ( -0.5000000 0.1255845 0.0242414), wk = 0.0024155 k( 392) = ( -0.5000000 0.1255845 0.0000000), wk = 0.0024155 k( 393) = ( 0.0000000 0.0000000 1.0181383), wk = 0.0024155 k( 394) = ( -0.0238095 0.0059802 1.0181383), wk = 0.0024155 k( 395) = ( -0.0476191 0.0119604 1.0181383), wk = 0.0024155 k( 396) = ( -0.0714286 0.0179406 1.0181383), wk = 0.0024155 k( 397) = ( -0.0952381 0.0239209 1.0181383), wk = 0.0024155 k( 398) = ( -0.1190476 0.0299011 1.0181383), wk = 0.0024155 k( 399) = ( -0.1428571 0.0358813 1.0181383), wk = 0.0024155 k( 400) = ( -0.1666667 0.0418615 1.0181383), wk = 0.0024155 k( 401) = ( -0.1904762 0.0478417 1.0181383), wk = 0.0024155 k( 402) = ( -0.2142857 0.0538219 1.0181383), wk = 0.0024155 k( 403) = ( -0.2380952 0.0598021 1.0181383), wk = 0.0024155 k( 404) = ( -0.2619048 0.0657824 1.0181383), wk = 0.0024155 k( 405) = ( -0.2857143 0.0717626 1.0181383), wk = 0.0024155 k( 406) = ( -0.3095238 0.0777428 1.0181383), wk = 0.0024155 k( 407) = ( -0.3333333 0.0837230 1.0181383), wk = 0.0024155 k( 408) = ( -0.3571429 0.0897032 1.0181383), wk = 0.0024155 k( 409) = ( -0.3809524 0.0956834 1.0181383), wk = 0.0024155 k( 410) = ( -0.4047619 0.1016636 1.0181383), wk = 0.0024155 k( 411) = ( -0.4285714 0.1076439 1.0181383), wk = 0.0024155 k( 412) = ( -0.4523810 0.1136241 1.0181383), wk = 0.0024155 k( 413) = ( -0.4761905 0.1196043 1.0181383), wk = 0.0024155 k( 414) = ( -0.5000000 0.1255845 1.0181383), wk = 0.0024155 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 2) = ( 0.0059060 0.0059060 0.0000000), wk = 0.0024155 k( 3) = ( 0.0118121 0.0118121 0.0000000), wk = 0.0024155 k( 4) = ( 0.0177181 0.0177181 0.0000000), wk = 0.0024155 k( 5) = ( 0.0236241 0.0236241 0.0000000), wk = 0.0024155 k( 6) = ( 0.0295302 0.0295302 -0.0000000), wk = 0.0024155 k( 7) = ( 0.0354362 0.0354362 0.0000000), wk = 0.0024155 k( 8) = ( 0.0413422 0.0413422 0.0000000), wk = 0.0024155 k( 9) = ( 0.0472483 0.0472483 0.0000000), wk = 0.0024155 k( 10) = ( 0.0531543 0.0531543 0.0000000), wk = 0.0024155 k( 11) = ( 0.0590603 0.0590603 0.0000000), wk = 0.0024155 k( 12) = ( 0.0649664 0.0649664 0.0000000), wk = 0.0024155 k( 13) = ( 0.0708724 0.0708724 0.0000000), wk = 0.0024155 k( 14) = ( 0.0767784 0.0767784 0.0000000), wk = 0.0024155 k( 15) = ( 0.0826845 0.0826845 0.0000000), wk = 0.0024155 k( 16) = ( 0.0885905 0.0885905 0.0000000), wk = 0.0024155 k( 17) = ( 0.0944965 0.0944965 0.0000000), wk = 0.0024155 k( 18) = ( 0.1004025 0.1004026 0.0000000), wk = 0.0024155 k( 19) = ( 0.1063086 0.1063086 0.0000000), wk = 0.0024155 k( 20) = ( 0.1122146 0.1122146 0.0000000), wk = 0.0024155 k( 21) = ( 0.1181206 0.1181206 0.0000000), wk = 0.0024155 k( 22) = ( 0.1240267 0.1240267 0.0000000), wk = 0.0024155 k( 23) = ( 0.1299327 0.1299327 0.0000000), wk = 0.0024155 k( 24) = ( 0.1358388 0.1358388 0.0000000), wk = 0.0024155 k( 25) = ( 0.1417448 0.1417448 0.0000000), wk = 0.0024155 k( 26) = ( 0.1476508 0.1476508 0.0000000), wk = 0.0024155 k( 27) = ( 0.1535568 0.1535568 0.0000000), wk = 0.0024155 k( 28) = ( 0.1594629 0.1594629 -0.0000000), wk = 0.0024155 k( 29) = ( 0.1653689 0.1653689 0.0000000), wk = 0.0024155 k( 30) = ( 0.1712750 0.1712750 0.0000000), wk = 0.0024155 k( 31) = ( 0.1771810 0.1771810 0.0000000), wk = 0.0024155 k( 32) = ( 0.1830870 0.1830870 -0.0000000), wk = 0.0024155 k( 33) = ( 0.1889930 0.1889930 0.0000000), wk = 0.0024155 k( 34) = ( 0.1948991 0.1948991 0.0000000), wk = 0.0024155 k( 35) = ( 0.2008051 0.2008051 0.0000000), wk = 0.0024155 k( 36) = ( 0.2067111 0.2067111 0.0000000), wk = 0.0024155 k( 37) = ( 0.2126172 0.2126172 0.0000000), wk = 0.0024155 k( 38) = ( 0.2185232 0.2185232 -0.0000000), wk = 0.0024155 k( 39) = ( 0.2244292 0.2244292 0.0000000), wk = 0.0024155 k( 40) = ( 0.2303353 0.2303353 0.0000000), wk = 0.0024155 k( 41) = ( 0.2362413 0.2362413 0.0000000), wk = 0.0024155 k( 42) = ( 0.2421473 0.2421473 0.0000000), wk = 0.0024155 k( 43) = ( 0.2480534 0.2480534 0.0000000), wk = 0.0024155 k( 44) = ( 0.2539594 0.2539594 0.0000000), wk = 0.0024155 k( 45) = ( 0.2598654 0.2598654 -0.0000000), wk = 0.0024155 k( 46) = ( 0.2657715 0.2657715 -0.0000000), wk = 0.0024155 k( 47) = ( 0.2657715 0.2657715 -0.0000000), wk = 0.0024155 k( 48) = ( 0.2416104 0.2870650 0.0000000), wk = 0.0024155 k( 49) = ( 0.2174494 0.3083585 0.0000000), wk = 0.0024155 k( 50) = ( 0.1932883 0.3296520 -0.0000000), wk = 0.0024155 k( 51) = ( 0.1691273 0.3509455 -0.0000000), wk = 0.0024155 k( 52) = ( 0.1449662 0.3722390 0.0000000), wk = 0.0024155 k( 53) = ( 0.1208052 0.3935325 -0.0000000), wk = 0.0024155 k( 54) = ( 0.0966442 0.4148260 0.0000000), wk = 0.0024155 k( 55) = ( 0.0724831 0.4361195 0.0000000), wk = 0.0024155 k( 56) = ( 0.0483221 0.4574130 0.0000000), wk = 0.0024155 k( 57) = ( 0.0241610 0.4787065 0.0000000), wk = 0.0024155 k( 58) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0024155 k( 59) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0024155 k( 60) = ( 0.0000000 0.5000000 0.0119048), wk = 0.0024155 k( 61) = ( 0.0000000 0.5000000 0.0238095), wk = 0.0024155 k( 62) = ( 0.0000000 0.5000000 0.0357143), wk = 0.0024155 k( 63) = ( 0.0000000 0.5000000 0.0476191), wk = 0.0024155 k( 64) = ( 0.0000000 0.5000000 0.0595238), wk = 0.0024155 k( 65) = ( 0.0000000 0.5000000 0.0714286), wk = 0.0024155 k( 66) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0024155 k( 67) = ( 0.0000000 0.5000000 0.0952381), wk = 0.0024155 k( 68) = ( 0.0000000 0.5000000 0.1071429), wk = 0.0024155 k( 69) = ( 0.0000000 0.5000000 0.1190476), wk = 0.0024155 k( 70) = ( 0.0000000 0.5000000 0.1309524), wk = 0.0024155 k( 71) = ( 0.0000000 0.5000000 0.1428571), wk = 0.0024155 k( 72) = ( 0.0000000 0.5000000 0.1547619), wk = 0.0024155 k( 73) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0024155 k( 74) = ( 0.0000000 0.5000000 0.1785714), wk = 0.0024155 k( 75) = ( 0.0000000 0.5000000 0.1904762), wk = 0.0024155 k( 76) = ( 0.0000000 0.5000000 0.2023809), wk = 0.0024155 k( 77) = ( 0.0000000 0.5000000 0.2142857), wk = 0.0024155 k( 78) = ( 0.0000000 0.5000000 0.2261905), wk = 0.0024155 k( 79) = ( 0.0000000 0.5000000 0.2380952), wk = 0.0024155 k( 80) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0024155 k( 81) = ( 0.0000000 0.5000000 0.2619048), wk = 0.0024155 k( 82) = ( 0.0000000 0.5000000 0.2738095), wk = 0.0024155 k( 83) = ( 0.0000000 0.5000000 0.2857143), wk = 0.0024155 k( 84) = ( 0.0000000 0.5000000 0.2976190), wk = 0.0024155 k( 85) = ( 0.0000000 0.5000000 0.3095238), wk = 0.0024155 k( 86) = ( 0.0000000 0.5000000 0.3214286), wk = 0.0024155 k( 87) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0024155 k( 88) = ( 0.0000000 0.5000000 0.3452381), wk = 0.0024155 k( 89) = ( 0.0000000 0.5000000 0.3571429), wk = 0.0024155 k( 90) = ( 0.0000000 0.5000000 0.3690476), wk = 0.0024155 k( 91) = ( 0.0000000 0.5000000 0.3809524), wk = 0.0024155 k( 92) = ( 0.0000000 0.5000000 0.3928571), wk = 0.0024155 k( 93) = ( 0.0000000 0.5000000 0.4047619), wk = 0.0024155 k( 94) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0024155 k( 95) = ( 0.0000000 0.5000000 0.4285714), wk = 0.0024155 k( 96) = ( 0.0000000 0.5000000 0.4404762), wk = 0.0024155 k( 97) = ( 0.0000000 0.5000000 0.4523810), wk = 0.0024155 k( 98) = ( 0.0000000 0.5000000 0.4642857), wk = 0.0024155 k( 99) = ( 0.0000000 0.5000000 0.4761905), wk = 0.0024155 k( 100) = ( 0.0000000 0.5000000 0.4880952), wk = 0.0024155 k( 101) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0024155 k( 102) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0024155 k( 103) = ( 0.0241610 0.4787065 0.5000000), wk = 0.0024155 k( 104) = ( 0.0483221 0.4574130 0.5000000), wk = 0.0024155 k( 105) = ( 0.0724831 0.4361195 0.5000000), wk = 0.0024155 k( 106) = ( 0.0966442 0.4148260 0.5000000), wk = 0.0024155 k( 107) = ( 0.1208052 0.3935325 0.5000000), wk = 0.0024155 k( 108) = ( 0.1449662 0.3722390 0.5000000), wk = 0.0024155 k( 109) = ( 0.1691273 0.3509455 0.5000000), wk = 0.0024155 k( 110) = ( 0.1932883 0.3296520 0.5000000), wk = 0.0024155 k( 111) = ( 0.2174494 0.3083585 0.5000000), wk = 0.0024155 k( 112) = ( 0.2416104 0.2870650 0.5000000), wk = 0.0024155 k( 113) = ( 0.2657715 0.2657715 0.5000000), wk = 0.0024155 k( 114) = ( 0.2657715 0.2657715 0.5000000), wk = 0.0024155 k( 115) = ( 0.2598654 0.2598654 0.5000000), wk = 0.0024155 k( 116) = ( 0.2539594 0.2539594 0.5000000), wk = 0.0024155 k( 117) = ( 0.2480534 0.2480534 0.5000000), wk = 0.0024155 k( 118) = ( 0.2421473 0.2421473 0.5000000), wk = 0.0024155 k( 119) = ( 0.2362413 0.2362413 0.5000000), wk = 0.0024155 k( 120) = ( 0.2303353 0.2303353 0.5000000), wk = 0.0024155 k( 121) = ( 0.2244292 0.2244292 0.5000000), wk = 0.0024155 k( 122) = ( 0.2185232 0.2185232 0.5000000), wk = 0.0024155 k( 123) = ( 0.2126172 0.2126172 0.5000000), wk = 0.0024155 k( 124) = ( 0.2067111 0.2067111 0.5000000), wk = 0.0024155 k( 125) = ( 0.2008051 0.2008051 0.5000000), wk = 0.0024155 k( 126) = ( 0.1948991 0.1948991 0.5000000), wk = 0.0024155 k( 127) = ( 0.1889930 0.1889930 0.5000000), wk = 0.0024155 k( 128) = ( 0.1830870 0.1830870 0.5000000), wk = 0.0024155 k( 129) = ( 0.1771810 0.1771810 0.5000000), wk = 0.0024155 k( 130) = ( 0.1712750 0.1712750 0.5000000), wk = 0.0024155 k( 131) = ( 0.1653689 0.1653689 0.5000000), wk = 0.0024155 k( 132) = ( 0.1594629 0.1594629 0.5000000), wk = 0.0024155 k( 133) = ( 0.1535568 0.1535568 0.5000000), wk = 0.0024155 k( 134) = ( 0.1476508 0.1476508 0.5000000), wk = 0.0024155 k( 135) = ( 0.1417448 0.1417448 0.5000000), wk = 0.0024155 k( 136) = ( 0.1358388 0.1358388 0.5000000), wk = 0.0024155 k( 137) = ( 0.1299327 0.1299327 0.5000000), wk = 0.0024155 k( 138) = ( 0.1240267 0.1240267 0.5000000), wk = 0.0024155 k( 139) = ( 0.1181206 0.1181206 0.5000000), wk = 0.0024155 k( 140) = ( 0.1122146 0.1122146 0.5000000), wk = 0.0024155 k( 141) = ( 0.1063086 0.1063086 0.5000000), wk = 0.0024155 k( 142) = ( 0.1004025 0.1004026 0.5000000), wk = 0.0024155 k( 143) = ( 0.0944965 0.0944965 0.5000000), wk = 0.0024155 k( 144) = ( 0.0885905 0.0885905 0.5000000), wk = 0.0024155 k( 145) = ( 0.0826845 0.0826845 0.5000000), wk = 0.0024155 k( 146) = ( 0.0767784 0.0767784 0.5000000), wk = 0.0024155 k( 147) = ( 0.0708724 0.0708724 0.5000000), wk = 0.0024155 k( 148) = ( 0.0649664 0.0649664 0.5000000), wk = 0.0024155 k( 149) = ( 0.0590603 0.0590603 0.5000000), wk = 0.0024155 k( 150) = ( 0.0531543 0.0531543 0.5000000), wk = 0.0024155 k( 151) = ( 0.0472483 0.0472483 0.5000000), wk = 0.0024155 k( 152) = ( 0.0413422 0.0413422 0.5000000), wk = 0.0024155 k( 153) = ( 0.0354362 0.0354362 0.5000000), wk = 0.0024155 k( 154) = ( 0.0295302 0.0295302 0.5000000), wk = 0.0024155 k( 155) = ( 0.0236241 0.0236241 0.5000000), wk = 0.0024155 k( 156) = ( 0.0177181 0.0177181 0.5000000), wk = 0.0024155 k( 157) = ( 0.0118121 0.0118121 0.5000000), wk = 0.0024155 k( 158) = ( 0.0059060 0.0059060 0.5000000), wk = 0.0024155 k( 159) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024155 k( 160) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024155 k( 161) = ( 0.0000000 0.0000000 0.4880952), wk = 0.0024155 k( 162) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0024155 k( 163) = ( 0.0000000 0.0000000 0.4642857), wk = 0.0024155 k( 164) = ( 0.0000000 0.0000000 0.4523809), wk = 0.0024155 k( 165) = ( 0.0000000 0.0000000 0.4404762), wk = 0.0024155 k( 166) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0024155 k( 167) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0024155 k( 168) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0024155 k( 169) = ( 0.0000000 0.0000000 0.3928571), wk = 0.0024155 k( 170) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0024155 k( 171) = ( 0.0000000 0.0000000 0.3690476), wk = 0.0024155 k( 172) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0024155 k( 173) = ( 0.0000000 0.0000000 0.3452381), wk = 0.0024155 k( 174) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0024155 k( 175) = ( 0.0000000 0.0000000 0.3214286), wk = 0.0024155 k( 176) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0024155 k( 177) = ( 0.0000000 0.0000000 0.2976190), wk = 0.0024155 k( 178) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0024155 k( 179) = ( 0.0000000 0.0000000 0.2738095), wk = 0.0024155 k( 180) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0024155 k( 181) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0024155 k( 182) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0024155 k( 183) = ( 0.0000000 0.0000000 0.2261905), wk = 0.0024155 k( 184) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0024155 k( 185) = ( 0.0000000 0.0000000 0.2023809), wk = 0.0024155 k( 186) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0024155 k( 187) = ( 0.0000000 0.0000000 0.1785714), wk = 0.0024155 k( 188) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0024155 k( 189) = ( 0.0000000 0.0000000 0.1547619), wk = 0.0024155 k( 190) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0024155 k( 191) = ( 0.0000000 0.0000000 0.1309524), wk = 0.0024155 k( 192) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0024155 k( 193) = ( 0.0000000 0.0000000 0.1071429), wk = 0.0024155 k( 194) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0024155 k( 195) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0024155 k( 196) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0024155 k( 197) = ( 0.0000000 0.0000000 0.0595238), wk = 0.0024155 k( 198) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0024155 k( 199) = ( 0.0000000 0.0000000 0.0357143), wk = 0.0024155 k( 200) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0024155 k( 201) = ( 0.0000000 0.0000000 0.0119048), wk = 0.0024155 k( 202) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 203) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024155 k( 204) = ( -0.0238095 0.0238095 -0.0000000), wk = 0.0024155 k( 205) = ( -0.0476191 0.0476190 -0.0000000), wk = 0.0024155 k( 206) = ( -0.0714286 0.0714286 0.0000000), wk = 0.0024155 k( 207) = ( -0.0952381 0.0952381 -0.0000000), wk = 0.0024155 k( 208) = ( -0.1190476 0.1190476 -0.0000000), wk = 0.0024155 k( 209) = ( -0.1428571 0.1428571 0.0000000), wk = 0.0024155 k( 210) = ( -0.1666667 0.1666667 -0.0000000), wk = 0.0024155 k( 211) = ( -0.1904762 0.1904762 -0.0000000), wk = 0.0024155 k( 212) = ( -0.2142857 0.2142857 -0.0000000), wk = 0.0024155 k( 213) = ( -0.2380952 0.2380952 -0.0000000), wk = 0.0024155 k( 214) = ( -0.2619048 0.2619048 -0.0000000), wk = 0.0024155 k( 215) = ( -0.2857143 0.2857143 -0.0000000), wk = 0.0024155 k( 216) = ( -0.3095238 0.3095238 0.0000000), wk = 0.0024155 k( 217) = ( -0.3333333 0.3333333 -0.0000000), wk = 0.0024155 k( 218) = ( -0.3571429 0.3571429 -0.0000000), wk = 0.0024155 k( 219) = ( -0.3809524 0.3809524 -0.0000000), wk = 0.0024155 k( 220) = ( -0.4047619 0.4047619 0.0000000), wk = 0.0024155 k( 221) = ( -0.4285714 0.4285714 -0.0000000), wk = 0.0024155 k( 222) = ( -0.4523810 0.4523810 -0.0000000), wk = 0.0024155 k( 223) = ( -0.4761905 0.4761905 -0.0000000), wk = 0.0024155 k( 224) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0024155 k( 225) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0024155 k( 226) = ( -0.4941443 0.5058557 0.0000000), wk = 0.0024155 k( 227) = ( -0.4882886 0.5117114 0.0000000), wk = 0.0024155 k( 228) = ( -0.4824329 0.5175671 -0.0000000), wk = 0.0024155 k( 229) = ( -0.4765772 0.5234228 -0.0000000), wk = 0.0024155 k( 230) = ( -0.4707214 0.5292786 -0.0000000), wk = 0.0024155 k( 231) = ( -0.4648657 0.5351343 -0.0000000), wk = 0.0024155 k( 232) = ( -0.4590100 0.5409900 -0.0000000), wk = 0.0024155 k( 233) = ( -0.4531543 0.5468457 0.0000000), wk = 0.0024155 k( 234) = ( -0.4472986 0.5527014 -0.0000000), wk = 0.0024155 k( 235) = ( -0.4414429 0.5585571 -0.0000000), wk = 0.0024155 k( 236) = ( -0.4355871 0.5644128 -0.0000000), wk = 0.0024155 k( 237) = ( -0.4297314 0.5702686 -0.0000000), wk = 0.0024155 k( 238) = ( -0.4238757 0.5761243 0.0000000), wk = 0.0024155 k( 239) = ( -0.4180200 0.5819800 0.0000000), wk = 0.0024155 k( 240) = ( -0.4121643 0.5878357 -0.0000000), wk = 0.0024155 k( 241) = ( -0.4063086 0.5936914 -0.0000000), wk = 0.0024155 k( 242) = ( -0.4004529 0.5995471 -0.0000000), wk = 0.0024155 k( 243) = ( -0.3945972 0.6054028 -0.0000000), wk = 0.0024155 k( 244) = ( -0.3887414 0.6112585 -0.0000000), wk = 0.0024155 k( 245) = ( -0.3828857 0.6171143 0.0000000), wk = 0.0024155 k( 246) = ( -0.3770300 0.6229700 -0.0000000), wk = 0.0024155 k( 247) = ( -0.3711743 0.6288257 0.0000000), wk = 0.0024155 k( 248) = ( -0.3653186 0.6346814 0.0000000), wk = 0.0024155 k( 249) = ( -0.3594629 0.6405371 -0.0000000), wk = 0.0024155 k( 250) = ( -0.3536072 0.6463928 0.0000000), wk = 0.0024155 k( 251) = ( -0.3477515 0.6522486 0.0000000), wk = 0.0024155 k( 252) = ( -0.3418957 0.6581043 -0.0000000), wk = 0.0024155 k( 253) = ( -0.3360400 0.6639600 0.0000000), wk = 0.0024155 k( 254) = ( -0.3301843 0.6698157 -0.0000000), wk = 0.0024155 k( 255) = ( -0.3243286 0.6756714 -0.0000000), wk = 0.0024155 k( 256) = ( -0.3184729 0.6815271 0.0000000), wk = 0.0024155 k( 257) = ( -0.3126172 0.6873828 0.0000000), wk = 0.0024155 k( 258) = ( -0.3067615 0.6932385 -0.0000000), wk = 0.0024155 k( 259) = ( -0.3009058 0.6990943 0.0000000), wk = 0.0024155 k( 260) = ( -0.2950500 0.7049500 -0.0000000), wk = 0.0024155 k( 261) = ( -0.2891943 0.7108057 0.0000000), wk = 0.0024155 k( 262) = ( -0.2833386 0.7166614 -0.0000000), wk = 0.0024155 k( 263) = ( -0.2774829 0.7225171 -0.0000000), wk = 0.0024155 k( 264) = ( -0.2716272 0.7283728 0.0000000), wk = 0.0024155 k( 265) = ( -0.2657715 0.7342285 -0.0000000), wk = 0.0024155 k( 266) = ( -0.2657715 0.7342285 -0.0000000), wk = 0.0024155 k( 267) = ( -0.2657715 0.7342285 0.0119048), wk = 0.0024155 k( 268) = ( -0.2657715 0.7342285 0.0238095), wk = 0.0024155 k( 269) = ( -0.2657715 0.7342285 0.0357143), wk = 0.0024155 k( 270) = ( -0.2657715 0.7342285 0.0476191), wk = 0.0024155 k( 271) = ( -0.2657715 0.7342285 0.0595238), wk = 0.0024155 k( 272) = ( -0.2657715 0.7342285 0.0714286), wk = 0.0024155 k( 273) = ( -0.2657715 0.7342285 0.0833333), wk = 0.0024155 k( 274) = ( -0.2657715 0.7342285 0.0952381), wk = 0.0024155 k( 275) = ( -0.2657715 0.7342285 0.1071429), wk = 0.0024155 k( 276) = ( -0.2657715 0.7342285 0.1190476), wk = 0.0024155 k( 277) = ( -0.2657715 0.7342285 0.1309524), wk = 0.0024155 k( 278) = ( -0.2657715 0.7342285 0.1428571), wk = 0.0024155 k( 279) = ( -0.2657715 0.7342285 0.1547619), wk = 0.0024155 k( 280) = ( -0.2657715 0.7342285 0.1666667), wk = 0.0024155 k( 281) = ( -0.2657715 0.7342285 0.1785714), wk = 0.0024155 k( 282) = ( -0.2657715 0.7342285 0.1904762), wk = 0.0024155 k( 283) = ( -0.2657715 0.7342285 0.2023810), wk = 0.0024155 k( 284) = ( -0.2657715 0.7342285 0.2142857), wk = 0.0024155 k( 285) = ( -0.2657715 0.7342285 0.2261905), wk = 0.0024155 k( 286) = ( -0.2657715 0.7342285 0.2380952), wk = 0.0024155 k( 287) = ( -0.2657715 0.7342285 0.2500000), wk = 0.0024155 k( 288) = ( -0.2657715 0.7342285 0.2619048), wk = 0.0024155 k( 289) = ( -0.2657715 0.7342285 0.2738095), wk = 0.0024155 k( 290) = ( -0.2657715 0.7342285 0.2857143), wk = 0.0024155 k( 291) = ( -0.2657715 0.7342285 0.2976190), wk = 0.0024155 k( 292) = ( -0.2657715 0.7342285 0.3095238), wk = 0.0024155 k( 293) = ( -0.2657715 0.7342285 0.3214286), wk = 0.0024155 k( 294) = ( -0.2657715 0.7342285 0.3333333), wk = 0.0024155 k( 295) = ( -0.2657715 0.7342285 0.3452381), wk = 0.0024155 k( 296) = ( -0.2657715 0.7342285 0.3571429), wk = 0.0024155 k( 297) = ( -0.2657715 0.7342285 0.3690476), wk = 0.0024155 k( 298) = ( -0.2657715 0.7342285 0.3809524), wk = 0.0024155 k( 299) = ( -0.2657715 0.7342285 0.3928571), wk = 0.0024155 k( 300) = ( -0.2657715 0.7342285 0.4047619), wk = 0.0024155 k( 301) = ( -0.2657715 0.7342285 0.4166667), wk = 0.0024155 k( 302) = ( -0.2657715 0.7342285 0.4285714), wk = 0.0024155 k( 303) = ( -0.2657715 0.7342285 0.4404762), wk = 0.0024155 k( 304) = ( -0.2657715 0.7342285 0.4523809), wk = 0.0024155 k( 305) = ( -0.2657715 0.7342285 0.4642857), wk = 0.0024155 k( 306) = ( -0.2657715 0.7342285 0.4761905), wk = 0.0024155 k( 307) = ( -0.2657715 0.7342285 0.4880952), wk = 0.0024155 k( 308) = ( -0.2657715 0.7342285 0.5000000), wk = 0.0024155 k( 309) = ( -0.2657715 0.7342285 0.5000000), wk = 0.0024155 k( 310) = ( -0.2716272 0.7283728 0.5000000), wk = 0.0024155 k( 311) = ( -0.2774829 0.7225171 0.5000000), wk = 0.0024155 k( 312) = ( -0.2833386 0.7166614 0.5000000), wk = 0.0024155 k( 313) = ( -0.2891943 0.7108057 0.5000000), wk = 0.0024155 k( 314) = ( -0.2950500 0.7049500 0.5000000), wk = 0.0024155 k( 315) = ( -0.3009058 0.6990943 0.5000000), wk = 0.0024155 k( 316) = ( -0.3067615 0.6932385 0.5000000), wk = 0.0024155 k( 317) = ( -0.3126172 0.6873828 0.5000000), wk = 0.0024155 k( 318) = ( -0.3184729 0.6815271 0.5000000), wk = 0.0024155 k( 319) = ( -0.3243286 0.6756714 0.5000000), wk = 0.0024155 k( 320) = ( -0.3301843 0.6698157 0.5000000), wk = 0.0024155 k( 321) = ( -0.3360400 0.6639600 0.5000000), wk = 0.0024155 k( 322) = ( -0.3418957 0.6581043 0.5000000), wk = 0.0024155 k( 323) = ( -0.3477515 0.6522486 0.5000000), wk = 0.0024155 k( 324) = ( -0.3536072 0.6463928 0.5000000), wk = 0.0024155 k( 325) = ( -0.3594629 0.6405371 0.5000000), wk = 0.0024155 k( 326) = ( -0.3653186 0.6346814 0.5000000), wk = 0.0024155 k( 327) = ( -0.3711743 0.6288257 0.5000000), wk = 0.0024155 k( 328) = ( -0.3770300 0.6229700 0.5000000), wk = 0.0024155 k( 329) = ( -0.3828857 0.6171143 0.5000000), wk = 0.0024155 k( 330) = ( -0.3887414 0.6112585 0.5000000), wk = 0.0024155 k( 331) = ( -0.3945972 0.6054028 0.5000000), wk = 0.0024155 k( 332) = ( -0.4004529 0.5995471 0.5000000), wk = 0.0024155 k( 333) = ( -0.4063086 0.5936914 0.5000000), wk = 0.0024155 k( 334) = ( -0.4121643 0.5878357 0.5000000), wk = 0.0024155 k( 335) = ( -0.4180200 0.5819800 0.5000000), wk = 0.0024155 k( 336) = ( -0.4238757 0.5761243 0.5000000), wk = 0.0024155 k( 337) = ( -0.4297314 0.5702686 0.5000000), wk = 0.0024155 k( 338) = ( -0.4355871 0.5644128 0.5000000), wk = 0.0024155 k( 339) = ( -0.4414429 0.5585571 0.5000000), wk = 0.0024155 k( 340) = ( -0.4472986 0.5527014 0.5000000), wk = 0.0024155 k( 341) = ( -0.4531543 0.5468457 0.5000000), wk = 0.0024155 k( 342) = ( -0.4590100 0.5409900 0.5000000), wk = 0.0024155 k( 343) = ( -0.4648657 0.5351343 0.5000000), wk = 0.0024155 k( 344) = ( -0.4707214 0.5292786 0.5000000), wk = 0.0024155 k( 345) = ( -0.4765772 0.5234228 0.5000000), wk = 0.0024155 k( 346) = ( -0.4824329 0.5175671 0.5000000), wk = 0.0024155 k( 347) = ( -0.4882886 0.5117114 0.5000000), wk = 0.0024155 k( 348) = ( -0.4941443 0.5058557 0.5000000), wk = 0.0024155 k( 349) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024155 k( 350) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024155 k( 351) = ( -0.5000000 0.5000000 0.4880952), wk = 0.0024155 k( 352) = ( -0.5000000 0.5000000 0.4761905), wk = 0.0024155 k( 353) = ( -0.5000000 0.5000000 0.4642857), wk = 0.0024155 k( 354) = ( -0.5000000 0.5000000 0.4523809), wk = 0.0024155 k( 355) = ( -0.5000000 0.5000000 0.4404762), wk = 0.0024155 k( 356) = ( -0.5000000 0.5000000 0.4285714), wk = 0.0024155 k( 357) = ( -0.5000000 0.5000000 0.4166667), wk = 0.0024155 k( 358) = ( -0.5000000 0.5000000 0.4047619), wk = 0.0024155 k( 359) = ( -0.5000000 0.5000000 0.3928571), wk = 0.0024155 k( 360) = ( -0.5000000 0.5000000 0.3809524), wk = 0.0024155 k( 361) = ( -0.5000000 0.5000000 0.3690476), wk = 0.0024155 k( 362) = ( -0.5000000 0.5000000 0.3571429), wk = 0.0024155 k( 363) = ( -0.5000000 0.5000000 0.3452381), wk = 0.0024155 k( 364) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0024155 k( 365) = ( -0.5000000 0.5000000 0.3214286), wk = 0.0024155 k( 366) = ( -0.5000000 0.5000000 0.3095238), wk = 0.0024155 k( 367) = ( -0.5000000 0.5000000 0.2976190), wk = 0.0024155 k( 368) = ( -0.5000000 0.5000000 0.2857143), wk = 0.0024155 k( 369) = ( -0.5000000 0.5000000 0.2738095), wk = 0.0024155 k( 370) = ( -0.5000000 0.5000000 0.2619048), wk = 0.0024155 k( 371) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0024155 k( 372) = ( -0.5000000 0.5000000 0.2380952), wk = 0.0024155 k( 373) = ( -0.5000000 0.5000000 0.2261905), wk = 0.0024155 k( 374) = ( -0.5000000 0.5000000 0.2142857), wk = 0.0024155 k( 375) = ( -0.5000000 0.5000000 0.2023809), wk = 0.0024155 k( 376) = ( -0.5000000 0.5000000 0.1904762), wk = 0.0024155 k( 377) = ( -0.5000000 0.5000000 0.1785714), wk = 0.0024155 k( 378) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0024155 k( 379) = ( -0.5000000 0.5000000 0.1547619), wk = 0.0024155 k( 380) = ( -0.5000000 0.5000000 0.1428571), wk = 0.0024155 k( 381) = ( -0.5000000 0.5000000 0.1309524), wk = 0.0024155 k( 382) = ( -0.5000000 0.5000000 0.1190476), wk = 0.0024155 k( 383) = ( -0.5000000 0.5000000 0.1071429), wk = 0.0024155 k( 384) = ( -0.5000000 0.5000000 0.0952381), wk = 0.0024155 k( 385) = ( -0.5000000 0.5000000 0.0833333), wk = 0.0024155 k( 386) = ( -0.5000000 0.5000000 0.0714286), wk = 0.0024155 k( 387) = ( -0.5000000 0.5000000 0.0595238), wk = 0.0024155 k( 388) = ( -0.5000000 0.5000000 0.0476191), wk = 0.0024155 k( 389) = ( -0.5000000 0.5000000 0.0357143), wk = 0.0024155 k( 390) = ( -0.5000000 0.5000000 0.0238095), wk = 0.0024155 k( 391) = ( -0.5000000 0.5000000 0.0119048), wk = 0.0024155 k( 392) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0024155 k( 393) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024155 k( 394) = ( -0.0238095 0.0238095 0.5000000), wk = 0.0024155 k( 395) = ( -0.0476191 0.0476190 0.5000000), wk = 0.0024155 k( 396) = ( -0.0714286 0.0714286 0.5000000), wk = 0.0024155 k( 397) = ( -0.0952381 0.0952381 0.5000000), wk = 0.0024155 k( 398) = ( -0.1190476 0.1190476 0.5000000), wk = 0.0024155 k( 399) = ( -0.1428571 0.1428571 0.5000000), wk = 0.0024155 k( 400) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0024155 k( 401) = ( -0.1904762 0.1904762 0.5000000), wk = 0.0024155 k( 402) = ( -0.2142857 0.2142857 0.5000000), wk = 0.0024155 k( 403) = ( -0.2380952 0.2380952 0.5000000), wk = 0.0024155 k( 404) = ( -0.2619048 0.2619048 0.5000000), wk = 0.0024155 k( 405) = ( -0.2857143 0.2857143 0.5000000), wk = 0.0024155 k( 406) = ( -0.3095238 0.3095238 0.5000000), wk = 0.0024155 k( 407) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0024155 k( 408) = ( -0.3571429 0.3571429 0.5000000), wk = 0.0024155 k( 409) = ( -0.3809524 0.3809524 0.5000000), wk = 0.0024155 k( 410) = ( -0.4047619 0.4047619 0.5000000), wk = 0.0024155 k( 411) = ( -0.4285714 0.4285714 0.5000000), wk = 0.0024155 k( 412) = ( -0.4523810 0.4523810 0.5000000), wk = 0.0024155 k( 413) = ( -0.4761905 0.4761905 0.5000000), wk = 0.0024155 k( 414) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0024155 Dense grid: 53387 G-vectors FFT dimensions: ( 75, 75, 40) Smooth grid: 30337 G-vectors FFT dimensions: ( 64, 64, 32) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 168, 48) NL pseudopotentials 0.16 Mb ( 84, 124) Each V/rho on FFT grid 0.09 Mb ( 5625) Each G-vector array 0.01 Mb ( 1112) G-vector shells 0.00 Mb ( 578) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.49 Mb ( 168, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.18 Mb ( 124, 2, 48) The potential is recalculated from file : ./ZrGe2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 42.1 secs Computing kpt #: 2 total cpu time spent up to now is 44.6 secs Computing kpt #: 3 total cpu time spent up to now is 46.2 secs Computing kpt #: 4 total cpu time spent up to now is 47.8 secs Computing kpt #: 5 total cpu time spent up to now is 49.4 secs Computing kpt #: 6 total cpu time spent up to now is 51.2 secs Computing kpt #: 7 total cpu time spent up to now is 53.0 secs Computing kpt #: 8 total cpu time spent up to now is 54.7 secs Computing kpt #: 9 total cpu time spent up to now is 56.4 secs Computing kpt #: 10 total cpu time spent up to now is 58.3 secs Computing kpt #: 11 total cpu time spent up to now is 59.8 secs Computing kpt #: 12 total cpu time spent up to now is 61.3 secs Computing kpt #: 13 total cpu time spent up to now is 62.8 secs Computing kpt #: 14 total cpu time spent up to now is 64.4 secs Computing kpt #: 15 total cpu time spent up to now is 65.8 secs Computing kpt #: 16 total cpu time spent up to now is 67.3 secs Computing kpt #: 17 total cpu time spent up to now is 68.8 secs Computing kpt #: 18 total cpu time spent up to now is 70.5 secs Computing kpt #: 19 total cpu time spent up to now is 72.1 secs Computing kpt #: 20 total cpu time spent up to now is 73.5 secs Computing kpt #: 21 total cpu time spent up to now is 74.9 secs Computing kpt #: 22 total cpu time spent up to now is 76.4 secs Computing kpt #: 23 total cpu time spent up to now is 78.4 secs Computing kpt #: 24 total cpu time spent up to now is 80.0 secs Computing kpt #: 25 total cpu time spent up to now is 81.7 secs Computing kpt #: 26 total cpu time spent up to now is 83.2 secs Computing kpt #: 27 total cpu time spent up to now is 84.7 secs Computing kpt #: 28 total cpu time spent up to now is 86.3 secs Computing kpt #: 29 total cpu time spent up to now is 87.9 secs Computing kpt #: 30 total cpu time spent up to now is 89.4 secs Computing kpt #: 31 total cpu time spent up to now is 91.1 secs Computing kpt #: 32 total cpu time spent up to now is 93.0 secs Computing kpt #: 33 total cpu time spent up to now is 95.6 secs Computing kpt #: 34 total cpu time spent up to now is 97.2 secs Computing kpt #: 35 total cpu time spent up to now is 98.9 secs Computing kpt #: 36 total cpu time spent up to now is 100.5 secs Computing kpt #: 37 total cpu time spent up to now is 101.9 secs Computing kpt #: 38 total cpu time spent up to now is 103.4 secs Computing kpt #: 39 total cpu time spent up to now is 105.0 secs Computing kpt #: 40 total cpu time spent up to now is 106.7 secs Computing kpt #: 41 total cpu time spent up to now is 108.2 secs Computing kpt #: 42 total cpu time spent up to now is 109.7 secs Computing kpt #: 43 total cpu time spent up to now is 111.2 secs Computing kpt #: 44 total cpu time spent up to now is 112.7 secs Computing kpt #: 45 total cpu time spent up to now is 114.3 secs Computing kpt #: 46 total cpu time spent up to now is 116.0 secs Computing kpt #: 47 total cpu time spent up to now is 117.5 secs Computing kpt #: 48 total cpu time spent up to now is 119.0 secs Computing kpt #: 49 total cpu time spent up to now is 120.4 secs Computing kpt #: 50 total cpu time spent up to now is 122.1 secs Computing kpt #: 51 total cpu time spent up to now is 123.5 secs Computing kpt #: 52 total cpu time spent up to now is 125.0 secs Computing kpt #: 53 total cpu time spent up to now is 126.6 secs Computing kpt #: 54 total cpu time spent up to now is 128.4 secs Computing kpt #: 55 total cpu time spent up to now is 130.0 secs Computing kpt #: 56 total cpu time spent up to now is 131.6 secs Computing kpt #: 57 total cpu time spent up to now is 133.1 secs Computing kpt #: 58 total cpu time spent up to now is 134.6 secs Computing kpt #: 59 total cpu time spent up to now is 136.1 secs Computing kpt #: 60 total cpu time spent up to now is 137.6 secs Computing kpt #: 61 total cpu time spent up to now is 139.1 secs Computing kpt #: 62 total cpu time spent up to now is 140.6 secs Computing kpt #: 63 total cpu time spent up to now is 142.0 secs Computing kpt #: 64 total cpu time spent up to now is 143.6 secs Computing kpt #: 65 total cpu time spent up to now is 145.7 secs Computing kpt #: 66 total cpu time spent up to now is 147.6 secs Computing kpt #: 67 total cpu time spent up to now is 149.1 secs Computing kpt #: 68 total cpu time spent up to now is 151.5 secs Computing kpt #: 69 total cpu time spent up to now is 153.6 secs Computing kpt #: 70 total cpu time spent up to now is 155.1 secs Computing kpt #: 71 total cpu time spent up to now is 156.6 secs Computing kpt #: 72 total cpu time spent up to now is 158.1 secs Computing kpt #: 73 total cpu time spent up to now is 159.8 secs Computing kpt #: 74 total cpu time spent up to now is 161.6 secs Computing kpt #: 75 total cpu time spent up to now is 163.3 secs Computing kpt #: 76 total cpu time spent up to now is 165.0 secs Computing kpt #: 77 total cpu time spent up to now is 166.5 secs Computing kpt #: 78 total cpu time spent up to now is 168.1 secs Computing kpt #: 79 total cpu time spent up to now is 169.6 secs Computing kpt #: 80 total cpu time spent up to now is 171.2 secs Computing kpt #: 81 total cpu time spent up to now is 172.7 secs Computing kpt #: 82 total cpu time spent up to now is 174.2 secs Computing kpt #: 83 total cpu time spent up to now is 175.6 secs Computing kpt #: 84 total cpu time spent up to now is 177.3 secs Computing kpt #: 85 total cpu time spent up to now is 180.7 secs Computing kpt #: 86 total cpu time spent up to now is 182.4 secs Computing kpt #: 87 total cpu time spent up to now is 183.9 secs Computing kpt #: 88 total cpu time spent up to now is 185.3 secs Computing kpt #: 89 total cpu time spent up to now is 186.8 secs Computing kpt #: 90 total cpu time spent up to now is 188.3 secs Computing kpt #: 91 total cpu time spent up to now is 190.0 secs Computing kpt #: 92 total cpu time spent up to now is 191.7 secs Computing kpt #: 93 total cpu time spent up to now is 193.3 secs Computing kpt #: 94 total cpu time spent up to now is 194.8 secs Computing kpt #: 95 total cpu time spent up to now is 196.3 secs Computing kpt #: 96 total cpu time spent up to now is 198.2 secs Computing kpt #: 97 total cpu time spent up to now is 199.6 secs Computing kpt #: 98 total cpu time spent up to now is 202.1 secs Computing kpt #: 99 total cpu time spent up to now is 205.9 secs Computing kpt #: 100 total cpu time spent up to now is 207.4 secs Computing kpt #: 101 total cpu time spent up to now is 208.7 secs Computing kpt #: 102 total cpu time spent up to now is 210.0 secs Computing kpt #: 103 total cpu time spent up to now is 211.5 secs Computing kpt #: 104 total cpu time spent up to now is 213.3 secs Computing kpt #: 105 total cpu time spent up to now is 215.1 secs Computing kpt #: 106 total cpu time spent up to now is 216.6 secs Computing kpt #: 107 total cpu time spent up to now is 218.1 secs Computing kpt #: 108 total cpu time spent up to now is 219.5 secs Computing kpt #: 109 total cpu time spent up to now is 221.0 secs Computing kpt #: 110 total cpu time spent up to now is 223.0 secs Computing kpt #: 111 total cpu time spent up to now is 224.7 secs Computing kpt #: 112 total cpu time spent up to now is 226.2 secs Computing kpt #: 113 total cpu time spent up to now is 227.8 secs Computing kpt #: 114 total cpu time spent up to now is 231.1 secs Computing kpt #: 115 total cpu time spent up to now is 233.6 secs Computing kpt #: 116 total cpu time spent up to now is 235.0 secs Computing kpt #: 117 total cpu time spent up to now is 236.5 secs Computing kpt #: 118 total cpu time spent up to now is 237.9 secs Computing kpt #: 119 total cpu time spent up to now is 239.2 secs Computing kpt #: 120 total cpu time spent up to now is 240.6 secs Computing kpt #: 121 total cpu time spent up to now is 242.0 secs Computing kpt #: 122 total cpu time spent up to now is 243.7 secs Computing kpt #: 123 total cpu time spent up to now is 245.3 secs Computing kpt #: 124 total cpu time spent up to now is 246.6 secs Computing kpt #: 125 total cpu time spent up to now is 249.6 secs Computing kpt #: 126 total cpu time spent up to now is 251.5 secs Computing kpt #: 127 total cpu time spent up to now is 252.8 secs Computing kpt #: 128 total cpu time spent up to now is 254.3 secs Computing kpt #: 129 total cpu time spent up to now is 255.7 secs Computing kpt #: 130 total cpu time spent up to now is 257.0 secs Computing kpt #: 131 total cpu time spent up to now is 258.3 secs Computing kpt #: 132 total cpu time spent up to now is 259.6 secs Computing kpt #: 133 total cpu time spent up to now is 261.1 secs Computing kpt #: 134 total cpu time spent up to now is 262.5 secs Computing kpt #: 135 total cpu time spent up to now is 264.0 secs Computing kpt #: 136 total cpu time spent up to now is 267.4 secs Computing kpt #: 137 total cpu time spent up to now is 270.0 secs Computing kpt #: 138 total cpu time spent up to now is 271.4 secs Computing kpt #: 139 total cpu time spent up to now is 273.2 secs Computing kpt #: 140 total cpu time spent up to now is 274.7 secs Computing kpt #: 141 total cpu time spent up to now is 276.2 secs Computing kpt #: 142 total cpu time spent up to now is 278.4 secs Computing kpt #: 143 total cpu time spent up to now is 280.3 secs Computing kpt #: 144 total cpu time spent up to now is 281.9 secs Computing kpt #: 145 total cpu time spent up to now is 283.6 secs Computing kpt #: 146 total cpu time spent up to now is 285.2 secs Computing kpt #: 147 total cpu time spent up to now is 289.3 secs Computing kpt #: 148 total cpu time spent up to now is 292.4 secs Computing kpt #: 149 total cpu time spent up to now is 293.8 secs Computing kpt #: 150 total cpu time spent up to now is 295.4 secs Computing kpt #: 151 total cpu time spent up to now is 296.7 secs Computing kpt #: 152 total cpu time spent up to now is 298.0 secs Computing kpt #: 153 total cpu time spent up to now is 299.4 secs Computing kpt #: 154 total cpu time spent up to now is 300.9 secs Computing kpt #: 155 total cpu time spent up to now is 302.4 secs Computing kpt #: 156 total cpu time spent up to now is 303.8 secs Computing kpt #: 157 total cpu time spent up to now is 305.2 secs Computing kpt #: 158 total cpu time spent up to now is 306.7 secs Computing kpt #: 159 total cpu time spent up to now is 308.2 secs Computing kpt #: 160 total cpu time spent up to now is 311.6 secs Computing kpt #: 161 total cpu time spent up to now is 315.5 secs Computing kpt #: 162 total cpu time spent up to now is 317.2 secs Computing kpt #: 163 total cpu time spent up to now is 319.3 secs Computing kpt #: 164 total cpu time spent up to now is 321.5 secs Computing kpt #: 165 total cpu time spent up to now is 323.5 secs Computing kpt #: 166 total cpu time spent up to now is 325.2 secs Computing kpt #: 167 total cpu time spent up to now is 326.9 secs Computing kpt #: 168 total cpu time spent up to now is 328.6 secs Computing kpt #: 169 total cpu time spent up to now is 330.6 secs Computing kpt #: 170 total cpu time spent up to now is 334.6 secs Computing kpt #: 171 total cpu time spent up to now is 339.1 secs Computing kpt #: 172 total cpu time spent up to now is 341.0 secs Computing kpt #: 173 total cpu time spent up to now is 342.7 secs Computing kpt #: 174 total cpu time spent up to now is 344.5 secs Computing kpt #: 175 total cpu time spent up to now is 347.1 secs Computing kpt #: 176 total cpu time spent up to now is 349.1 secs Computing kpt #: 177 total cpu time spent up to now is 351.0 secs Computing kpt #: 178 total cpu time spent up to now is 354.3 secs Computing kpt #: 179 total cpu time spent up to now is 358.0 secs Computing kpt #: 180 total cpu time spent up to now is 360.0 secs Computing kpt #: 181 total cpu time spent up to now is 361.7 secs Computing kpt #: 182 total cpu time spent up to now is 363.5 secs Computing kpt #: 183 total cpu time spent up to now is 366.0 secs Computing kpt #: 184 total cpu time spent up to now is 367.9 secs Computing kpt #: 185 total cpu time spent up to now is 369.7 secs Computing kpt #: 186 total cpu time spent up to now is 373.0 secs Computing kpt #: 187 total cpu time spent up to now is 375.7 secs Computing kpt #: 188 total cpu time spent up to now is 377.2 secs Computing kpt #: 189 total cpu time spent up to now is 378.8 secs Computing kpt #: 190 total cpu time spent up to now is 380.4 secs Computing kpt #: 191 total cpu time spent up to now is 382.4 secs Computing kpt #: 192 total cpu time spent up to now is 383.9 secs Computing kpt #: 193 total cpu time spent up to now is 385.5 secs Computing kpt #: 194 total cpu time spent up to now is 387.1 secs Computing kpt #: 195 total cpu time spent up to now is 388.6 secs Computing kpt #: 196 total cpu time spent up to now is 392.5 secs Computing kpt #: 197 total cpu time spent up to now is 395.5 secs Computing kpt #: 198 total cpu time spent up to now is 397.4 secs Computing kpt #: 199 total cpu time spent up to now is 399.2 secs Computing kpt #: 200 total cpu time spent up to now is 401.1 secs Computing kpt #: 201 total cpu time spent up to now is 402.7 secs Computing kpt #: 202 total cpu time spent up to now is 404.2 secs Computing kpt #: 203 total cpu time spent up to now is 406.4 secs Computing kpt #: 204 total cpu time spent up to now is 408.4 secs Computing kpt #: 205 total cpu time spent up to now is 410.2 secs Computing kpt #: 206 total cpu time spent up to now is 414.1 secs Computing kpt #: 207 total cpu time spent up to now is 417.6 secs Computing kpt #: 208 total cpu time spent up to now is 419.9 secs Computing kpt #: 209 total cpu time spent up to now is 421.4 secs Computing kpt #: 210 total cpu time spent up to now is 422.9 secs Computing kpt #: 211 total cpu time spent up to now is 424.4 secs Computing kpt #: 212 total cpu time spent up to now is 425.8 secs Computing kpt #: 213 total cpu time spent up to now is 427.4 secs Computing kpt #: 214 total cpu time spent up to now is 430.6 secs Computing kpt #: 215 total cpu time spent up to now is 433.7 secs Computing kpt #: 216 total cpu time spent up to now is 435.3 secs Computing kpt #: 217 total cpu time spent up to now is 436.6 secs Computing kpt #: 218 total cpu time spent up to now is 438.0 secs Computing kpt #: 219 total cpu time spent up to now is 439.7 secs Computing kpt #: 220 total cpu time spent up to now is 441.7 secs Computing kpt #: 221 total cpu time spent up to now is 443.2 secs Computing kpt #: 222 total cpu time spent up to now is 445.0 secs Computing kpt #: 223 total cpu time spent up to now is 446.7 secs Computing kpt #: 224 total cpu time spent up to now is 448.8 secs Computing kpt #: 225 total cpu time spent up to now is 452.8 secs Computing kpt #: 226 total cpu time spent up to now is 455.4 secs Computing kpt #: 227 total cpu time spent up to now is 457.2 secs Computing kpt #: 228 total cpu time spent up to now is 459.2 secs Computing kpt #: 229 total cpu time spent up to now is 460.8 secs Computing kpt #: 230 total cpu time spent up to now is 462.9 secs Computing kpt #: 231 total cpu time spent up to now is 465.2 secs Computing kpt #: 232 total cpu time spent up to now is 466.9 secs Computing kpt #: 233 total cpu time spent up to now is 468.5 secs Computing kpt #: 234 total cpu time spent up to now is 472.0 secs Computing kpt #: 235 total cpu time spent up to now is 474.6 secs Computing kpt #: 236 total cpu time spent up to now is 475.9 secs Computing kpt #: 237 total cpu time spent up to now is 477.6 secs Computing kpt #: 238 total cpu time spent up to now is 479.1 secs Computing kpt #: 239 total cpu time spent up to now is 480.7 secs Computing kpt #: 240 total cpu time spent up to now is 482.1 secs Computing kpt #: 241 total cpu time spent up to now is 483.3 secs Computing kpt #: 242 total cpu time spent up to now is 484.6 secs Computing kpt #: 243 total cpu time spent up to now is 486.0 secs Computing kpt #: 244 total cpu time spent up to now is 488.2 secs Computing kpt #: 245 total cpu time spent up to now is 491.7 secs Computing kpt #: 246 total cpu time spent up to now is 493.4 secs Computing kpt #: 247 total cpu time spent up to now is 494.8 secs Computing kpt #: 248 total cpu time spent up to now is 496.2 secs Computing kpt #: 249 total cpu time spent up to now is 497.9 secs Computing kpt #: 250 total cpu time spent up to now is 499.4 secs Computing kpt #: 251 total cpu time spent up to now is 500.9 secs Computing kpt #: 252 total cpu time spent up to now is 502.6 secs Computing kpt #: 253 total cpu time spent up to now is 504.3 secs Computing kpt #: 254 total cpu time spent up to now is 505.8 secs Computing kpt #: 255 total cpu time spent up to now is 509.0 secs Computing kpt #: 256 total cpu time spent up to now is 512.6 secs Computing kpt #: 257 total cpu time spent up to now is 514.2 secs Computing kpt #: 258 total cpu time spent up to now is 515.7 secs Computing kpt #: 259 total cpu time spent up to now is 517.3 secs Computing kpt #: 260 total cpu time spent up to now is 518.9 secs Computing kpt #: 261 total cpu time spent up to now is 520.3 secs Computing kpt #: 262 total cpu time spent up to now is 521.8 secs Computing kpt #: 263 total cpu time spent up to now is 523.6 secs Computing kpt #: 264 total cpu time spent up to now is 525.2 secs Computing kpt #: 265 total cpu time spent up to now is 527.2 secs Computing kpt #: 266 total cpu time spent up to now is 531.3 secs Computing kpt #: 267 total cpu time spent up to now is 533.3 secs Computing kpt #: 268 total cpu time spent up to now is 534.8 secs Computing kpt #: 269 total cpu time spent up to now is 536.1 secs Computing kpt #: 270 total cpu time spent up to now is 537.6 secs Computing kpt #: 271 total cpu time spent up to now is 539.0 secs Computing kpt #: 272 total cpu time spent up to now is 540.4 secs Computing kpt #: 273 total cpu time spent up to now is 541.7 secs Computing kpt #: 274 total cpu time spent up to now is 542.9 secs Computing kpt #: 275 total cpu time spent up to now is 544.3 secs Computing kpt #: 276 total cpu time spent up to now is 545.6 secs Computing kpt #: 277 total cpu time spent up to now is 548.9 secs Computing kpt #: 278 total cpu time spent up to now is 551.4 secs Computing kpt #: 279 total cpu time spent up to now is 552.8 secs Computing kpt #: 280 total cpu time spent up to now is 554.5 secs Computing kpt #: 281 total cpu time spent up to now is 556.3 secs Computing kpt #: 282 total cpu time spent up to now is 557.9 secs Computing kpt #: 283 total cpu time spent up to now is 559.6 secs Computing kpt #: 284 total cpu time spent up to now is 561.5 secs Computing kpt #: 285 total cpu time spent up to now is 563.1 secs Computing kpt #: 286 total cpu time spent up to now is 564.9 secs Computing kpt #: 287 total cpu time spent up to now is 568.2 secs Computing kpt #: 288 total cpu time spent up to now is 570.8 secs Computing kpt #: 289 total cpu time spent up to now is 572.2 secs Computing kpt #: 290 total cpu time spent up to now is 573.7 secs Computing kpt #: 291 total cpu time spent up to now is 575.6 secs Computing kpt #: 292 total cpu time spent up to now is 577.0 secs Computing kpt #: 293 total cpu time spent up to now is 578.4 secs Computing kpt #: 294 total cpu time spent up to now is 579.7 secs Computing kpt #: 295 total cpu time spent up to now is 581.1 secs Computing kpt #: 296 total cpu time spent up to now is 582.5 secs Computing kpt #: 297 total cpu time spent up to now is 584.0 secs Computing kpt #: 298 total cpu time spent up to now is 585.9 secs Computing kpt #: 299 total cpu time spent up to now is 587.6 secs Computing kpt #: 300 total cpu time spent up to now is 589.3 secs Computing kpt #: 301 total cpu time spent up to now is 591.0 secs Computing kpt #: 302 total cpu time spent up to now is 592.7 secs Computing kpt #: 303 total cpu time spent up to now is 594.3 secs Computing kpt #: 304 total cpu time spent up to now is 596.0 secs Computing kpt #: 305 total cpu time spent up to now is 597.7 secs Computing kpt #: 306 total cpu time spent up to now is 599.4 secs Computing kpt #: 307 total cpu time spent up to now is 601.1 secs Computing kpt #: 308 total cpu time spent up to now is 602.9 secs Computing kpt #: 309 total cpu time spent up to now is 604.5 secs Computing kpt #: 310 total cpu time spent up to now is 606.0 secs Computing kpt #: 311 total cpu time spent up to now is 607.6 secs Computing kpt #: 312 total cpu time spent up to now is 609.1 secs Computing kpt #: 313 total cpu time spent up to now is 610.9 secs Computing kpt #: 314 total cpu time spent up to now is 612.9 secs Computing kpt #: 315 total cpu time spent up to now is 614.6 secs Computing kpt #: 316 total cpu time spent up to now is 616.3 secs Computing kpt #: 317 total cpu time spent up to now is 617.8 secs Computing kpt #: 318 total cpu time spent up to now is 619.7 secs Computing kpt #: 319 total cpu time spent up to now is 621.5 secs Computing kpt #: 320 total cpu time spent up to now is 623.0 secs Computing kpt #: 321 total cpu time spent up to now is 624.5 secs Computing kpt #: 322 total cpu time spent up to now is 626.3 secs Computing kpt #: 323 total cpu time spent up to now is 628.4 secs Computing kpt #: 324 total cpu time spent up to now is 630.2 secs Computing kpt #: 325 total cpu time spent up to now is 631.9 secs Computing kpt #: 326 total cpu time spent up to now is 633.4 secs Computing kpt #: 327 total cpu time spent up to now is 635.2 secs Computing kpt #: 328 total cpu time spent up to now is 636.9 secs Computing kpt #: 329 total cpu time spent up to now is 639.5 secs Computing kpt #: 330 total cpu time spent up to now is 641.2 secs Computing kpt #: 331 total cpu time spent up to now is 643.1 secs Computing kpt #: 332 total cpu time spent up to now is 645.3 secs Computing kpt #: 333 total cpu time spent up to now is 647.1 secs Computing kpt #: 334 total cpu time spent up to now is 649.3 secs Computing kpt #: 335 total cpu time spent up to now is 651.5 secs Computing kpt #: 336 total cpu time spent up to now is 653.6 secs Computing kpt #: 337 total cpu time spent up to now is 655.6 secs Computing kpt #: 338 total cpu time spent up to now is 658.1 secs Computing kpt #: 339 total cpu time spent up to now is 659.9 secs Computing kpt #: 340 total cpu time spent up to now is 661.6 secs Computing kpt #: 341 total cpu time spent up to now is 663.2 secs Computing kpt #: 342 total cpu time spent up to now is 665.2 secs Computing kpt #: 343 total cpu time spent up to now is 667.2 secs Computing kpt #: 344 total cpu time spent up to now is 668.8 secs Computing kpt #: 345 total cpu time spent up to now is 670.4 secs Computing kpt #: 346 total cpu time spent up to now is 672.1 secs Computing kpt #: 347 total cpu time spent up to now is 674.5 secs Computing kpt #: 348 total cpu time spent up to now is 676.1 secs Computing kpt #: 349 total cpu time spent up to now is 677.9 secs Computing kpt #: 350 total cpu time spent up to now is 679.6 secs Computing kpt #: 351 total cpu time spent up to now is 681.3 secs Computing kpt #: 352 total cpu time spent up to now is 682.9 secs Computing kpt #: 353 total cpu time spent up to now is 684.6 secs Computing kpt #: 354 total cpu time spent up to now is 686.3 secs Computing kpt #: 355 total cpu time spent up to now is 688.3 secs Computing kpt #: 356 total cpu time spent up to now is 690.2 secs Computing kpt #: 357 total cpu time spent up to now is 691.7 secs Computing kpt #: 358 total cpu time spent up to now is 693.3 secs Computing kpt #: 359 total cpu time spent up to now is 694.7 secs Computing kpt #: 360 total cpu time spent up to now is 696.2 secs Computing kpt #: 361 total cpu time spent up to now is 697.7 secs Computing kpt #: 362 total cpu time spent up to now is 699.2 secs Computing kpt #: 363 total cpu time spent up to now is 700.7 secs Computing kpt #: 364 total cpu time spent up to now is 701.9 secs Computing kpt #: 365 total cpu time spent up to now is 703.2 secs Computing kpt #: 366 total cpu time spent up to now is 704.5 secs Computing kpt #: 367 total cpu time spent up to now is 705.8 secs Computing kpt #: 368 total cpu time spent up to now is 707.2 secs Computing kpt #: 369 total cpu time spent up to now is 708.7 secs Computing kpt #: 370 total cpu time spent up to now is 710.1 secs Computing kpt #: 371 total cpu time spent up to now is 711.7 secs Computing kpt #: 372 total cpu time spent up to now is 713.4 secs Computing kpt #: 373 total cpu time spent up to now is 714.9 secs Computing kpt #: 374 total cpu time spent up to now is 716.6 secs Computing kpt #: 375 total cpu time spent up to now is 718.0 secs Computing kpt #: 376 total cpu time spent up to now is 719.3 secs Computing kpt #: 377 total cpu time spent up to now is 720.8 secs Computing kpt #: 378 total cpu time spent up to now is 722.3 secs Computing kpt #: 379 total cpu time spent up to now is 724.0 secs Computing kpt #: 380 total cpu time spent up to now is 725.5 secs Computing kpt #: 381 total cpu time spent up to now is 727.7 secs Computing kpt #: 382 total cpu time spent up to now is 730.8 secs Computing kpt #: 383 total cpu time spent up to now is 732.1 secs Computing kpt #: 384 total cpu time spent up to now is 733.6 secs Computing kpt #: 385 total cpu time spent up to now is 735.0 secs Computing kpt #: 386 total cpu time spent up to now is 736.5 secs Computing kpt #: 387 total cpu time spent up to now is 738.5 secs Computing kpt #: 388 total cpu time spent up to now is 740.5 secs Computing kpt #: 389 total cpu time spent up to now is 742.3 secs Computing kpt #: 390 total cpu time spent up to now is 744.2 secs Computing kpt #: 391 total cpu time spent up to now is 746.1 secs Computing kpt #: 392 total cpu time spent up to now is 747.8 secs Computing kpt #: 393 total cpu time spent up to now is 749.2 secs Computing kpt #: 394 total cpu time spent up to now is 750.7 secs Computing kpt #: 395 total cpu time spent up to now is 752.4 secs Computing kpt #: 396 total cpu time spent up to now is 754.6 secs Computing kpt #: 397 total cpu time spent up to now is 756.1 secs Computing kpt #: 398 total cpu time spent up to now is 757.8 secs Computing kpt #: 399 total cpu time spent up to now is 759.4 secs Computing kpt #: 400 total cpu time spent up to now is 761.4 secs Computing kpt #: 401 total cpu time spent up to now is 763.7 secs Computing kpt #: 402 total cpu time spent up to now is 765.9 secs Computing kpt #: 403 total cpu time spent up to now is 767.8 secs Computing kpt #: 404 total cpu time spent up to now is 769.4 secs Computing kpt #: 405 total cpu time spent up to now is 771.0 secs Computing kpt #: 406 total cpu time spent up to now is 772.6 secs Computing kpt #: 407 total cpu time spent up to now is 774.6 secs Computing kpt #: 408 total cpu time spent up to now is 776.3 secs Computing kpt #: 409 total cpu time spent up to now is 778.1 secs Computing kpt #: 410 total cpu time spent up to now is 779.8 secs Computing kpt #: 411 total cpu time spent up to now is 781.4 secs Computing kpt #: 412 total cpu time spent up to now is 782.9 secs Computing kpt #: 413 total cpu time spent up to now is 784.8 secs Computing kpt #: 414 total cpu time spent up to now is 786.4 secs ethr = 2.50E-11, avg # of iterations = 26.3 total cpu time spent up to now is 786.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3803 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5528 -14.5528 -14.4698 -14.4698 -14.4480 -14.4480 -14.4226 -14.4226 -0.8622 -0.8622 0.7121 0.7121 4.2677 4.2677 7.9000 7.9000 8.5940 8.5940 9.3984 9.3984 9.4229 9.4229 9.5295 9.5295 9.5380 9.5380 9.6475 9.6475 10.0225 10.0225 11.4229 11.4229 13.4682 13.4682 13.5340 13.5340 13.8504 13.8504 14.0561 14.0561 k = 0.0059 0.0235-0.0000 ( 3799 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5528 -14.5528 -14.4699 -14.4699 -14.4480 -14.4480 -14.4226 -14.4226 -0.8609 -0.8609 0.7128 0.7128 4.2694 4.2694 7.8915 7.8915 8.5942 8.5942 9.3788 9.3788 9.4007 9.4007 9.5459 9.5459 9.5523 9.5523 9.6544 9.6544 10.0272 10.0272 11.4276 11.4276 13.4685 13.4685 13.5325 13.5325 13.8432 13.8432 14.0562 14.0562 k = 0.0118 0.0470-0.0000 ( 3805 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2427 -16.2427 -16.1987 -16.1987 -14.5528 -14.5528 -14.4703 -14.4703 -14.4483 -14.4483 -14.4226 -14.4226 -0.8569 -0.8569 0.7151 0.7151 4.2744 4.2744 7.8659 7.8659 8.5948 8.5948 9.3320 9.3320 9.3593 9.3593 9.5689 9.5689 9.5817 9.5817 9.6781 9.6781 10.0411 10.0411 11.4413 11.4413 13.4693 13.4693 13.5279 13.5279 13.8225 13.8225 14.0558 14.0558 k = 0.0177 0.0705-0.0000 ( 3797 PWs) bands (ev): -36.9470 -36.9470 -36.9376 -36.9376 -16.2429 -16.2429 -16.1989 -16.1989 -14.5529 -14.5529 -14.4710 -14.4710 -14.4487 -14.4487 -14.4226 -14.4226 -0.8503 -0.8503 0.7188 0.7188 4.2828 4.2828 7.8235 7.8235 8.5957 8.5957 9.2715 9.2715 9.3174 9.3174 9.5859 9.5859 9.6081 9.6081 9.7185 9.7185 10.0629 10.0629 11.4638 11.4638 13.4695 13.4695 13.5198 13.5198 13.7915 13.7915 14.0533 14.0533 k = 0.0236 0.0941-0.0000 ( 3799 PWs) bands (ev): -36.9469 -36.9469 -36.9376 -36.9376 -16.2431 -16.2431 -16.1993 -16.1993 -14.5530 -14.5530 -14.4719 -14.4719 -14.4492 -14.4492 -14.4226 -14.4226 -0.8411 -0.8411 0.7241 0.7241 4.2946 4.2946 7.7649 7.7649 8.5969 8.5969 9.2027 9.2027 9.2808 9.2808 9.5957 9.5957 9.6326 9.6326 9.7665 9.7665 10.0909 10.0909 11.4944 11.4944 13.4647 13.4647 13.5101 13.5101 13.7549 13.7549 14.0462 14.0462 k = 0.0295 0.1176-0.0000 ( 3799 PWs) bands (ev): -36.9468 -36.9468 -36.9375 -36.9375 -16.2434 -16.2434 -16.1998 -16.1998 -14.5531 -14.5531 -14.4730 -14.4730 -14.4499 -14.4499 -14.4226 -14.4226 -0.8293 -0.8293 0.7308 0.7308 4.3097 4.3097 7.6910 7.6910 8.5981 8.5981 9.1275 9.1275 9.2519 9.2519 9.6022 9.6022 9.6557 9.6557 9.8151 9.8151 10.1232 10.1232 11.5324 11.5324 13.4452 13.4452 13.5054 13.5054 13.7187 13.7187 14.0304 14.0304 k = 0.0354 0.1411-0.0000 ( 3793 PWs) bands (ev): -36.9467 -36.9467 -36.9374 -36.9374 -16.2437 -16.2437 -16.2003 -16.2003 -14.5532 -14.5532 -14.4744 -14.4744 -14.4508 -14.4508 -14.4226 -14.4226 -0.8150 -0.8150 0.7391 0.7391 4.3281 4.3281 7.6031 7.6031 8.5994 8.5994 9.0474 9.0474 9.2315 9.2315 9.6079 9.6079 9.6777 9.6777 9.8610 9.8610 10.1583 10.1583 11.5766 11.5766 13.4052 13.4052 13.5083 13.5083 13.6881 13.6881 14.0018 14.0018 k = 0.0413 0.1646-0.0000 ( 3797 PWs) bands (ev): -36.9465 -36.9465 -36.9373 -36.9373 -16.2442 -16.2442 -16.2010 -16.2010 -14.5534 -14.5534 -14.4761 -14.4761 -14.4517 -14.4517 -14.4226 -14.4226 -0.7982 -0.7982 0.7490 0.7490 4.3498 4.3498 7.5028 7.5028 8.6005 8.6005 8.9631 8.9631 9.2198 9.2198 9.6139 9.6139 9.6991 9.6991 9.9026 9.9026 10.1949 10.1949 11.6259 11.6259 13.3481 13.3481 13.5155 13.5155 13.6652 13.6652 13.9570 13.9570 k = 0.0472 0.1881-0.0000 ( 3793 PWs) bands (ev): -36.9464 -36.9464 -36.9371 -36.9371 -16.2446 -16.2446 -16.2018 -16.2018 -14.5537 -14.5537 -14.4780 -14.4780 -14.4528 -14.4528 -14.4225 -14.4225 -0.7789 -0.7789 0.7603 0.7603 4.3747 4.3747 7.3918 7.3918 8.6012 8.6012 8.8754 8.8754 9.2163 9.2163 9.6207 9.6207 9.7206 9.7206 9.9393 9.9393 10.2321 10.2321 11.6791 11.6791 13.2784 13.2784 13.5252 13.5252 13.6491 13.6491 13.8944 13.8944 k = 0.0532 0.2116-0.0000 ( 3797 PWs) bands (ev): -36.9462 -36.9462 -36.9370 -36.9370 -16.2452 -16.2452 -16.2026 -16.2026 -14.5540 -14.5540 -14.4801 -14.4801 -14.4539 -14.4539 -14.4224 -14.4224 -0.7572 -0.7572 0.7733 0.7733 4.4028 4.4028 7.2717 7.2717 8.6010 8.6010 8.7851 8.7851 9.2205 9.2205 9.6289 9.6289 9.7423 9.7423 9.9709 9.9709 10.2690 10.2690 11.7352 11.7352 13.2001 13.2001 13.5365 13.5365 13.6372 13.6372 13.8156 13.8156 k = 0.0591 0.2351-0.0000 ( 3789 PWs) bands (ev): -36.9460 -36.9460 -36.9368 -36.9368 -16.2457 -16.2457 -16.2036 -16.2036 -14.5544 -14.5544 -14.4825 -14.4825 -14.4551 -14.4551 -14.4223 -14.4223 -0.7332 -0.7332 0.7878 0.7878 4.4341 4.4341 7.1441 7.1441 8.5988 8.5988 8.6940 8.6940 9.2315 9.2315 9.6388 9.6388 9.7647 9.7647 9.9974 9.9974 10.3053 10.3053 11.7929 11.7929 13.1163 13.1163 13.5485 13.5485 13.6266 13.6266 13.7254 13.7254 k = 0.0650 0.2587-0.0000 ( 3793 PWs) bands (ev): -36.9458 -36.9458 -36.9366 -36.9366 -16.2464 -16.2464 -16.2046 -16.2046 -14.5548 -14.5548 -14.4851 -14.4851 -14.4564 -14.4564 -14.4221 -14.4221 -0.7071 -0.7071 0.8039 0.8039 4.4683 4.4683 7.0105 7.0105 8.5779 8.5779 8.6187 8.6187 9.2488 9.2488 9.6506 9.6506 9.7878 9.7878 10.0188 10.0188 10.3405 10.3405 11.8515 11.8515 13.0293 13.0293 13.5549 13.5549 13.6008 13.6008 13.6482 13.6482 k = 0.0709 0.2822-0.0000 ( 3793 PWs) bands (ev): -36.9456 -36.9456 -36.9364 -36.9364 -16.2471 -16.2471 -16.2057 -16.2057 -14.5553 -14.5553 -14.4878 -14.4878 -14.4577 -14.4577 -14.4219 -14.4219 -0.6787 -0.6787 0.8218 0.8218 4.5056 4.5056 6.8721 6.8721 8.4936 8.4936 8.6044 8.6044 9.2717 9.2717 9.6647 9.6647 9.8115 9.8115 10.0352 10.0352 10.3744 10.3744 11.9102 11.9102 12.9406 12.9406 13.4865 13.4865 13.5838 13.5838 13.6316 13.6316 k = 0.0768 0.3057-0.0000 ( 3803 PWs) bands (ev): -36.9455 -36.9455 -36.9362 -36.9362 -16.2478 -16.2478 -16.2069 -16.2069 -14.5559 -14.5559 -14.4908 -14.4908 -14.4590 -14.4590 -14.4217 -14.4217 -0.6484 -0.6484 0.8412 0.8412 4.5457 4.5457 6.7300 6.7300 8.3973 8.3973 8.5999 8.5999 9.2995 9.2995 9.6814 9.6814 9.8360 9.8360 10.0469 10.0469 10.4069 10.4069 11.9686 11.9686 12.8512 12.8512 13.3733 13.3733 13.5900 13.5900 13.6335 13.6335 k = 0.0827 0.3292-0.0000 ( 3797 PWs) bands (ev): -36.9452 -36.9452 -36.9360 -36.9360 -16.2485 -16.2485 -16.2082 -16.2082 -14.5567 -14.5567 -14.4940 -14.4940 -14.4603 -14.4603 -14.4214 -14.4214 -0.6162 -0.6162 0.8625 0.8625 4.5887 4.5887 6.5852 6.5852 8.2992 8.2992 8.5954 8.5954 9.3316 9.3316 9.7008 9.7008 9.8609 9.8609 10.0539 10.0539 10.4380 10.4380 12.0262 12.0262 12.7620 12.7620 13.2541 13.2541 13.5906 13.5906 13.6456 13.6456 k = 0.0886 0.3527-0.0000 ( 3805 PWs) bands (ev): -36.9450 -36.9450 -36.9358 -36.9358 -16.2494 -16.2494 -16.2095 -16.2095 -14.5575 -14.5575 -14.4973 -14.4973 -14.4616 -14.4616 -14.4211 -14.4211 -0.5822 -0.5822 0.8855 0.8855 4.6342 4.6342 6.4384 6.4384 8.2004 8.2004 8.5899 8.5899 9.3677 9.3677 9.7232 9.7232 9.8861 9.8861 10.0562 10.0562 10.4677 10.4677 12.0830 12.0830 12.6735 12.6735 13.1334 13.1334 13.5862 13.5862 13.6644 13.6644 k = 0.0945 0.3762-0.0000 ( 3809 PWs) bands (ev): -36.9447 -36.9447 -36.9355 -36.9355 -16.2502 -16.2502 -16.2109 -16.2109 -14.5584 -14.5584 -14.5007 -14.5007 -14.4629 -14.4629 -14.4208 -14.4208 -0.5466 -0.5466 0.9104 0.9104 4.6822 4.6822 6.2904 6.2904 8.1014 8.1014 8.5834 8.5834 9.4073 9.4073 9.7485 9.7485 9.9112 9.9112 10.0539 10.0539 10.4959 10.4959 12.1390 12.1390 12.5861 12.5861 13.0133 13.0133 13.5790 13.5790 13.6868 13.6868 k = 0.1004 0.3997-0.0000 ( 3803 PWs) bands (ev): -36.9445 -36.9445 -36.9353 -36.9353 -16.2511 -16.2511 -16.2123 -16.2123 -14.5594 -14.5594 -14.5042 -14.5042 -14.4641 -14.4641 -14.4205 -14.4205 -0.5095 -0.5095 0.9372 0.9372 4.7324 4.7324 6.1420 6.1420 8.0026 8.0026 8.5756 8.5756 9.4498 9.4498 9.7770 9.7770 9.9358 9.9358 10.0470 10.0470 10.5231 10.5231 12.1943 12.1943 12.5004 12.5004 12.8954 12.8954 13.5695 13.5695 13.7116 13.7116 k = 0.1063 0.4233-0.0000 ( 3801 PWs) bands (ev): -36.9442 -36.9442 -36.9350 -36.9350 -16.2520 -16.2520 -16.2138 -16.2138 -14.5605 -14.5605 -14.5078 -14.5078 -14.4652 -14.4652 -14.4201 -14.4201 -0.4712 -0.4712 0.9661 0.9661 4.7844 4.7844 5.9938 5.9938 7.9043 7.9043 8.5667 8.5667 9.4948 9.4948 9.8086 9.8086 9.9593 9.9593 10.0358 10.0358 10.5494 10.5494 12.2487 12.2487 12.4168 12.4168 12.7808 12.7808 13.5579 13.5579 13.7381 13.7381 k = 0.1122 0.4468-0.0000 ( 3801 PWs) bands (ev): -36.9439 -36.9439 -36.9347 -36.9347 -16.2529 -16.2529 -16.2153 -16.2153 -14.5617 -14.5617 -14.5115 -14.5115 -14.4662 -14.4662 -14.4197 -14.4197 -0.4318 -0.4318 0.9970 0.9970 4.8375 4.8375 5.8469 5.8469 7.8067 7.8067 8.5566 8.5566 9.5418 9.5418 9.8430 9.8430 9.9802 9.9802 10.0214 10.0214 10.5753 10.5753 12.2979 12.2979 12.3402 12.3402 12.6709 12.6709 13.5441 13.5441 13.7658 13.7658 k = 0.1181 0.4703-0.0000 ( 3801 PWs) bands (ev): -36.9437 -36.9437 -36.9345 -36.9345 -16.2538 -16.2538 -16.2168 -16.2168 -14.5630 -14.5630 -14.5153 -14.5153 -14.4671 -14.4671 -14.4193 -14.4193 -0.3915 -0.3915 1.0302 1.0302 4.8905 4.8905 5.7026 5.7026 7.7103 7.7103 8.5456 8.5456 9.5900 9.5900 9.8794 9.8794 9.9894 9.9894 10.0135 10.0135 10.6012 10.6012 12.2503 12.2503 12.3626 12.3626 12.5667 12.5667 13.5279 13.5279 13.7946 13.7946 k = 0.1240 0.4938-0.0000 ( 3797 PWs) bands (ev): -36.9434 -36.9434 -36.9342 -36.9342 -16.2547 -16.2547 -16.2184 -16.2184 -14.5645 -14.5645 -14.5190 -14.5190 -14.4680 -14.4680 -14.4189 -14.4189 -0.3506 -0.3506 1.0657 1.0657 4.9407 4.9407 5.5640 5.5640 7.6152 7.6152 8.5336 8.5336 9.6384 9.6384 9.9139 9.9139 9.9764 9.9764 10.0261 10.0261 10.6278 10.6278 12.1736 12.1736 12.4138 12.4138 12.4721 12.4721 13.5090 13.5090 13.8240 13.8240 k = 0.1299 0.5173-0.0000 ( 3789 PWs) bands (ev): -36.9431 -36.9431 -36.9339 -36.9339 -16.2557 -16.2557 -16.2199 -16.2199 -14.5659 -14.5659 -14.5228 -14.5228 -14.4687 -14.4687 -14.4185 -14.4185 -0.3094 -0.3094 1.1037 1.1037 4.9814 4.9814 5.4378 5.4378 7.5217 7.5217 8.5208 8.5208 9.6848 9.6848 9.9238 9.9238 9.9823 9.9823 10.0419 10.0419 10.6557 10.6557 12.0984 12.0984 12.3731 12.3731 12.4785 12.4785 13.4871 13.4871 13.8537 13.8537 k = 0.1358 0.5408-0.0000 ( 3789 PWs) bands (ev): -36.9428 -36.9428 -36.9336 -36.9336 -16.2566 -16.2566 -16.2215 -16.2215 -14.5675 -14.5675 -14.5266 -14.5266 -14.4693 -14.4693 -14.4181 -14.4181 -0.2680 -0.2680 1.1443 1.1443 4.9941 4.9941 5.3425 5.3425 7.4300 7.4300 8.5075 8.5075 9.7237 9.7237 9.9068 9.9068 10.0139 10.0139 10.0608 10.0608 10.6854 10.6854 12.0254 12.0254 12.2912 12.2912 12.5356 12.5356 13.4620 13.4620 13.8828 13.8828 k = 0.1417 0.5643-0.0000 ( 3793 PWs) bands (ev): -36.9425 -36.9425 -36.9334 -36.9334 -16.2575 -16.2575 -16.2231 -16.2231 -14.5691 -14.5691 -14.5303 -14.5303 -14.4698 -14.4698 -14.4176 -14.4176 -0.2267 -0.2267 1.1877 1.1877 4.9486 4.9486 5.3085 5.3085 7.3404 7.3404 8.4936 8.4936 9.7418 9.7418 9.8994 9.8994 10.0354 10.0354 10.0944 10.0944 10.7176 10.7176 11.9549 11.9549 12.2166 12.2166 12.5955 12.5955 13.4334 13.4334 13.9102 13.9102 k = 0.1477 0.5879-0.0000 ( 3805 PWs) bands (ev): -36.9423 -36.9423 -36.9331 -36.9331 -16.2585 -16.2585 -16.2246 -16.2246 -14.5708 -14.5708 -14.5340 -14.5340 -14.4702 -14.4702 -14.4172 -14.4172 -0.1859 -0.1859 1.2340 1.2340 4.8486 4.8486 5.3321 5.3321 7.2530 7.2530 8.4795 8.4795 9.7254 9.7254 9.9197 9.9197 10.0415 10.0415 10.1429 10.1429 10.7524 10.7524 11.8870 11.8870 12.1508 12.1508 12.6578 12.6578 13.4012 13.4012 13.9314 13.9314 k = 0.1536 0.6114-0.0000 ( 3805 PWs) bands (ev): -36.9420 -36.9420 -36.9329 -36.9329 -16.2594 -16.2594 -16.2262 -16.2262 -14.5724 -14.5724 -14.5376 -14.5376 -14.4706 -14.4706 -14.4168 -14.4168 -0.1457 -0.1457 1.2833 1.2833 4.7240 4.7240 5.3833 5.3833 7.1681 7.1681 8.4652 8.4652 9.6835 9.6835 9.9591 9.9591 10.0396 10.0396 10.1984 10.1984 10.7901 10.7901 11.8216 11.8216 12.0942 12.0942 12.7223 12.7223 13.3652 13.3652 13.9365 13.9365 k = 0.1595 0.6349-0.0000 ( 3805 PWs) bands (ev): -36.9417 -36.9417 -36.9327 -36.9327 -16.2602 -16.2602 -16.2277 -16.2277 -14.5741 -14.5741 -14.5410 -14.5410 -14.4708 -14.4708 -14.4164 -14.4164 -0.1066 -0.1066 1.3358 1.3358 4.5905 4.5905 5.4464 5.4464 7.0860 7.0860 8.4509 8.4509 9.6282 9.6282 10.0040 10.0040 10.0336 10.0336 10.2581 10.2581 10.8308 10.8308 11.7590 11.7590 12.0471 12.0471 12.7894 12.7894 13.3252 13.3252 13.9225 13.9225 k = 0.1654 0.6584-0.0000 ( 3806 PWs) bands (ev): -36.9415 -36.9415 -36.9325 -36.9325 -16.2611 -16.2611 -16.2292 -16.2292 -14.5758 -14.5758 -14.5444 -14.5444 -14.4710 -14.4710 -14.4161 -14.4161 -0.0687 -0.0687 1.3917 1.3917 4.4539 4.4539 5.5155 5.5155 7.0067 7.0067 8.4367 8.4367 9.5650 9.5650 10.0148 10.0148 10.0591 10.0591 10.3210 10.3210 10.8741 10.8741 11.6989 11.6989 12.0097 12.0097 12.8591 12.8591 13.2814 13.2814 13.8926 13.8926 k = 0.1713 0.6819-0.0000 ( 3806 PWs) bands (ev): -36.9413 -36.9413 -36.9322 -36.9322 -16.2619 -16.2619 -16.2306 -16.2306 -14.5774 -14.5774 -14.5477 -14.5477 -14.4711 -14.4711 -14.4157 -14.4157 -0.0323 -0.0323 1.4511 1.4511 4.3166 4.3166 5.5881 5.5881 6.9305 6.9305 8.4228 8.4228 9.4963 9.4963 9.9984 9.9984 10.1073 10.1073 10.3868 10.3868 10.9198 10.9198 11.6416 11.6416 11.9820 11.9820 12.9315 12.9315 13.2336 13.2336 13.8485 13.8485 k = 0.1772 0.7054-0.0000 ( 3812 PWs) bands (ev): -36.9410 -36.9410 -36.9321 -36.9321 -16.2627 -16.2627 -16.2319 -16.2319 -14.5789 -14.5789 -14.5508 -14.5508 -14.4711 -14.4711 -14.4154 -14.4154 0.0023 0.0023 1.5141 1.5141 4.1797 4.1797 5.6630 5.6630 6.8576 6.8576 8.4094 8.4094 9.4235 9.4235 9.9771 9.9771 10.1554 10.1554 10.4552 10.4552 10.9674 10.9674 11.5868 11.5868 11.9638 11.9638 13.0068 13.0068 13.1821 13.1821 13.7934 13.7934 k = 0.1831 0.7289-0.0000 ( 3816 PWs) bands (ev): -36.9408 -36.9408 -36.9319 -36.9319 -16.2634 -16.2634 -16.2332 -16.2332 -14.5804 -14.5804 -14.5537 -14.5537 -14.4711 -14.4711 -14.4151 -14.4151 0.0349 0.0349 1.5807 1.5807 4.0437 4.0437 5.7393 5.7393 6.7881 6.7881 8.3965 8.3965 9.3477 9.3477 9.9523 9.9523 10.2021 10.2021 10.5259 10.5259 11.0166 11.0166 11.5346 11.5346 11.9549 11.9549 13.0846 13.0846 13.1272 13.1272 13.7313 13.7313 k = 0.1890 0.7525-0.0000 ( 3808 PWs) bands (ev): -36.9406 -36.9406 -36.9316 -36.9316 -16.2641 -16.2641 -16.2345 -16.2345 -14.5818 -14.5818 -14.5564 -14.5564 -14.4710 -14.4710 -14.4148 -14.4148 0.0653 0.0653 1.6512 1.6512 3.9091 3.9091 5.8163 5.8163 6.7222 6.7222 8.3843 8.3843 9.2700 9.2700 9.9244 9.9244 10.2468 10.2468 10.5989 10.5989 11.0668 11.0668 11.4849 11.4849 11.9547 11.9547 13.0684 13.0684 13.1656 13.1656 13.6658 13.6658 k = 0.1949 0.7760-0.0000 ( 3800 PWs) bands (ev): -36.9404 -36.9404 -36.9314 -36.9314 -16.2647 -16.2647 -16.2356 -16.2356 -14.5831 -14.5831 -14.5590 -14.5590 -14.4709 -14.4709 -14.4146 -14.4146 0.0933 0.0933 1.7254 1.7254 3.7759 3.7759 5.8936 5.8936 6.6602 6.6602 8.3728 8.3728 9.1915 9.1915 9.8940 9.8940 10.2891 10.2891 10.6739 10.6739 11.1172 11.1172 11.4376 11.4376 11.9629 11.9629 13.0072 13.0072 13.2483 13.2483 13.6003 13.6003 k = 0.2008 0.7995-0.0000 ( 3792 PWs) bands (ev): -36.9402 -36.9402 -36.9313 -36.9313 -16.2653 -16.2653 -16.2367 -16.2367 -14.5843 -14.5843 -14.5613 -14.5613 -14.4708 -14.4708 -14.4144 -14.4144 0.1188 0.1188 1.8034 1.8034 3.6445 3.6445 5.9705 5.9705 6.6021 6.6021 8.3621 8.3621 9.1130 9.1130 9.8615 9.8615 10.3292 10.3292 10.7506 10.7506 11.1673 11.1673 11.3927 11.3927 11.9785 11.9785 12.9435 12.9435 13.3312 13.3312 13.5387 13.5387 k = 0.2067 0.8230-0.0000 ( 3788 PWs) bands (ev): -36.9400 -36.9400 -36.9311 -36.9311 -16.2658 -16.2658 -16.2376 -16.2376 -14.5854 -14.5854 -14.5635 -14.5635 -14.4706 -14.4706 -14.4142 -14.4142 0.1416 0.1416 1.8852 1.8852 3.5150 3.5150 6.0464 6.0464 6.5481 6.5481 8.3524 8.3524 9.0357 9.0357 9.8272 9.8272 10.3669 10.3669 10.8289 10.8289 11.2161 11.2161 11.3501 11.3501 12.0009 12.0009 12.8779 12.8779 13.3992 13.3992 13.4979 13.4979 k = 0.2126 0.8465-0.0000 ( 3788 PWs) bands (ev): -36.9399 -36.9399 -36.9310 -36.9310 -16.2662 -16.2662 -16.2385 -16.2385 -14.5863 -14.5863 -14.5654 -14.5654 -14.4705 -14.4705 -14.4141 -14.4141 0.1617 0.1617 1.9709 1.9709 3.3873 3.3873 6.1206 6.1206 6.4984 6.4984 8.3436 8.3436 8.9607 8.9607 9.7914 9.7914 10.4025 10.4025 10.9084 10.9084 11.2620 11.2620 11.3105 11.3105 12.0291 12.0291 12.8108 12.8108 13.3890 13.3890 13.5424 13.5424 k = 0.2185 0.8700-0.0000 ( 3788 PWs) bands (ev): -36.9398 -36.9398 -36.9309 -36.9309 -16.2666 -16.2666 -16.2393 -16.2393 -14.5871 -14.5871 -14.5670 -14.5670 -14.4703 -14.4703 -14.4140 -14.4140 0.1789 0.1789 2.0602 2.0602 3.2617 3.2617 6.1923 6.1923 6.4530 6.4530 8.3359 8.3359 8.8890 8.8890 9.7545 9.7545 10.4362 10.4362 10.9890 10.9890 11.2669 11.2669 11.3108 11.3108 12.0619 12.0619 12.7429 12.7429 13.3438 13.3438 13.6304 13.6304 k = 0.2244 0.8935-0.0000 ( 3788 PWs) bands (ev): -36.9397 -36.9397 -36.9308 -36.9308 -16.2668 -16.2668 -16.2399 -16.2399 -14.5878 -14.5878 -14.5684 -14.5684 -14.4702 -14.4702 -14.4139 -14.4139 0.1933 0.1933 2.1532 2.1532 3.1382 3.1382 6.2606 6.2606 6.4121 6.4121 8.3292 8.3292 8.8219 8.8219 9.7167 9.7167 10.4683 10.4683 11.0701 11.0701 11.2309 11.2309 11.3498 11.3498 12.0984 12.0984 12.6749 12.6749 13.3001 13.3001 13.7262 13.7262 k = 0.2303 0.9171-0.0000 ( 3792 PWs) bands (ev): -36.9396 -36.9396 -36.9307 -36.9307 -16.2671 -16.2671 -16.2405 -16.2405 -14.5883 -14.5883 -14.5696 -14.5696 -14.4700 -14.4700 -14.4139 -14.4139 0.2048 0.2048 2.2499 2.2499 3.0168 3.0168 6.3243 6.3243 6.3759 6.3759 8.3237 8.3237 8.7606 8.7606 9.6781 9.6781 10.4992 10.4992 11.1499 11.1499 11.1967 11.1967 11.3853 11.3853 12.1372 12.1372 12.6074 12.6074 13.2633 13.2633 13.8246 13.8246 k = 0.2362 0.9406-0.0000 ( 3798 PWs) bands (ev): -36.9396 -36.9396 -36.9307 -36.9307 -16.2672 -16.2672 -16.2409 -16.2409 -14.5886 -14.5886 -14.5704 -14.5704 -14.4699 -14.4699 -14.4140 -14.4140 0.2135 0.2135 2.3500 2.3500 2.8977 2.8977 6.3439 6.3439 6.3827 6.3827 8.3194 8.3194 8.7066 8.7066 9.6391 9.6391 10.5291 10.5291 11.1571 11.1571 11.2357 11.2357 11.4154 11.4154 12.1772 12.1772 12.5411 12.5411 13.2352 13.2352 13.9197 13.9197 k = 0.2421 0.9641-0.0000 ( 3800 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2672 -16.2672 -16.2412 -16.2412 -14.5887 -14.5887 -14.5710 -14.5710 -14.4697 -14.4697 -14.4141 -14.4141 0.2192 0.2192 2.4536 2.4536 2.7807 2.7807 6.3171 6.3171 6.4340 6.4340 8.3162 8.3162 8.6611 8.6611 9.5998 9.5998 10.5585 10.5585 11.1231 11.1231 11.3154 11.3154 11.4396 11.4396 12.2172 12.2172 12.4767 12.4767 13.2171 13.2171 13.9708 13.9708 k = 0.2481 0.9876-0.0000 ( 3808 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2672 -16.2672 -16.2414 -16.2414 -14.5887 -14.5887 -14.5714 -14.5714 -14.4696 -14.4696 -14.4142 -14.4142 0.2222 0.2222 2.5605 2.5605 2.6660 2.6660 6.2950 6.2950 6.4772 6.4772 8.3142 8.3142 8.6256 8.6256 9.5603 9.5603 10.5877 10.5877 11.0886 11.0886 11.3917 11.3917 11.4597 11.4597 12.2560 12.2560 12.4149 12.4149 13.2097 13.2097 13.9657 13.9657 k = 0.2540 1.0111-0.0000 ( 3812 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2671 -16.2671 -16.2415 -16.2415 -14.5886 -14.5886 -14.5714 -14.5714 -14.4695 -14.4695 -14.4144 -14.4144 0.2224 0.2224 2.5536 2.5536 2.6706 2.6706 6.2778 6.2778 6.5111 6.5111 8.3135 8.3135 8.6011 8.6011 9.5207 9.5207 10.6169 10.6169 11.0539 11.0539 11.4429 11.4429 11.4961 11.4961 12.2923 12.2923 12.3565 12.3565 13.2134 13.2134 13.9531 13.9531 k = 0.2599 1.0346-0.0000 ( 3812 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2669 -16.2669 -16.2414 -16.2414 -14.5882 -14.5882 -14.5712 -14.5712 -14.4694 -14.4694 -14.4146 -14.4146 0.2199 0.2199 2.4436 2.4436 2.7838 2.7838 6.2653 6.2653 6.5349 6.5349 8.3142 8.3142 8.5887 8.5887 9.4813 9.4813 10.6465 10.6465 11.0184 11.0184 11.4515 11.4515 11.5656 11.5656 12.3013 12.3013 12.3261 12.3261 13.2281 13.2281 13.9413 13.9413 k = 0.2658 1.0581-0.0000 ( 3812 PWs) bands (ev): -36.9396 -36.9396 -36.9308 -36.9308 -16.2667 -16.2667 -16.2412 -16.2412 -14.5878 -14.5878 -14.5707 -14.5707 -14.4693 -14.4693 -14.4148 -14.4148 0.2147 0.2147 2.3359 2.3359 2.9000 2.9000 6.2577 6.2577 6.5478 6.5478 8.3161 8.3161 8.5889 8.5889 9.4420 9.4420 10.6765 10.6765 10.9820 10.9820 11.4453 11.4453 11.6401 11.6401 12.2520 12.2520 12.3545 12.3545 13.2533 13.2533 13.9323 13.9323 k = 0.2658 1.0581-0.0000 ( 3812 PWs) bands (ev): -36.9396 -36.9396 -36.9308 -36.9308 -16.2667 -16.2667 -16.2412 -16.2412 -14.5878 -14.5878 -14.5707 -14.5707 -14.4693 -14.4693 -14.4148 -14.4148 0.2147 0.2147 2.3359 2.3359 2.9000 2.9000 6.2577 6.2577 6.5478 6.5478 8.3161 8.3161 8.5889 8.5889 9.4420 9.4420 10.6765 10.6765 10.9820 10.9820 11.4453 11.4453 11.6401 11.6401 12.2520 12.2520 12.3545 12.3545 13.2533 13.2533 13.9323 13.9323 k = 0.2416 1.0581-0.0000 ( 3810 PWs) bands (ev): -36.9396 -36.9396 -36.9308 -36.9308 -16.2668 -16.2668 -16.2413 -16.2413 -14.5879 -14.5879 -14.5708 -14.5708 -14.4694 -14.4694 -14.4148 -14.4148 0.2162 0.2162 2.3617 2.3617 2.8718 2.8718 6.2545 6.2545 6.5515 6.5515 8.3155 8.3155 8.5816 8.5816 9.4598 9.4598 10.6659 10.6659 10.9898 10.9898 11.4479 11.4479 11.6264 11.6264 12.2576 12.2576 12.3484 12.3484 13.2421 13.2421 13.9416 13.9416 k = 0.2174 1.0581-0.0000 ( 3806 PWs) bands (ev): -36.9396 -36.9396 -36.9307 -36.9307 -16.2668 -16.2668 -16.2413 -16.2413 -14.5880 -14.5880 -14.5710 -14.5710 -14.4694 -14.4694 -14.4147 -14.4147 0.2175 0.2175 2.3872 2.3872 2.8443 2.8443 6.2434 6.2434 6.5652 6.5652 8.3148 8.3148 8.5637 8.5637 9.4932 9.4932 10.6487 10.6487 10.9948 10.9948 11.4508 11.4508 11.6215 11.6215 12.2517 12.2517 12.3432 12.3432 13.2233 13.2233 13.9658 13.9658 k = 0.1933 1.0581-0.0000 ( 3802 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2669 -16.2669 -16.2414 -16.2414 -14.5881 -14.5881 -14.5711 -14.5711 -14.4694 -14.4694 -14.4146 -14.4146 0.2186 0.2186 2.4125 2.4125 2.8175 2.8175 6.2268 6.2268 6.5864 6.5864 8.3139 8.3139 8.5376 8.5376 9.5397 9.5397 10.6251 10.6251 10.9969 10.9969 11.4536 11.4536 11.6253 11.6253 12.2351 12.2351 12.3393 12.3393 13.1982 13.1982 14.0041 14.0041 k = 0.1691 1.0581-0.0000 ( 3804 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2670 -16.2670 -16.2414 -16.2414 -14.5883 -14.5883 -14.5712 -14.5712 -14.4694 -14.4694 -14.4145 -14.4145 0.2196 0.2196 2.4374 2.4374 2.7915 2.7915 6.2076 6.2076 6.6121 6.6121 8.3130 8.3130 8.5063 8.5063 9.5959 9.5959 10.5955 10.5955 10.9966 10.9966 11.4565 11.4565 11.6376 11.6376 12.2089 12.2089 12.3369 12.3369 13.1686 13.1686 14.0552 14.0552 k = 0.1450 1.0581-0.0000 ( 3794 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2670 -16.2670 -16.2414 -16.2414 -14.5884 -14.5884 -14.5712 -14.5712 -14.4695 -14.4695 -14.4145 -14.4145 0.2204 0.2204 2.4619 2.4619 2.7662 2.7662 6.1879 6.1879 6.6396 6.6396 8.3117 8.3117 8.4729 8.4729 9.6588 9.6588 10.5604 10.5604 10.9943 10.9943 11.4592 11.4592 11.6578 11.6578 12.1749 12.1749 12.3359 12.3359 13.1368 13.1368 14.1171 14.1171 k = 0.1208 1.0581-0.0000 ( 3796 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2671 -16.2671 -16.2414 -16.2414 -14.5885 -14.5885 -14.5713 -14.5713 -14.4695 -14.4695 -14.4144 -14.4144 0.2211 0.2211 2.4858 2.4858 2.7417 2.7417 6.1695 6.1695 6.6666 6.6666 8.3099 8.3099 8.4403 8.4403 9.7251 9.7251 10.5207 10.5207 10.9907 10.9907 11.4615 11.4615 11.6850 11.6850 12.1347 12.1347 12.3361 12.3361 13.1053 13.1053 14.1873 14.1873 k = 0.0966 1.0581-0.0000 ( 3798 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2671 -16.2671 -16.2414 -16.2414 -14.5886 -14.5886 -14.5713 -14.5713 -14.4695 -14.4695 -14.4143 -14.4143 0.2216 0.2216 2.5090 2.5090 2.7182 2.7182 6.1532 6.1532 6.6915 6.6915 8.3073 8.3073 8.4112 8.4112 9.7918 9.7918 10.4778 10.4778 10.9866 10.9866 11.4635 11.4635 11.7183 11.7183 12.0900 12.0900 12.3369 12.3369 13.0764 13.0764 14.2626 14.2626 k = 0.0725 1.0581-0.0000 ( 3798 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2672 -16.2672 -16.2414 -16.2414 -14.5886 -14.5886 -14.5714 -14.5714 -14.4695 -14.4695 -14.4143 -14.4143 0.2220 0.2220 2.5312 2.5312 2.6958 2.6958 6.1400 6.1400 6.7127 6.7127 8.3038 8.3038 8.3878 8.3878 9.8553 9.8553 10.4341 10.4341 10.9827 10.9827 11.4650 11.4650 11.7567 11.7567 12.0423 12.0423 12.3382 12.3382 13.0519 13.0519 14.3385 14.3385 k = 0.0483 1.0581-0.0000 ( 3800 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2672 -16.2672 -16.2414 -16.2414 -14.5887 -14.5887 -14.5714 -14.5714 -14.4695 -14.4695 -14.4143 -14.4143 0.2223 0.2223 2.5515 2.5515 2.6754 2.6754 6.1302 6.1302 6.7289 6.7289 8.2997 8.2997 8.3715 8.3715 9.9106 9.9106 10.3934 10.3934 10.9795 10.9795 11.4660 11.4660 11.7992 11.7992 11.9929 11.9929 12.3394 12.3394 13.0333 13.0333 14.4065 14.4065 k = 0.0242 1.0581-0.0000 ( 3793 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2672 -16.2672 -16.2414 -16.2414 -14.5887 -14.5887 -14.5714 -14.5714 -14.4696 -14.4696 -14.4142 -14.4142 0.2225 0.2225 2.5677 2.5677 2.6592 2.6592 6.1242 6.1242 6.7390 6.7390 8.2960 8.2960 8.3623 8.3623 9.9504 9.9504 10.3627 10.3627 10.9774 10.9774 11.4667 11.4667 11.8449 11.8449 11.9429 11.9429 12.3402 12.3402 13.0217 13.0217 14.4336 14.4336 k = 0.0000 1.0581-0.0000 ( 3796 PWs) bands (ev): -36.9395 -36.9395 -36.9306 -36.9306 -16.2672 -16.2672 -16.2414 -16.2414 -14.5887 -14.5887 -14.5714 -14.5714 -14.4696 -14.4696 -14.4142 -14.4142 0.2226 0.2226 2.5745 2.5745 2.6523 2.6523 6.1222 6.1222 6.7425 6.7425 8.2945 8.2945 8.3595 8.3595 9.9653 9.9653 10.3508 10.3508 10.9767 10.9767 11.4669 11.4669 11.8890 11.8890 11.8974 11.8974 12.3405 12.3405 13.0178 13.0178 14.4365 14.4365 k = 0.0000 1.0581-0.0000 ( 3796 PWs) bands (ev): -36.9395 -36.9395 -36.9306 -36.9306 -16.2672 -16.2672 -16.2414 -16.2414 -14.5887 -14.5887 -14.5714 -14.5714 -14.4696 -14.4696 -14.4142 -14.4142 0.2226 0.2226 2.5745 2.5745 2.6523 2.6523 6.1222 6.1222 6.7425 6.7425 8.2945 8.2945 8.3595 8.3595 9.9653 9.9653 10.3508 10.3508 10.9767 10.9767 11.4669 11.4669 11.8890 11.8890 11.8974 11.8974 12.3405 12.3405 13.0178 13.0178 14.4365 14.4365 k = 0.0000 1.0581 0.0242 ( 3790 PWs) bands (ev): -36.9394 -36.9394 -36.9306 -36.9306 -16.2672 -16.2672 -16.2415 -16.2415 -14.5887 -14.5887 -14.5714 -14.5714 -14.4697 -14.4697 -14.4143 -14.4143 0.2238 0.2238 2.5758 2.5758 2.6536 2.6536 6.1220 6.1220 6.7386 6.7386 8.2942 8.2942 8.3597 8.3597 9.9633 9.9633 10.3502 10.3502 10.9666 10.9666 11.4408 11.4408 11.8827 11.8827 11.9175 11.9175 12.3471 12.3471 13.0255 13.0255 14.4108 14.4108 k = 0.0000 1.0581 0.0485 ( 3792 PWs) bands (ev): -36.9394 -36.9394 -36.9306 -36.9306 -16.2673 -16.2673 -16.2416 -16.2416 -14.5886 -14.5886 -14.5714 -14.5714 -14.4699 -14.4699 -14.4147 -14.4147 0.2273 0.2273 2.5796 2.5796 2.6573 2.6573 6.1213 6.1213 6.7272 6.7272 8.2930 8.2930 8.3610 8.3610 9.9572 9.9572 10.3484 10.3484 10.9367 10.9367 11.3738 11.3738 11.8606 11.8606 11.9699 11.9699 12.3669 12.3669 13.0479 13.0479 14.3778 14.3778 k = 0.0000 1.0581 0.0727 ( 3798 PWs) bands (ev): -36.9394 -36.9394 -36.9306 -36.9306 -16.2674 -16.2674 -16.2418 -16.2418 -14.5884 -14.5884 -14.5714 -14.5714 -14.4704 -14.4704 -14.4152 -14.4152 0.2333 0.2333 2.5860 2.5860 2.6635 2.6635 6.1195 6.1195 6.7090 6.7090 8.2901 8.2901 8.3642 8.3642 9.9469 9.9469 10.3453 10.3453 10.8887 10.8887 11.2831 11.2831 11.8249 11.8249 12.0368 12.0368 12.3996 12.3996 13.0829 13.0829 14.3528 14.3528 k = 0.0000 1.0581 0.0970 ( 3794 PWs) bands (ev): -36.9393 -36.9393 -36.9306 -36.9306 -16.2675 -16.2675 -16.2420 -16.2420 -14.5882 -14.5882 -14.5714 -14.5714 -14.4711 -14.4711 -14.4160 -14.4160 0.2416 0.2416 2.5949 2.5949 2.6722 2.6722 6.1156 6.1156 6.6852 6.6852 8.2847 8.2847 8.3703 8.3703 9.9325 9.9325 10.3408 10.3408 10.8247 10.8247 11.1789 11.1789 11.7772 11.7772 12.1081 12.1081 12.4450 12.4450 13.1272 13.1272 14.3388 14.3388 k = 0.0000 1.0581 0.1212 ( 3796 PWs) bands (ev): -36.9392 -36.9392 -36.9305 -36.9305 -16.2676 -16.2676 -16.2423 -16.2423 -14.5880 -14.5880 -14.5714 -14.5714 -14.4719 -14.4719 -14.4170 -14.4170 0.2523 0.2523 2.6063 2.6063 2.6833 2.6833 6.1083 6.1083 6.6575 6.6575 8.2767 8.2767 8.3799 8.3799 9.9137 9.9137 10.3347 10.3347 10.7474 10.7474 11.0661 11.0661 11.7193 11.7193 12.1791 12.1791 12.5026 12.5026 13.1775 13.1775 14.3371 14.3371 k = 0.0000 1.0581 0.1454 ( 3796 PWs) bands (ev): -36.9391 -36.9391 -36.9304 -36.9304 -16.2678 -16.2678 -16.2427 -16.2427 -14.5877 -14.5877 -14.5714 -14.5714 -14.4729 -14.4729 -14.4182 -14.4182 0.2654 0.2654 2.6202 2.6202 2.6969 2.6969 6.0953 6.0953 6.6286 6.6286 8.2663 8.2663 8.3927 8.3927 9.8905 9.8905 10.3267 10.3267 10.6594 10.6594 10.9478 10.9478 11.6530 11.6530 12.2482 12.2482 12.5712 12.5712 13.2305 13.2305 14.3485 14.3485 k = 0.0000 1.0581 0.1697 ( 3798 PWs) bands (ev): -36.9389 -36.9389 -36.9304 -36.9304 -16.2680 -16.2680 -16.2431 -16.2431 -14.5874 -14.5874 -14.5714 -14.5714 -14.4741 -14.4741 -14.4196 -14.4196 0.2808 0.2808 2.6366 2.6366 2.7130 2.7130 6.0741 6.0741 6.6016 6.6016 8.2542 8.2542 8.4086 8.4086 9.8626 9.8626 10.3162 10.3162 10.5635 10.5635 10.8261 10.8261 11.5799 11.5799 12.3146 12.3146 12.6496 12.6496 13.2835 13.2835 14.3735 14.3735 k = 0.0000 1.0581 0.1939 ( 3798 PWs) bands (ev): -36.9388 -36.9388 -36.9303 -36.9303 -16.2683 -16.2683 -16.2436 -16.2436 -14.5870 -14.5870 -14.5715 -14.5715 -14.4754 -14.4754 -14.4212 -14.4212 0.2987 0.2987 2.6555 2.6555 2.7314 2.7314 6.0420 6.0420 6.5798 6.5798 8.2409 8.2409 8.4268 8.4268 9.8296 9.8296 10.3019 10.3019 10.4623 10.4623 10.7035 10.7035 11.5015 11.5015 12.3788 12.3788 12.7359 12.7359 13.3344 13.3344 14.4120 14.4120 k = 0.0000 1.0581 0.2182 ( 3796 PWs) bands (ev): -36.9385 -36.9385 -36.9302 -36.9302 -16.2685 -16.2685 -16.2442 -16.2442 -14.5866 -14.5866 -14.5715 -14.5715 -14.4769 -14.4769 -14.4229 -14.4229 0.3189 0.3189 2.6767 2.6767 2.7523 2.7523 5.9970 5.9970 6.5658 6.5658 8.2267 8.2267 8.4468 8.4468 9.7909 9.7909 10.2802 10.2802 10.3589 10.3589 10.5840 10.5840 11.4191 11.4191 12.4412 12.4412 12.8286 12.8286 13.3818 13.3818 14.4634 14.4634 k = 0.0000 1.0581 0.2424 ( 3798 PWs) bands (ev): -36.9384 -36.9384 -36.9301 -36.9301 -16.2688 -16.2688 -16.2448 -16.2448 -14.5861 -14.5861 -14.5715 -14.5715 -14.4785 -14.4785 -14.4248 -14.4248 0.3415 0.3415 2.7004 2.7004 2.7755 2.7755 5.9384 5.9384 6.5610 6.5610 8.2120 8.2120 8.4681 8.4681 9.7460 9.7460 10.2367 10.2367 10.2623 10.2623 10.4764 10.4764 11.3340 11.3340 12.5023 12.5023 12.9258 12.9258 13.4254 13.4254 14.5260 14.5260 k = 0.0000 1.0581 0.2667 ( 3798 PWs) bands (ev): -36.9381 -36.9381 -36.9300 -36.9300 -16.2692 -16.2692 -16.2455 -16.2455 -14.5857 -14.5857 -14.5715 -14.5715 -14.4802 -14.4802 -14.4269 -14.4269 0.3664 0.3664 2.7264 2.7264 2.8011 2.8011 5.8671 5.8671 6.5652 6.5652 8.1968 8.1968 8.4898 8.4898 9.6938 9.6938 10.1443 10.1443 10.1874 10.1874 10.3964 10.3964 11.2471 11.2471 12.5625 12.5625 13.0260 13.0260 13.4652 13.4652 14.5658 14.5658 k = 0.0000 1.0581 0.2909 ( 3804 PWs) bands (ev): -36.9379 -36.9379 -36.9299 -36.9299 -16.2695 -16.2695 -16.2463 -16.2463 -14.5852 -14.5852 -14.5716 -14.5716 -14.4820 -14.4820 -14.4291 -14.4291 0.3938 0.3938 2.7546 2.7546 2.8290 2.8290 5.7848 5.7848 6.5775 6.5775 8.1812 8.1812 8.5109 8.5109 9.6339 9.6339 10.0442 10.0442 10.0910 10.0910 10.3496 10.3496 11.1594 11.1594 12.6224 12.6224 13.1280 13.1280 13.5020 13.5020 14.5705 14.5705 k = 0.0000 1.0581 0.3151 ( 3802 PWs) bands (ev): -36.9376 -36.9376 -36.9298 -36.9298 -16.2699 -16.2699 -16.2471 -16.2471 -14.5847 -14.5847 -14.5716 -14.5716 -14.4838 -14.4838 -14.4315 -14.4315 0.4235 0.4235 2.7850 2.7850 2.8592 2.8592 5.6932 5.6932 6.5965 6.5965 8.1651 8.1651 8.5299 8.5299 9.5663 9.5663 9.9411 9.9411 9.9854 9.9854 10.3218 10.3218 11.0716 11.0716 12.6821 12.6821 13.2303 13.2303 13.5365 13.5365 14.5772 14.5772 k = 0.0000 1.0581 0.3394 ( 3794 PWs) bands (ev): -36.9373 -36.9373 -36.9297 -36.9297 -16.2703 -16.2703 -16.2479 -16.2479 -14.5843 -14.5843 -14.5717 -14.5717 -14.4858 -14.4858 -14.4339 -14.4339 0.4555 0.4555 2.8176 2.8176 2.8916 2.8916 5.5942 5.5942 6.6211 6.6211 8.1482 8.1482 8.5448 8.5448 9.4926 9.4926 9.8258 9.8258 9.8926 9.8926 10.3021 10.3021 10.9843 10.9843 12.7420 12.7420 13.3320 13.3320 13.5698 13.5698 14.5865 14.5865 k = 0.0000 1.0581 0.3636 ( 3798 PWs) bands (ev): -36.9371 -36.9371 -36.9296 -36.9296 -16.2707 -16.2707 -16.2488 -16.2488 -14.5838 -14.5838 -14.5718 -14.5718 -14.4877 -14.4877 -14.4364 -14.4364 0.4900 0.4900 2.8523 2.8523 2.9262 2.9262 5.4894 5.4894 6.6502 6.6502 8.1303 8.1303 8.5529 8.5529 9.4164 9.4164 9.7024 9.7024 9.8136 9.8136 10.2858 10.2858 10.8983 10.8983 12.8023 12.8023 13.4320 13.4320 13.6026 13.6026 14.5980 14.5980 k = 0.0000 1.0581 0.3879 ( 3800 PWs) bands (ev): -36.9368 -36.9368 -36.9294 -36.9294 -16.2711 -16.2711 -16.2498 -16.2498 -14.5834 -14.5834 -14.5718 -14.5718 -14.4897 -14.4897 -14.4391 -14.4391 0.5268 0.5268 2.8889 2.8889 2.9629 2.9629 5.3799 5.3799 6.6832 6.6832 8.1110 8.1110 8.5504 8.5504 9.3433 9.3433 9.5779 9.5779 9.7427 9.7427 10.2713 10.2713 10.8139 10.8139 12.8632 12.8632 13.5294 13.5294 13.6359 13.6359 14.6117 14.6117 k = 0.0000 1.0581 0.4121 ( 3800 PWs) bands (ev): -36.9365 -36.9365 -36.9293 -36.9293 -16.2715 -16.2715 -16.2507 -16.2507 -14.5830 -14.5830 -14.5719 -14.5719 -14.4917 -14.4917 -14.4417 -14.4417 0.5660 0.5660 2.9273 2.9273 3.0017 3.0017 5.2669 5.2669 6.7192 6.7192 8.0897 8.0897 8.5330 8.5330 9.2793 9.2793 9.4556 9.4556 9.6770 9.6770 10.2579 10.2579 10.7318 10.7318 12.9249 12.9249 13.6232 13.6232 13.6706 13.6706 14.6273 14.6273 k = 0.0000 1.0581 0.4363 ( 3796 PWs) bands (ev): -36.9361 -36.9361 -36.9292 -36.9292 -16.2719 -16.2719 -16.2518 -16.2518 -14.5827 -14.5827 -14.5720 -14.5720 -14.4936 -14.4936 -14.4445 -14.4445 0.6075 0.6075 2.9674 2.9674 3.0424 3.0424 5.1512 5.1512 6.7578 6.7578 8.0659 8.0659 8.4965 8.4965 9.2298 9.2298 9.3377 9.3377 9.6145 9.6145 10.2454 10.2454 10.6524 10.6524 12.9875 12.9875 13.7009 13.7009 13.7194 13.7194 14.6444 14.6444 k = 0.0000 1.0581 0.4606 ( 3796 PWs) bands (ev): -36.9358 -36.9358 -36.9291 -36.9291 -16.2724 -16.2724 -16.2528 -16.2528 -14.5824 -14.5824 -14.5722 -14.5722 -14.4955 -14.4955 -14.4472 -14.4472 0.6514 0.6514 3.0090 3.0090 3.0851 3.0851 5.0337 5.0337 6.7984 6.7984 8.0387 8.0387 8.4396 8.4396 9.1951 9.1951 9.2280 9.2280 9.5541 9.5541 10.2335 10.2335 10.5762 10.5762 13.0510 13.0510 13.7413 13.7413 13.8035 13.8035 14.6627 14.6627 k = 0.0000 1.0581 0.4848 ( 3794 PWs) bands (ev): -36.9355 -36.9355 -36.9289 -36.9289 -16.2728 -16.2728 -16.2539 -16.2539 -14.5822 -14.5822 -14.5723 -14.5723 -14.4974 -14.4974 -14.4500 -14.4500 0.6977 0.6977 3.0520 3.0520 3.1297 3.1297 4.9150 4.9150 6.8403 6.8403 8.0074 8.0074 8.3639 8.3639 9.1169 9.1169 9.1854 9.1854 9.4950 9.4950 10.2224 10.2224 10.5038 10.5038 13.1156 13.1156 13.7813 13.7813 13.8864 13.8864 14.6820 14.6820 k = 0.0000 1.0581 0.5091 ( 3790 PWs) bands (ev): -36.9351 -36.9351 -36.9288 -36.9288 -16.2732 -16.2732 -16.2550 -16.2550 -14.5821 -14.5821 -14.5725 -14.5725 -14.4991 -14.4991 -14.4528 -14.4528 0.7463 0.7463 3.0959 3.0959 3.1760 3.1760 4.7958 4.7958 6.8830 6.8830 7.9713 7.9713 8.2734 8.2734 9.0213 9.0213 9.1811 9.1811 9.4369 9.4369 10.2119 10.2119 10.4356 10.4356 13.1813 13.1813 13.8235 13.8235 13.9656 13.9656 14.7020 14.7020 k = 0.0000 1.0581 0.5333 ( 3786 PWs) bands (ev): -36.9347 -36.9347 -36.9287 -36.9287 -16.2736 -16.2736 -16.2561 -16.2561 -14.5820 -14.5820 -14.5727 -14.5727 -14.5007 -14.5007 -14.4556 -14.4556 0.7972 0.7972 3.1406 3.1406 3.2238 3.2238 4.6768 4.6768 6.9258 6.9258 7.9300 7.9300 8.1726 8.1726 8.9352 8.9352 9.1851 9.1851 9.3797 9.3797 10.2022 10.2022 10.3723 10.3723 13.2482 13.2482 13.8684 13.8684 14.0412 14.0412 14.7225 14.7225 k = 0.0000 1.0581 0.5576 ( 3782 PWs) bands (ev): -36.9344 -36.9344 -36.9286 -36.9286 -16.2741 -16.2741 -16.2572 -16.2572 -14.5820 -14.5820 -14.5730 -14.5730 -14.5022 -14.5022 -14.4583 -14.4583 0.8505 0.8505 3.1854 3.1854 3.2732 3.2732 4.5587 4.5587 6.9676 6.9676 7.8836 7.8836 8.0650 8.0650 8.8600 8.8600 9.1919 9.1919 9.3240 9.3240 10.1931 10.1931 10.3148 10.3148 13.3161 13.3161 13.9161 13.9161 14.1134 14.1134 14.7434 14.7434 k = 0.0000 1.0581 0.5818 ( 3778 PWs) bands (ev): -36.9340 -36.9340 -36.9285 -36.9285 -16.2744 -16.2744 -16.2583 -16.2583 -14.5821 -14.5821 -14.5733 -14.5733 -14.5035 -14.5035 -14.4611 -14.4611 0.9061 0.9061 3.2297 3.2297 3.3239 3.3239 4.4424 4.4424 7.0071 7.0071 7.8331 7.8331 7.9536 7.9536 8.7963 8.7963 9.1950 9.1950 9.2734 9.2734 10.1845 10.1845 10.2638 10.2638 13.3850 13.3850 13.9668 13.9668 14.1826 14.1826 14.7646 14.7646 k = 0.0000 1.0581 0.6060 ( 3786 PWs) bands (ev): -36.9337 -36.9337 -36.9284 -36.9284 -16.2748 -16.2748 -16.2595 -16.2595 -14.5822 -14.5822 -14.5736 -14.5736 -14.5047 -14.5047 -14.4637 -14.4637 0.9641 0.9641 3.2725 3.2725 3.3758 3.3758 4.3289 4.3289 7.0422 7.0422 7.7806 7.7806 7.8405 7.8405 8.7440 8.7440 9.1771 9.1771 9.2421 9.2421 10.1757 10.1757 10.2208 10.2208 13.4548 13.4548 14.0204 14.0204 14.2490 14.2490 14.7860 14.7860 k = 0.0000 1.0581 0.6303 ( 3784 PWs) bands (ev): -36.9333 -36.9333 -36.9283 -36.9283 -16.2752 -16.2752 -16.2606 -16.2606 -14.5824 -14.5824 -14.5740 -14.5740 -14.5056 -14.5056 -14.4664 -14.4664 1.0244 1.0244 3.3122 3.3122 3.4287 3.4287 4.2198 4.2198 7.0700 7.0700 7.7206 7.7206 7.7367 7.7367 8.7026 8.7026 9.1317 9.1317 9.2349 9.2349 10.1630 10.1630 10.1901 10.1901 13.5254 13.5254 14.0772 14.0772 14.3132 14.3132 14.8077 14.8077 k = 0.0000 1.0581 0.6545 ( 3784 PWs) bands (ev): -36.9329 -36.9329 -36.9282 -36.9282 -16.2755 -16.2755 -16.2617 -16.2617 -14.5826 -14.5826 -14.5745 -14.5745 -14.5064 -14.5064 -14.4689 -14.4689 1.0869 1.0869 3.3462 3.3462 3.4823 3.4823 4.1178 4.1178 7.0864 7.0864 7.6117 7.6117 7.6898 7.6898 8.6708 8.6708 9.0777 9.0777 9.2314 9.2314 10.1426 10.1426 10.1760 10.1760 13.5967 13.5967 14.1368 14.1368 14.3753 14.3753 14.8296 14.8296 k = 0.0000 1.0581 0.6788 ( 3776 PWs) bands (ev): -36.9326 -36.9326 -36.9281 -36.9281 -16.2758 -16.2758 -16.2629 -16.2629 -14.5829 -14.5829 -14.5751 -14.5751 -14.5070 -14.5070 -14.4714 -14.4714 1.1518 1.1518 3.3705 3.3705 3.5364 3.5364 4.0267 4.0267 7.0870 7.0870 7.5005 7.5005 7.6603 7.6603 8.6476 8.6476 9.0217 9.0217 9.2242 9.2242 10.1232 10.1232 10.1696 10.1696 13.6685 13.6685 14.1994 14.1994 14.4356 14.4356 14.8518 14.8518 k = 0.0000 1.0581 0.7030 ( 3778 PWs) bands (ev): -36.9323 -36.9323 -36.9281 -36.9281 -16.2760 -16.2760 -16.2640 -16.2640 -14.5832 -14.5832 -14.5757 -14.5757 -14.5074 -14.5074 -14.4739 -14.4739 1.2190 1.2190 3.3787 3.3787 3.5907 3.5907 3.9527 3.9527 7.0687 7.0687 7.3915 7.3915 7.6487 7.6487 8.6318 8.6318 8.9651 8.9651 9.2117 9.2117 10.1097 10.1097 10.1658 10.1658 13.7406 13.7406 14.2646 14.2646 14.4943 14.4943 14.8742 14.8742 k = 0.0000 1.0581 0.7272 ( 3776 PWs) bands (ev): -36.9319 -36.9319 -36.9281 -36.9281 -16.2763 -16.2763 -16.2650 -16.2650 -14.5835 -14.5835 -14.5763 -14.5763 -14.5076 -14.5076 -14.4762 -14.4762 1.2885 1.2885 3.3636 3.3636 3.6449 3.6449 3.9030 3.9030 7.0322 7.0322 7.2856 7.2856 7.6558 7.6558 8.6222 8.6222 8.9085 8.9085 9.1935 9.1935 10.1024 10.1024 10.1634 10.1634 13.8126 13.8126 14.3320 14.3320 14.5514 14.5514 14.8965 14.8965 k = 0.0000 1.0581 0.7515 ( 3778 PWs) bands (ev): -36.9316 -36.9316 -36.9280 -36.9280 -16.2764 -16.2764 -16.2661 -16.2661 -14.5837 -14.5837 -14.5770 -14.5770 -14.5077 -14.5077 -14.4785 -14.4785 1.3602 1.3602 3.3213 3.3213 3.6985 3.6985 3.8809 3.8809 6.9819 6.9819 7.1836 7.1836 7.6782 7.6782 8.6181 8.6181 8.8519 8.8519 9.1703 9.1703 10.1006 10.1006 10.1620 10.1620 13.8844 13.8844 14.4013 14.4013 14.6066 14.6066 14.9149 14.9149 k = 0.0000 1.0581 0.7757 ( 3776 PWs) bands (ev): -36.9313 -36.9313 -36.9280 -36.9280 -16.2766 -16.2766 -16.2671 -16.2671 -14.5840 -14.5840 -14.5778 -14.5778 -14.5075 -14.5075 -14.4807 -14.4807 1.4342 1.4342 3.2554 3.2554 3.7511 3.7511 3.8827 3.8827 6.9230 6.9230 7.0860 7.0860 7.7120 7.7120 8.6185 8.6185 8.7955 8.7955 9.1428 9.1428 10.1029 10.1029 10.1616 10.1616 13.9555 13.9555 14.4715 14.4715 14.6596 14.6596 14.9149 14.9149 k = 0.0000 1.0581 0.8000 ( 3780 PWs) bands (ev): -36.9310 -36.9310 -36.9280 -36.9280 -16.2766 -16.2766 -16.2681 -16.2681 -14.5843 -14.5843 -14.5785 -14.5785 -14.5072 -14.5072 -14.4829 -14.4829 1.5104 1.5104 3.1732 3.1732 3.8022 3.8022 3.9004 3.9004 6.8603 6.8603 6.9937 6.9937 7.7535 7.7535 8.6227 8.6227 8.7396 8.7396 9.1119 9.1119 10.1084 10.1084 10.1619 10.1619 14.0258 14.0258 14.5415 14.5415 14.7096 14.7096 14.8995 14.8995 k = 0.0000 1.0581 0.8242 ( 3776 PWs) bands (ev): -36.9307 -36.9307 -36.9280 -36.9280 -16.2767 -16.2767 -16.2690 -16.2690 -14.5845 -14.5845 -14.5793 -14.5793 -14.5067 -14.5067 -14.4849 -14.4849 1.5888 1.5888 3.0815 3.0815 3.8513 3.8513 3.9268 3.9268 6.7973 6.7973 6.9072 6.9072 7.8000 7.8000 8.6292 8.6292 8.6854 8.6854 9.0786 9.0786 10.1158 10.1158 10.1627 10.1627 14.0948 14.0948 14.6092 14.6092 14.7557 14.7557 14.8800 14.8800 k = 0.0000 1.0581 0.8484 ( 3780 PWs) bands (ev): -36.9304 -36.9304 -36.9281 -36.9281 -16.2766 -16.2766 -16.2699 -16.2699 -14.5847 -14.5847 -14.5801 -14.5801 -14.5061 -14.5061 -14.4869 -14.4869 1.6694 1.6694 2.9846 2.9846 3.8975 3.8975 3.9570 3.9570 6.7369 6.7369 6.8275 6.8275 7.8500 7.8500 8.6177 8.6177 8.6526 8.6526 9.0438 9.0438 10.1242 10.1242 10.1640 10.1640 14.1622 14.1622 14.6711 14.6711 14.7965 14.7965 14.8609 14.8609 k = 0.0000 1.0581 0.8727 ( 3784 PWs) bands (ev): -36.9302 -36.9302 -36.9281 -36.9281 -16.2765 -16.2765 -16.2708 -16.2708 -14.5848 -14.5848 -14.5808 -14.5808 -14.5054 -14.5054 -14.4888 -14.4888 1.7522 1.7522 2.8851 2.8851 3.9404 3.9404 3.9875 3.9875 6.6810 6.6810 6.7553 6.7553 7.9022 7.9022 8.5670 8.5670 8.6623 8.6623 9.0080 9.0080 10.1328 10.1328 10.1654 10.1654 14.2277 14.2277 14.7184 14.7184 14.8289 14.8289 14.8518 14.8518 k = 0.0000 1.0581 0.8969 ( 3784 PWs) bands (ev): -36.9299 -36.9299 -36.9282 -36.9282 -16.2764 -16.2764 -16.2716 -16.2716 -14.5849 -14.5849 -14.5815 -14.5815 -14.5045 -14.5045 -14.4906 -14.4906 1.8370 1.8370 2.7846 2.7846 3.9790 3.9790 4.0162 4.0162 6.6316 6.6316 6.6914 6.6914 7.9559 7.9559 8.5120 8.5120 8.6791 8.6791 8.9721 8.9721 10.1411 10.1411 10.1669 10.1669 14.2909 14.2909 14.7340 14.7340 14.8505 14.8505 14.8696 14.8696 k = 0.0000 1.0581 0.9212 ( 3782 PWs) bands (ev): -36.9297 -36.9297 -36.9283 -36.9283 -16.2762 -16.2762 -16.2723 -16.2723 -14.5849 -14.5849 -14.5821 -14.5821 -14.5035 -14.5035 -14.4924 -14.4924 1.9239 1.9239 2.6840 2.6840 4.0126 4.0126 4.0413 4.0413 6.5899 6.5899 6.6366 6.6366 8.0106 8.0106 8.4564 8.4564 8.6992 8.6992 8.9363 8.9363 10.1486 10.1486 10.1682 10.1682 14.3515 14.3515 14.7179 14.7179 14.8798 14.8798 14.8936 14.8936 k = 0.0000 1.0581 0.9454 ( 3780 PWs) bands (ev): -36.9294 -36.9294 -36.9284 -36.9284 -16.2759 -16.2759 -16.2730 -16.2730 -14.5848 -14.5848 -14.5827 -14.5827 -14.5024 -14.5024 -14.4941 -14.4941 2.0129 2.0129 2.5840 2.5840 4.0405 4.0405 4.0615 4.0615 6.5574 6.5574 6.5918 6.5918 8.0658 8.0658 8.4007 8.4007 8.7219 8.7219 8.9013 8.9013 10.1550 10.1550 10.1690 10.1690 14.4094 14.4094 14.6877 14.6877 14.9073 14.9073 14.9143 14.9143 k = 0.0000 1.0581 0.9697 ( 3786 PWs) bands (ev): -36.9292 -36.9292 -36.9286 -36.9286 -16.2756 -16.2756 -16.2737 -16.2737 -14.5846 -14.5846 -14.5833 -14.5833 -14.5012 -14.5012 -14.4956 -14.4956 2.1038 2.1038 2.4850 2.4850 4.0619 4.0619 4.0757 4.0757 6.5349 6.5349 6.5577 6.5577 8.1215 8.1215 8.3449 8.3449 8.7470 8.7470 8.8673 8.8673 10.1602 10.1602 10.1692 10.1692 14.4642 14.4642 14.6507 14.6507 14.9261 14.9261 14.9309 14.9309 k = 0.0000 1.0581 0.9939 ( 3784 PWs) bands (ev): -36.9290 -36.9290 -36.9287 -36.9287 -16.2752 -16.2752 -16.2743 -16.2743 -14.5844 -14.5844 -14.5837 -14.5837 -14.5000 -14.5000 -14.4972 -14.4972 2.1965 2.1965 2.3873 2.3873 4.0763 4.0763 4.0832 4.0832 6.5234 6.5234 6.5347 6.5347 8.1773 8.1773 8.2891 8.2891 8.7743 8.7743 8.8347 8.8347 10.1642 10.1642 10.1686 10.1686 14.5159 14.5159 14.6094 14.6094 14.9374 14.9374 14.9406 14.9406 k = 0.0000 1.0581 1.0181 ( 3780 PWs) bands (ev): -36.9288 -36.9288 -36.9288 -36.9288 -16.2748 -16.2748 -16.2748 -16.2748 -14.5841 -14.5841 -14.5841 -14.5841 -14.4986 -14.4986 -14.4986 -14.4986 2.2911 2.2911 2.2911 2.2911 4.0835 4.0835 4.0835 4.0835 6.5232 6.5232 6.5232 6.5232 8.2332 8.2332 8.2332 8.2332 8.8036 8.8036 8.8036 8.8036 10.1670 10.1670 10.1670 10.1670 14.5644 14.5644 14.5644 14.5644 14.9425 14.9425 14.9425 14.9425 k = 0.0000 1.0581 1.0181 ( 3780 PWs) bands (ev): -36.9288 -36.9288 -36.9288 -36.9288 -16.2748 -16.2748 -16.2748 -16.2748 -14.5841 -14.5841 -14.5841 -14.5841 -14.4986 -14.4986 -14.4986 -14.4986 2.2911 2.2911 2.2911 2.2911 4.0835 4.0835 4.0835 4.0835 6.5232 6.5232 6.5232 6.5232 8.2332 8.2332 8.2332 8.2332 8.8036 8.8036 8.8036 8.8036 10.1670 10.1670 10.1670 10.1670 14.5644 14.5644 14.5644 14.5644 14.9425 14.9425 14.9425 14.9425 k = 0.0242 1.0581 1.0181 ( 3776 PWs) bands (ev): -36.9288 -36.9288 -36.9288 -36.9288 -16.2748 -16.2748 -16.2747 -16.2747 -14.5841 -14.5841 -14.5841 -14.5841 -14.4987 -14.4987 -14.4985 -14.4985 2.2908 2.2908 2.2913 2.2913 4.0831 4.0831 4.0834 4.0834 6.5215 6.5215 6.5245 6.5245 8.2313 8.2313 8.2365 8.2365 8.8033 8.8033 8.8044 8.8044 10.1667 10.1667 10.1670 10.1670 14.5628 14.5628 14.5663 14.5663 14.9424 14.9424 14.9433 14.9433 k = 0.0483 1.0581 1.0181 ( 3780 PWs) bands (ev): -36.9288 -36.9288 -36.9288 -36.9288 -16.2748 -16.2748 -16.2747 -16.2747 -14.5842 -14.5842 -14.5840 -14.5840 -14.4988 -14.4988 -14.4984 -14.4984 2.2906 2.2906 2.2915 2.2915 4.0825 4.0825 4.0830 4.0830 6.5194 6.5194 6.5252 6.5252 8.2309 8.2309 8.2413 8.2413 8.8034 8.8034 8.8058 8.8058 10.1663 10.1663 10.1669 10.1669 14.5617 14.5617 14.5686 14.5686 14.9430 14.9430 14.9447 14.9447 k = 0.0725 1.0581 1.0181 ( 3786 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2748 -16.2748 -16.2746 -16.2746 -14.5842 -14.5842 -14.5840 -14.5840 -14.4988 -14.4988 -14.4984 -14.4984 2.2903 2.2903 2.2917 2.2917 4.0814 4.0814 4.0823 4.0823 6.5170 6.5170 6.5254 6.5254 8.2321 8.2321 8.2474 8.2474 8.8041 8.8041 8.8076 8.8076 10.1656 10.1656 10.1665 10.1665 14.5609 14.5609 14.5712 14.5712 14.9442 14.9442 14.9466 14.9466 k = 0.0966 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2746 -16.2746 -14.5842 -14.5842 -14.5839 -14.5839 -14.4989 -14.4989 -14.4983 -14.4983 2.2899 2.2899 2.2918 2.2918 4.0799 4.0799 4.0811 4.0811 6.5145 6.5145 6.5253 6.5253 8.2345 8.2345 8.2544 8.2544 8.8053 8.8053 8.8098 8.8098 10.1647 10.1647 10.1660 10.1660 14.5605 14.5605 14.5740 14.5740 14.9459 14.9459 14.9488 14.9488 k = 0.1208 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2745 -16.2745 -14.5841 -14.5841 -14.5839 -14.5839 -14.4990 -14.4990 -14.4982 -14.4982 2.2896 2.2896 2.2919 2.2919 4.0780 4.0780 4.0795 4.0795 6.5120 6.5120 6.5251 6.5251 8.2382 8.2382 8.2622 8.2622 8.8070 8.8070 8.8125 8.8125 10.1637 10.1637 10.1652 10.1652 14.5605 14.5605 14.5769 14.5769 14.9479 14.9479 14.9511 14.9511 k = 0.1450 1.0581 1.0181 ( 3800 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2745 -16.2745 -14.5841 -14.5841 -14.5838 -14.5838 -14.4990 -14.4990 -14.4982 -14.4982 2.2892 2.2892 2.2919 2.2919 4.0757 4.0757 4.0775 4.0775 6.5099 6.5099 6.5248 6.5248 8.2428 8.2428 8.2705 8.2705 8.8092 8.8092 8.8154 8.8154 10.1625 10.1625 10.1643 10.1643 14.5607 14.5607 14.5797 14.5797 14.9499 14.9499 14.9531 14.9531 k = 0.1691 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2744 -16.2744 -14.5840 -14.5840 -14.5838 -14.5838 -14.4990 -14.4990 -14.4981 -14.4981 2.2888 2.2888 2.2919 2.2919 4.0730 4.0730 4.0751 4.0751 6.5083 6.5083 6.5247 6.5247 8.2482 8.2482 8.2789 8.2789 8.8118 8.8118 8.8187 8.8187 10.1611 10.1611 10.1633 10.1633 14.5611 14.5611 14.5822 14.5822 14.9518 14.9518 14.9546 14.9546 k = 0.1933 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2743 -16.2743 -14.5840 -14.5840 -14.5837 -14.5837 -14.4991 -14.4991 -14.4981 -14.4981 2.2884 2.2884 2.2918 2.2918 4.0697 4.0697 4.0722 4.0722 6.5075 6.5075 6.5251 6.5251 8.2540 8.2540 8.2872 8.2872 8.8147 8.8147 8.8221 8.8221 10.1597 10.1597 10.1622 10.1622 14.5614 14.5614 14.5843 14.5843 14.9530 14.9530 14.9551 14.9551 k = 0.2174 1.0581 1.0181 ( 3790 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2743 -16.2743 -14.5839 -14.5839 -14.5836 -14.5836 -14.4991 -14.4991 -14.4980 -14.4980 2.2879 2.2879 2.2917 2.2917 4.0660 4.0660 4.0688 4.0688 6.5079 6.5079 6.5261 6.5261 8.2599 8.2599 8.2949 8.2949 8.8179 8.8179 8.8255 8.8255 10.1581 10.1581 10.1609 10.1609 14.5614 14.5614 14.5854 14.5854 14.9532 14.9532 14.9544 14.9544 k = 0.2416 1.0581 1.0181 ( 3792 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2742 -16.2742 -14.5837 -14.5837 -14.5836 -14.5836 -14.4991 -14.4991 -14.4980 -14.4980 2.2874 2.2874 2.2915 2.2915 4.0617 4.0617 4.0649 4.0649 6.5096 6.5096 6.5281 6.5281 8.2659 8.2659 8.3019 8.3019 8.8212 8.8212 8.8289 8.8289 10.1565 10.1565 10.1597 10.1597 14.5609 14.5609 14.5852 14.5852 14.9520 14.9520 14.9521 14.9521 k = 0.2658 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2749 -16.2749 -16.2741 -16.2741 -14.5836 -14.5836 -14.5835 -14.5835 -14.4991 -14.4991 -14.4980 -14.4980 2.2869 2.2869 2.2912 2.2912 4.0569 4.0569 4.0604 4.0604 6.5128 6.5128 6.5313 6.5313 8.2715 8.2715 8.3079 8.3079 8.8245 8.8245 8.8320 8.8320 10.1549 10.1549 10.1584 10.1584 14.5593 14.5593 14.5833 14.5833 14.9480 14.9480 14.9498 14.9498 k = 0.2658 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2749 -16.2749 -16.2741 -16.2741 -14.5836 -14.5836 -14.5835 -14.5835 -14.4991 -14.4991 -14.4980 -14.4980 2.2869 2.2869 2.2912 2.2912 4.0569 4.0569 4.0604 4.0604 6.5128 6.5128 6.5313 6.5313 8.2715 8.2715 8.3079 8.3079 8.8245 8.8245 8.8320 8.8320 10.1549 10.1549 10.1584 10.1584 14.5593 14.5593 14.5833 14.5833 14.9480 14.9480 14.9498 14.9498 k = 0.2599 1.0346 1.0181 ( 3798 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2744 -16.2744 -14.5841 -14.5841 -14.5837 -14.5837 -14.4991 -14.4991 -14.4980 -14.4980 2.2888 2.2888 2.2921 2.2921 4.0738 4.0738 4.0758 4.0758 6.5019 6.5019 6.5216 6.5216 8.2502 8.2502 8.2865 8.2865 8.8122 8.8122 8.8207 8.8207 10.1607 10.1607 10.1626 10.1626 14.5648 14.5648 14.5910 14.5910 14.9534 14.9534 14.9584 14.9584 k = 0.2540 1.0111 1.0181 ( 3798 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2748 -16.2748 -16.2747 -16.2747 -14.5845 -14.5845 -14.5837 -14.5837 -14.4991 -14.4991 -14.4980 -14.4980 2.2900 2.2900 2.2923 2.2923 4.0826 4.0826 4.0831 4.0831 6.5034 6.5034 6.5243 6.5243 8.2308 8.2308 8.2669 8.2669 8.8017 8.8017 8.8114 8.8114 10.1650 10.1650 10.1653 10.1653 14.5618 14.5618 14.5876 14.5876 14.9453 14.9453 14.9551 14.9551 k = 0.2481 0.9876 1.0181 ( 3802 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2748 -16.2748 -16.2747 -16.2747 -14.5847 -14.5847 -14.5835 -14.5835 -14.4992 -14.4992 -14.4981 -14.4981 2.2902 2.2902 2.2916 2.2916 4.0821 4.0821 4.0832 4.0832 6.5174 6.5174 6.5395 6.5395 8.2132 8.2132 8.2493 8.2493 8.7929 8.7929 8.8039 8.8039 10.1667 10.1667 10.1683 10.1683 14.5479 14.5479 14.5704 14.5704 14.9331 14.9331 14.9452 14.9452 k = 0.2421 0.9641 1.0181 ( 3790 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2745 -16.2745 -14.5847 -14.5847 -14.5831 -14.5831 -14.4993 -14.4993 -14.4982 -14.4982 2.2897 2.2897 2.2900 2.2900 4.0732 4.0732 4.0758 4.0758 6.5436 6.5436 6.5670 6.5670 8.1976 8.1976 8.2337 8.2337 8.7858 8.7858 8.7982 8.7982 10.1672 10.1672 10.1708 10.1708 14.5210 14.5210 14.5373 14.5373 14.9224 14.9224 14.9339 14.9339 k = 0.2362 0.9406 1.0181 ( 3792 PWs) bands (ev): -36.9289 -36.9289 -36.9289 -36.9289 -16.2749 -16.2749 -16.2742 -16.2742 -14.5845 -14.5845 -14.5824 -14.5824 -14.4994 -14.4994 -14.4983 -14.4983 2.2875 2.2875 2.2882 2.2882 4.0568 4.0568 4.0607 4.0607 6.5816 6.5816 6.6060 6.6060 8.1839 8.1839 8.2201 8.2201 8.7804 8.7804 8.7943 8.7943 10.1673 10.1673 10.1729 10.1729 14.4802 14.4802 14.4886 14.4886 14.9155 14.9155 14.9246 14.9246 k = 0.2303 0.9171 1.0181 ( 3796 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2748 -16.2748 -16.2738 -16.2738 -14.5840 -14.5840 -14.5816 -14.5816 -14.4995 -14.4995 -14.4984 -14.4984 2.2841 2.2841 2.2857 2.2857 4.0335 4.0335 4.0387 4.0387 6.6305 6.6305 6.6560 6.6560 8.1724 8.1724 8.2086 8.2086 8.7766 8.7766 8.7920 8.7920 10.1674 10.1674 10.1750 10.1750 14.4260 14.4260 14.4263 14.4263 14.9125 14.9125 14.9184 14.9184 k = 0.2244 0.8935 1.0181 ( 3796 PWs) bands (ev): -36.9291 -36.9291 -36.9291 -36.9291 -16.2746 -16.2746 -16.2734 -16.2734 -14.5834 -14.5834 -14.5807 -14.5807 -14.4996 -14.4996 -14.4986 -14.4986 2.2797 2.2797 2.2824 2.2824 4.0043 4.0043 4.0105 4.0105 6.6895 6.6895 6.7157 6.7157 8.1631 8.1631 8.1992 8.1992 8.7745 8.7745 8.7914 8.7914 10.1677 10.1677 10.1775 10.1775 14.3533 14.3533 14.3605 14.3605 14.9122 14.9122 14.9152 14.9152 k = 0.2185 0.8700 1.0181 ( 3796 PWs) bands (ev): -36.9292 -36.9292 -36.9292 -36.9292 -16.2744 -16.2744 -16.2728 -16.2728 -14.5826 -14.5826 -14.5795 -14.5795 -14.4998 -14.4998 -14.4988 -14.4988 2.2744 2.2744 2.2780 2.2780 3.9699 3.9699 3.9771 3.9771 6.7573 6.7573 6.7842 6.7842 8.1561 8.1561 8.1920 8.1920 8.7741 8.7741 8.7924 8.7924 10.1689 10.1689 10.1808 10.1808 14.2724 14.2724 14.2860 14.2860 14.9134 14.9134 14.9142 14.9142 k = 0.2126 0.8465 1.0181 ( 3788 PWs) bands (ev): -36.9293 -36.9293 -36.9293 -36.9293 -16.2741 -16.2741 -16.2722 -16.2722 -14.5817 -14.5817 -14.5782 -14.5782 -14.5000 -14.5000 -14.4990 -14.4990 2.2682 2.2682 2.2726 2.2726 3.9313 3.9313 3.9392 3.9392 6.8328 6.8328 6.8601 6.8601 8.1517 8.1517 8.1872 8.1872 8.7754 8.7754 8.7951 8.7951 10.1711 10.1711 10.1853 10.1853 14.1860 14.1860 14.2048 14.2048 14.9143 14.9143 14.9150 14.9150 k = 0.2067 0.8230 1.0181 ( 3788 PWs) bands (ev): -36.9294 -36.9294 -36.9294 -36.9294 -16.2737 -16.2737 -16.2716 -16.2716 -14.5805 -14.5805 -14.5767 -14.5767 -14.5002 -14.5002 -14.4992 -14.4992 2.2609 2.2609 2.2663 2.2663 3.8893 3.8893 3.8979 3.8979 6.9148 6.9148 6.9421 6.9421 8.1502 8.1502 8.1849 8.1849 8.7784 8.7784 8.7994 8.7994 10.1749 10.1749 10.1912 10.1912 14.0960 14.0960 14.1191 14.1191 14.9148 14.9148 14.9163 14.9163 k = 0.2008 0.7995 1.0181 ( 3780 PWs) bands (ev): -36.9295 -36.9295 -36.9295 -36.9295 -16.2732 -16.2732 -16.2709 -16.2709 -14.5792 -14.5792 -14.5751 -14.5751 -14.5004 -14.5004 -14.4995 -14.4995 2.2527 2.2527 2.2589 2.2589 3.8447 3.8447 3.8538 3.8538 7.0017 7.0017 7.0287 7.0287 8.1522 8.1522 8.1857 8.1857 8.7833 8.7833 8.8054 8.8054 10.1805 10.1805 10.1991 10.1991 14.0039 14.0039 14.0304 14.0304 14.9150 14.9150 14.9170 14.9170 k = 0.1949 0.7760 1.0181 ( 3764 PWs) bands (ev): -36.9296 -36.9296 -36.9296 -36.9296 -16.2726 -16.2726 -16.2701 -16.2701 -14.5777 -14.5777 -14.5733 -14.5733 -14.5006 -14.5006 -14.4997 -14.4997 2.2435 2.2435 2.2504 2.2504 3.7983 3.7983 3.8077 3.8077 7.0921 7.0921 7.1182 7.1182 8.1583 8.1583 8.1900 8.1900 8.7901 8.7901 8.8132 8.8132 10.1883 10.1883 10.2090 10.2090 13.9109 13.9109 13.9400 13.9400 14.9147 14.9147 14.9167 14.9167 k = 0.1890 0.7525 1.0181 ( 3768 PWs) bands (ev): -36.9298 -36.9298 -36.9298 -36.9298 -16.2720 -16.2720 -16.2692 -16.2692 -14.5761 -14.5761 -14.5714 -14.5714 -14.5008 -14.5008 -14.4999 -14.4999 2.2334 2.2334 2.2409 2.2409 3.7506 3.7506 3.7602 3.7602 7.1841 7.1841 7.2086 7.2086 8.1697 8.1697 8.1988 8.1988 8.7989 8.7989 8.8228 8.8228 10.1985 10.1985 10.2215 10.2215 13.8178 13.8178 13.8491 13.8491 14.9135 14.9135 14.9153 14.9153 k = 0.1831 0.7289 1.0181 ( 3768 PWs) bands (ev): -36.9300 -36.9300 -36.9300 -36.9300 -16.2714 -16.2714 -16.2684 -16.2684 -14.5744 -14.5744 -14.5695 -14.5695 -14.5010 -14.5010 -14.5001 -14.5001 2.2223 2.2223 2.2304 2.2304 3.7022 3.7022 3.7120 3.7120 7.2756 7.2756 7.2976 7.2976 8.1879 8.1879 8.2133 8.2133 8.8099 8.8099 8.8344 8.8344 10.2115 10.2115 10.2366 10.2366 13.7254 13.7254 13.7584 13.7584 14.9112 14.9112 14.9127 14.9127 k = 0.1772 0.7054 1.0181 ( 3772 PWs) bands (ev): -36.9302 -36.9302 -36.9302 -36.9302 -16.2706 -16.2706 -16.2675 -16.2675 -14.5725 -14.5725 -14.5674 -14.5674 -14.5011 -14.5011 -14.5003 -14.5003 2.2102 2.2102 2.2189 2.2189 3.6537 3.6537 3.6635 3.6635 7.3640 7.3640 7.3823 7.3823 8.2151 8.2151 8.2354 8.2354 8.8233 8.8233 8.8480 8.8480 10.2273 10.2273 10.2546 10.2546 13.6342 13.6342 13.6688 13.6688 14.9080 14.9080 14.9090 14.9090 k = 0.1713 0.6819 1.0181 ( 3774 PWs) bands (ev): -36.9304 -36.9304 -36.9304 -36.9304 -16.2699 -16.2699 -16.2665 -16.2665 -14.5706 -14.5706 -14.5653 -14.5653 -14.5011 -14.5011 -14.5004 -14.5004 2.1972 2.1972 2.2064 2.2064 3.6054 3.6054 3.6152 3.6152 7.4463 7.4463 7.4596 7.4596 8.2537 8.2537 8.2675 8.2675 8.8390 8.8390 8.8638 8.8638 10.2463 10.2463 10.2757 10.2757 13.5449 13.5449 13.5806 13.5806 14.9037 14.9037 14.9041 14.9041 k = 0.1654 0.6584 1.0181 ( 3778 PWs) bands (ev): -36.9307 -36.9307 -36.9307 -36.9307 -16.2690 -16.2690 -16.2655 -16.2655 -14.5686 -14.5686 -14.5632 -14.5632 -14.5011 -14.5011 -14.5005 -14.5005 2.1834 2.1834 2.1929 2.1929 3.5577 3.5577 3.5673 3.5673 7.5191 7.5191 7.5264 7.5264 8.3062 8.3062 8.3120 8.3120 8.8573 8.8573 8.8818 8.8818 10.2684 10.2684 10.2999 10.2999 13.4577 13.4577 13.4945 13.4945 14.8981 14.8981 14.8983 14.8983 k = 0.1595 0.6349 1.0181 ( 3778 PWs) bands (ev): -36.9309 -36.9309 -36.9309 -36.9309 -16.2681 -16.2681 -16.2645 -16.2645 -14.5666 -14.5666 -14.5611 -14.5611 -14.5010 -14.5010 -14.5005 -14.5005 2.1687 2.1687 2.1786 2.1786 3.5108 3.5108 3.5202 3.5202 7.5798 7.5798 7.5806 7.5806 8.3713 8.3713 8.3741 8.3741 8.8783 8.8783 8.9023 8.9023 10.2939 10.2939 10.3275 10.3275 13.3732 13.3732 13.4108 13.4108 14.8911 14.8911 14.8919 14.8919 k = 0.1536 0.6114 1.0181 ( 3790 PWs) bands (ev): -36.9312 -36.9312 -36.9312 -36.9312 -16.2672 -16.2672 -16.2635 -16.2635 -14.5646 -14.5646 -14.5591 -14.5591 -14.5008 -14.5008 -14.5004 -14.5004 2.1532 2.1532 2.1633 2.1633 3.4651 3.4651 3.4742 3.4742 7.6214 7.6214 7.6270 7.6270 8.4461 8.4461 8.4576 8.4576 8.9020 8.9020 8.9252 8.9252 10.3227 10.3227 10.3584 10.3584 13.2914 13.2914 13.3299 13.3299 14.8830 14.8830 14.8846 14.8846 k = 0.1477 0.5879 1.0181 ( 3790 PWs) bands (ev): -36.9315 -36.9315 -36.9315 -36.9315 -16.2663 -16.2663 -16.2625 -16.2625 -14.5626 -14.5626 -14.5571 -14.5571 -14.5004 -14.5004 -14.5002 -14.5002 2.1370 2.1370 2.1473 2.1473 3.4207 3.4207 3.4294 3.4294 7.6498 7.6498 7.6607 7.6607 8.5360 8.5360 8.5554 8.5554 8.9284 8.9284 8.9506 8.9506 10.3549 10.3549 10.3927 10.3927 13.2129 13.2129 13.2522 13.2522 14.8740 14.8740 14.8764 14.8764 k = 0.1417 0.5643 1.0181 ( 3782 PWs) bands (ev): -36.9317 -36.9317 -36.9317 -36.9317 -16.2653 -16.2653 -16.2614 -16.2614 -14.5606 -14.5606 -14.5552 -14.5552 -14.4999 -14.4999 -14.4999 -14.4999 2.1202 2.1202 2.1305 2.1305 3.3778 3.3778 3.3861 3.3861 7.6677 7.6677 7.6826 7.6826 8.6388 8.6388 8.6651 8.6651 8.9577 8.9577 8.9787 8.9787 10.3903 10.3903 10.4303 10.4303 13.1378 13.1378 13.1779 13.1779 14.8641 14.8641 14.8672 14.8672 k = 0.1358 0.5408 1.0181 ( 3778 PWs) bands (ev): -36.9319 -36.9319 -36.9319 -36.9319 -16.2643 -16.2643 -16.2604 -16.2604 -14.5587 -14.5587 -14.5535 -14.5535 -14.4994 -14.4994 -14.4993 -14.4993 2.1029 2.1029 2.1131 2.1131 3.3365 3.3365 3.3444 3.3444 7.6770 7.6770 7.6947 7.6947 8.7520 8.7520 8.7842 8.7842 8.9898 8.9898 9.0093 9.0093 10.4290 10.4290 10.4713 10.4713 13.0665 13.0665 13.1074 13.1074 14.8532 14.8532 14.8572 14.8572 k = 0.1299 0.5173 1.0181 ( 3774 PWs) bands (ev): -36.9322 -36.9322 -36.9322 -36.9322 -16.2633 -16.2633 -16.2594 -16.2594 -14.5569 -14.5569 -14.5519 -14.5519 -14.4988 -14.4988 -14.4984 -14.4984 2.0851 2.0851 2.0952 2.0952 3.2969 3.2969 3.3044 3.3044 7.6798 7.6798 7.6991 7.6991 8.8731 8.8731 8.9104 8.9104 9.0249 9.0249 9.0426 9.0426 10.4708 10.4708 10.5155 10.5155 12.9991 12.9991 13.0410 13.0410 14.8411 14.8411 14.8461 14.8461 k = 0.1240 0.4938 1.0181 ( 3782 PWs) bands (ev): -36.9325 -36.9325 -36.9325 -36.9325 -16.2623 -16.2623 -16.2584 -16.2584 -14.5553 -14.5553 -14.5505 -14.5505 -14.4980 -14.4980 -14.4974 -14.4974 2.0669 2.0669 2.0769 2.0769 3.2591 3.2591 3.2661 3.2661 7.6775 7.6775 7.6976 7.6976 8.9985 8.9985 9.0413 9.0413 9.0640 9.0640 9.0790 9.0790 10.5156 10.5156 10.5630 10.5630 12.9361 12.9361 12.9791 12.9791 14.8274 14.8274 14.8338 14.8338 k = 0.1181 0.4703 1.0181 ( 3788 PWs) bands (ev): -36.9328 -36.9328 -36.9328 -36.9328 -16.2613 -16.2613 -16.2574 -16.2574 -14.5538 -14.5538 -14.5492 -14.5492 -14.4970 -14.4970 -14.4962 -14.4962 2.0484 2.0484 2.0582 2.0582 3.2232 3.2232 3.2296 3.2296 7.6712 7.6712 7.6916 7.6916 9.0950 9.0950 9.1154 9.1154 9.1384 9.1384 9.1780 9.1780 10.5633 10.5633 10.6136 10.6136 12.8778 12.8778 12.9220 12.9220 14.8112 14.8112 14.8192 14.8192 k = 0.1122 0.4468 1.0181 ( 3784 PWs) bands (ev): -36.9330 -36.9330 -36.9330 -36.9330 -16.2603 -16.2603 -16.2564 -16.2564 -14.5524 -14.5524 -14.5482 -14.5482 -14.4959 -14.4959 -14.4948 -14.4948 2.0299 2.0299 2.0393 2.0393 3.1892 3.1892 3.1951 3.1951 7.6621 7.6621 7.6822 7.6822 9.1406 9.1406 9.1561 9.1561 9.2682 9.2682 9.3149 9.3149 10.6138 10.6138 10.6673 10.6673 12.8245 12.8245 12.8702 12.8702 14.7901 14.7901 14.7997 14.7997 k = 0.1063 0.4233 1.0181 ( 3788 PWs) bands (ev): -36.9333 -36.9333 -36.9333 -36.9333 -16.2593 -16.2593 -16.2555 -16.2555 -14.5512 -14.5512 -14.5473 -14.5473 -14.4946 -14.4946 -14.4933 -14.4933 2.0113 2.0113 2.0204 2.0204 3.1570 3.1570 3.1624 3.1624 7.6507 7.6507 7.6703 7.6703 9.1852 9.1852 9.1986 9.1986 9.4018 9.4018 9.4526 9.4526 10.6670 10.6670 10.7241 10.7241 12.7767 12.7767 12.8242 12.8242 14.7574 14.7574 14.7651 14.7651 k = 0.1004 0.3997 1.0181 ( 3780 PWs) bands (ev): -36.9335 -36.9335 -36.9335 -36.9335 -16.2583 -16.2583 -16.2546 -16.2546 -14.5502 -14.5502 -14.5466 -14.5466 -14.4932 -14.4932 -14.4916 -14.4916 1.9928 1.9928 2.0016 2.0016 3.1268 3.1268 3.1317 3.1317 7.6377 7.6377 7.6566 7.6566 9.2314 9.2314 9.2429 9.2429 9.5351 9.5351 9.5897 9.5897 10.7229 10.7229 10.7839 10.7839 12.7348 12.7348 12.7844 12.7844 14.6974 14.6974 14.7012 14.7012 k = 0.0945 0.3762 1.0181 ( 3780 PWs) bands (ev): -36.9338 -36.9338 -36.9338 -36.9338 -16.2574 -16.2574 -16.2537 -16.2537 -14.5493 -14.5493 -14.5461 -14.5461 -14.4916 -14.4916 -14.4899 -14.4899 1.9746 1.9746 1.9829 1.9829 3.0985 3.0985 3.1028 3.1028 7.6235 7.6235 7.6416 7.6416 9.2790 9.2790 9.2888 9.2888 9.6663 9.6663 9.7245 9.7245 10.7816 10.7816 10.8470 10.8470 12.6994 12.6994 12.7514 12.7514 14.6042 14.6042 14.6189 14.6189 k = 0.0886 0.3527 1.0181 ( 3776 PWs) bands (ev): -36.9340 -36.9340 -36.9340 -36.9340 -16.2564 -16.2564 -16.2529 -16.2529 -14.5487 -14.5487 -14.5457 -14.5457 -14.4899 -14.4899 -14.4880 -14.4880 1.9568 1.9568 1.9646 1.9646 3.0720 3.0720 3.0759 3.0759 7.6087 7.6087 7.6258 7.6258 9.3279 9.3279 9.3362 9.3362 9.7937 9.7937 9.8552 9.8552 10.8436 10.8436 10.9134 10.9134 12.6708 12.6708 12.7257 12.7257 14.5016 14.5016 14.5220 14.5220 k = 0.0827 0.3292 1.0181 ( 3780 PWs) bands (ev): -36.9343 -36.9343 -36.9343 -36.9343 -16.2555 -16.2555 -16.2521 -16.2521 -14.5481 -14.5481 -14.5454 -14.5454 -14.4881 -14.4881 -14.4861 -14.4861 1.9394 1.9394 1.9468 1.9468 3.0475 3.0475 3.0509 3.0509 7.5935 7.5935 7.6095 7.6095 9.3779 9.3779 9.3846 9.3846 9.9154 9.9154 9.9799 9.9799 10.9091 10.9091 10.9835 10.9835 12.6495 12.6495 12.7078 12.7078 14.3958 14.3958 14.4194 14.4194 k = 0.0768 0.3057 1.0181 ( 3784 PWs) bands (ev): -36.9345 -36.9345 -36.9345 -36.9345 -16.2546 -16.2546 -16.2514 -16.2514 -14.5477 -14.5477 -14.5453 -14.5453 -14.4863 -14.4863 -14.4842 -14.4842 1.9227 1.9227 1.9296 1.9296 3.0247 3.0247 3.0277 3.0277 7.5782 7.5782 7.5932 7.5932 9.4285 9.4285 9.4338 9.4338 10.0295 10.0295 10.0964 10.0964 10.9792 10.9792 11.0578 11.0578 12.6358 12.6358 12.6979 12.6979 14.2898 14.2898 14.3153 14.3153 k = 0.0709 0.2822 1.0181 ( 3790 PWs) bands (ev): -36.9348 -36.9348 -36.9348 -36.9348 -16.2538 -16.2538 -16.2507 -16.2507 -14.5473 -14.5473 -14.5452 -14.5452 -14.4844 -14.4844 -14.4824 -14.4824 1.9067 1.9067 1.9130 1.9130 3.0038 3.0038 3.0064 3.0064 7.5632 7.5632 7.5771 7.5771 9.4794 9.4794 9.4835 9.4835 10.1343 10.1343 10.2023 10.2023 11.0546 11.0546 11.1367 11.1367 12.6297 12.6297 12.6961 12.6961 14.1854 14.1854 14.2125 14.2125 k = 0.0650 0.2587 1.0181 ( 3788 PWs) bands (ev): -36.9349 -36.9349 -36.9349 -36.9349 -16.2529 -16.2529 -16.2501 -16.2501 -14.5471 -14.5471 -14.5452 -14.5452 -14.4826 -14.4826 -14.4805 -14.4805 1.8915 1.8915 1.8974 1.8974 2.9847 2.9847 2.9869 2.9869 7.5486 7.5486 7.5614 7.5614 9.5303 9.5303 9.5331 9.5331 10.2278 10.2278 10.2956 10.2956 11.1362 11.1362 11.2206 11.2206 12.6306 12.6306 12.7018 12.7018 14.0849 14.0849 14.1132 14.1132 k = 0.0591 0.2351 1.0181 ( 3792 PWs) bands (ev): -36.9351 -36.9351 -36.9351 -36.9351 -16.2522 -16.2522 -16.2495 -16.2495 -14.5469 -14.5469 -14.5453 -14.5453 -14.4808 -14.4808 -14.4788 -14.4788 1.8773 1.8773 1.8826 1.8826 2.9673 2.9673 2.9692 2.9692 7.5347 7.5347 7.5463 7.5463 9.5806 9.5806 9.5822 9.5822 10.3089 10.3089 10.3745 10.3745 11.2247 11.2247 11.3097 11.3097 12.6375 12.6375 12.7136 12.7136 13.9905 13.9905 14.0199 14.0199 k = 0.0532 0.2116 1.0181 ( 3788 PWs) bands (ev): -36.9353 -36.9353 -36.9353 -36.9353 -16.2515 -16.2515 -16.2490 -16.2490 -14.5468 -14.5468 -14.5454 -14.5454 -14.4791 -14.4791 -14.4772 -14.4772 1.8642 1.8642 1.8690 1.8690 2.9517 2.9517 2.9532 2.9532 7.5217 7.5217 7.5321 7.5321 9.6298 9.6298 9.6304 9.6304 10.3770 10.3770 10.4385 10.4385 11.3197 11.3197 11.4039 11.4039 12.6480 12.6480 12.7288 12.7288 13.9056 13.9056 13.9356 13.9356 k = 0.0472 0.1881 1.0181 ( 3784 PWs) bands (ev): -36.9355 -36.9355 -36.9355 -36.9355 -16.2508 -16.2508 -16.2486 -16.2486 -14.5468 -14.5468 -14.5456 -14.5456 -14.4775 -14.4775 -14.4757 -14.4757 1.8522 1.8522 1.8565 1.8565 2.9378 2.9378 2.9390 2.9390 7.5096 7.5096 7.5189 7.5189 9.6771 9.6771 9.6773 9.6773 10.4320 10.4320 10.4881 10.4881 11.4205 11.4205 11.5025 11.5025 12.6586 12.6586 12.7434 12.7434 13.8343 13.8343 13.8641 13.8641 k = 0.0413 0.1646 1.0181 ( 3788 PWs) bands (ev): -36.9356 -36.9356 -36.9356 -36.9356 -16.2502 -16.2502 -16.2482 -16.2482 -14.5467 -14.5467 -14.5457 -14.5457 -14.4759 -14.4759 -14.4743 -14.4743 1.8415 1.8415 1.8452 1.8452 2.9255 2.9255 2.9266 2.9266 7.4988 7.4988 7.5069 7.5069 9.7215 9.7215 9.7224 9.7224 10.4748 10.4748 10.5245 10.5245 11.5257 11.5257 11.6046 11.6046 12.6643 12.6643 12.7517 12.7517 13.7820 13.7820 13.8101 13.8101 k = 0.0354 0.1411 1.0181 ( 3784 PWs) bands (ev): -36.9357 -36.9357 -36.9357 -36.9357 -16.2496 -16.2496 -16.2479 -16.2479 -14.5467 -14.5467 -14.5459 -14.5459 -14.4746 -14.4746 -14.4731 -14.4731 1.8321 1.8321 1.8352 1.8352 2.9150 2.9150 2.9158 2.9158 7.4892 7.4892 7.4962 7.4962 9.7629 9.7629 9.7644 9.7644 10.5068 10.5068 10.5496 10.5496 11.6335 11.6335 11.7090 11.7090 12.6598 12.6598 12.7473 12.7473 13.7540 13.7540 13.7781 13.7781 k = 0.0295 0.1176 1.0181 ( 3784 PWs) bands (ev): -36.9358 -36.9358 -36.9358 -36.9358 -16.2491 -16.2491 -16.2477 -16.2477 -14.5467 -14.5467 -14.5460 -14.5460 -14.4733 -14.4733 -14.4721 -14.4721 1.8240 1.8240 1.8267 1.8267 2.9061 2.9061 2.9067 2.9067 7.4810 7.4810 7.4868 7.4868 9.8005 9.8005 9.8023 9.8023 10.5298 10.5298 10.5655 10.5655 11.7424 11.7424 11.8145 11.8145 12.6402 12.6402 12.7250 12.7250 13.7538 13.7538 13.7715 13.7715 k = 0.0236 0.0941 1.0181 ( 3788 PWs) bands (ev): -36.9359 -36.9359 -36.9359 -36.9359 -16.2487 -16.2487 -16.2475 -16.2475 -14.5467 -14.5467 -14.5462 -14.5462 -14.4723 -14.4723 -14.4713 -14.4713 1.8174 1.8174 1.8195 1.8195 2.8988 2.8988 2.8993 2.8993 7.4743 7.4743 7.4790 7.4790 9.8334 9.8334 9.8353 9.8353 10.5457 10.5457 10.5742 10.5742 11.8509 11.8509 11.9195 11.9195 12.6035 12.6035 12.6833 12.6833 13.7803 13.7803 13.7900 13.7900 k = 0.0177 0.0705 1.0181 ( 3796 PWs) bands (ev): -36.9360 -36.9360 -36.9360 -36.9360 -16.2483 -16.2483 -16.2474 -16.2474 -14.5467 -14.5467 -14.5463 -14.5463 -14.4714 -14.4714 -14.4707 -14.4707 1.8123 1.8123 1.8139 1.8139 2.8932 2.8932 2.8935 2.8935 7.4691 7.4691 7.4726 7.4726 9.8605 9.8605 9.8622 9.8622 10.5563 10.5563 10.5777 10.5777 11.9571 11.9571 12.0221 12.0221 12.5511 12.5511 12.6246 12.6246 13.8271 13.8271 13.8290 13.8290 k = 0.0118 0.0470 1.0181 ( 3804 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2480 -16.2480 -16.2474 -16.2474 -14.5467 -14.5467 -14.5464 -14.5464 -14.4708 -14.4708 -14.4703 -14.4703 1.8087 1.8087 1.8097 1.8097 2.8892 2.8892 2.8894 2.8894 7.4656 7.4656 7.4679 7.4679 9.8809 9.8809 9.8822 9.8822 10.5635 10.5635 10.5778 10.5778 12.0586 12.0586 12.1184 12.1184 12.4886 12.4886 12.5539 12.5539 13.8791 13.8791 13.8826 13.8826 k = 0.0059 0.0235 1.0181 ( 3808 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2477 -16.2477 -16.2474 -16.2474 -14.5466 -14.5466 -14.5465 -14.5465 -14.4703 -14.4703 -14.4701 -14.4701 1.8066 1.8066 1.8071 1.8071 2.8868 2.8868 2.8869 2.8869 7.4637 7.4637 7.4648 7.4648 9.8937 9.8937 9.8944 9.8944 10.5686 10.5686 10.5758 10.5758 12.1500 12.1500 12.1959 12.1959 12.4308 12.4308 12.4793 12.4793 13.9253 13.9253 13.9296 13.9296 k = 0.0000 0.0000 1.0181 ( 3800 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5466 -14.5466 -14.5466 -14.5466 -14.4701 -14.4701 -14.4701 -14.4701 1.8061 1.8061 1.8061 1.8061 2.8861 2.8861 2.8861 2.8861 7.4634 7.4634 7.4634 7.4634 9.8983 9.8983 9.8983 9.8983 10.5726 10.5726 10.5726 10.5726 12.2117 12.2117 12.2117 12.2117 12.4222 12.4222 12.4222 12.4222 13.9468 13.9468 13.9468 13.9468 k = 0.0000 0.0000 1.0181 ( 3800 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5466 -14.5466 -14.5466 -14.5466 -14.4701 -14.4701 -14.4701 -14.4701 1.8061 1.8061 1.8061 1.8061 2.8861 2.8861 2.8861 2.8861 7.4634 7.4634 7.4634 7.4634 9.8983 9.8983 9.8983 9.8983 10.5726 10.5726 10.5726 10.5726 12.2117 12.2117 12.2117 12.2117 12.4222 12.4222 12.4222 12.4222 13.9468 13.9468 13.9468 13.9468 k = 0.0000 0.0000 0.9939 ( 3804 PWs) bands (ev): -36.9363 -36.9363 -36.9360 -36.9360 -16.2483 -16.2483 -16.2467 -16.2467 -14.5478 -14.5478 -14.5452 -14.5452 -14.4708 -14.4708 -14.4694 -14.4694 1.6880 1.6880 1.9261 1.9261 2.7838 2.7838 2.9907 2.9907 7.3546 7.3546 7.5734 7.5734 9.8744 9.8744 9.9225 9.9225 10.5587 10.5587 10.5859 10.5859 12.1633 12.1633 12.2547 12.2547 12.3582 12.3582 12.4880 12.4880 13.9320 13.9320 13.9675 13.9675 k = 0.0000 0.0000 0.9697 ( 3796 PWs) bands (ev): -36.9365 -36.9365 -36.9358 -36.9358 -16.2490 -16.2490 -16.2458 -16.2458 -14.5488 -14.5488 -14.5436 -14.5436 -14.4714 -14.4714 -14.4688 -14.4688 1.5720 1.5720 2.0480 2.0480 2.6840 2.6840 3.0977 3.0977 7.2472 7.2472 7.6844 7.6844 9.8510 9.8510 9.9468 9.9468 10.5444 10.5444 10.5983 10.5983 12.1131 12.1131 12.2662 12.2662 12.3218 12.3218 12.5522 12.5522 13.9242 13.9242 13.9932 13.9932 k = 0.0000 0.0000 0.9454 ( 3804 PWs) bands (ev): -36.9368 -36.9368 -36.9356 -36.9356 -16.2496 -16.2496 -16.2448 -16.2448 -14.5497 -14.5497 -14.5418 -14.5418 -14.4720 -14.4720 -14.4681 -14.4681 1.4583 1.4583 2.1717 2.1717 2.5868 2.5868 3.2071 3.2071 7.1415 7.1415 7.7961 7.7961 9.8282 9.8282 9.9710 9.9710 10.5300 10.5300 10.6094 10.6094 12.0625 12.0625 12.2130 12.2130 12.3456 12.3456 12.6133 12.6133 13.9239 13.9239 14.0221 14.0221 k = 0.0000 0.0000 0.9212 ( 3808 PWs) bands (ev): -36.9370 -36.9370 -36.9355 -36.9355 -16.2501 -16.2501 -16.2437 -16.2437 -14.5504 -14.5504 -14.5399 -14.5399 -14.4727 -14.4727 -14.4674 -14.4674 1.3467 1.3467 2.2966 2.2966 2.4924 2.4924 3.3187 3.3187 7.0377 7.0377 7.9081 7.9081 9.8060 9.8060 9.9949 9.9949 10.5157 10.5157 10.6188 10.6188 12.0127 12.0127 12.1524 12.1524 12.3714 12.3714 12.6698 12.6698 13.9309 13.9309 14.0473 14.0473 k = 0.0000 0.0000 0.8969 ( 3810 PWs) bands (ev): -36.9373 -36.9373 -36.9354 -36.9354 -16.2505 -16.2505 -16.2426 -16.2426 -14.5510 -14.5510 -14.5378 -14.5378 -14.4732 -14.4732 -14.4668 -14.4668 1.2374 1.2374 2.3915 2.3915 2.4320 2.4320 3.4327 3.4327 6.9362 6.9362 8.0202 8.0202 9.7845 9.7845 10.0181 10.0181 10.5014 10.5014 10.6259 10.6259 11.9645 11.9645 12.0946 12.0946 12.3882 12.3882 12.7207 12.7207 13.9403 13.9403 14.0318 14.0318 k = 0.0000 0.0000 0.8727 ( 3790 PWs) bands (ev): -36.9375 -36.9375 -36.9353 -36.9353 -16.2509 -16.2509 -16.2414 -16.2414 -14.5514 -14.5514 -14.5355 -14.5355 -14.4737 -14.4737 -14.4662 -14.4662 1.1305 1.1305 2.3075 2.3075 2.5545 2.5545 3.5488 3.5488 6.8372 6.8372 8.1321 8.1321 9.7637 9.7637 10.0403 10.0403 10.4874 10.4874 10.6302 10.6302 11.9186 11.9186 12.0420 12.0420 12.3932 12.3932 12.7654 12.7654 13.9349 13.9349 14.0240 14.0240 k = 0.0000 0.0000 0.8484 ( 3792 PWs) bands (ev): -36.9377 -36.9377 -36.9353 -36.9353 -16.2512 -16.2512 -16.2401 -16.2401 -14.5517 -14.5517 -14.5330 -14.5330 -14.4742 -14.4742 -14.4655 -14.4655 1.0260 1.0260 2.2202 2.2202 2.6838 2.6838 3.6672 3.6672 6.7409 6.7409 8.2434 8.2434 9.7438 9.7438 10.0609 10.0609 10.4736 10.4736 10.6313 10.6313 11.8756 11.8756 11.9960 11.9960 12.3847 12.3847 12.8033 12.8033 13.9149 13.9149 14.0534 14.0534 k = 0.0000 0.0000 0.8242 ( 3786 PWs) bands (ev): -36.9380 -36.9380 -36.9352 -36.9352 -16.2514 -16.2514 -16.2387 -16.2387 -14.5518 -14.5518 -14.5304 -14.5304 -14.4746 -14.4746 -14.4649 -14.4649 0.9239 0.9239 2.1352 2.1352 2.8144 2.8144 3.7876 3.7876 6.6478 6.6478 8.3537 8.3537 9.7245 9.7245 10.0796 10.0796 10.4601 10.4601 10.6285 10.6285 11.8359 11.8359 11.9580 11.9580 12.3622 12.3622 12.8349 12.8349 13.9005 13.9005 14.1018 14.1018 k = 0.0000 0.0000 0.8000 ( 3788 PWs) bands (ev): -36.9383 -36.9383 -36.9352 -36.9352 -16.2515 -16.2515 -16.2373 -16.2373 -14.5518 -14.5518 -14.5277 -14.5277 -14.4750 -14.4750 -14.4643 -14.4643 0.8243 0.8243 2.0525 2.0525 2.9457 2.9457 3.9102 3.9102 6.5583 6.5583 8.4627 8.4627 9.7061 9.7061 10.0957 10.0957 10.4469 10.4469 10.6215 10.6215 11.8002 11.8002 11.9287 11.9287 12.3261 12.3261 12.8606 12.8606 13.8972 13.8972 14.1619 14.1619 k = 0.0000 0.0000 0.7757 ( 3784 PWs) bands (ev): -36.9386 -36.9386 -36.9352 -36.9352 -16.2516 -16.2516 -16.2359 -16.2359 -14.5518 -14.5518 -14.5248 -14.5248 -14.4752 -14.4752 -14.4638 -14.4638 0.7273 0.7273 1.9723 1.9723 3.0775 3.0775 4.0346 4.0346 6.4726 6.4726 8.5699 8.5699 9.6883 9.6883 10.1088 10.1088 10.4339 10.4339 10.6101 10.6101 11.7694 11.7694 11.9087 11.9087 12.2776 12.2776 12.8815 12.8815 13.9044 13.9044 14.2302 14.2302 k = 0.0000 0.0000 0.7515 ( 3784 PWs) bands (ev): -36.9389 -36.9389 -36.9352 -36.9352 -16.2516 -16.2516 -16.2344 -16.2344 -14.5516 -14.5516 -14.5219 -14.5219 -14.4753 -14.4753 -14.4632 -14.4632 0.6328 0.6328 1.8946 1.8946 3.2093 3.2093 4.1610 4.1610 6.3915 6.3915 8.6749 8.6749 9.6713 9.6713 10.1183 10.1183 10.4212 10.4212 10.5940 10.5940 11.7445 11.7445 11.8979 11.8979 12.2186 12.2186 12.8985 12.8985 13.9193 13.9193 14.2962 14.2962 k = 0.0000 0.0000 0.7272 ( 3786 PWs) bands (ev): -36.9393 -36.9393 -36.9352 -36.9352 -16.2515 -16.2515 -16.2328 -16.2328 -14.5514 -14.5514 -14.5188 -14.5188 -14.4754 -14.4754 -14.4626 -14.4626 0.5410 0.5410 1.8193 1.8193 3.3405 3.3405 4.2890 4.2890 6.3155 6.3155 8.7771 8.7771 9.6550 9.6550 10.1239 10.1239 10.4087 10.4087 10.5736 10.5736 11.7262 11.7262 11.8959 11.8959 12.1512 12.1512 12.9129 12.9129 13.9367 13.9367 14.2584 14.2584 k = 0.0000 0.0000 0.7030 ( 3790 PWs) bands (ev): -36.9396 -36.9396 -36.9353 -36.9353 -16.2514 -16.2514 -16.2312 -16.2312 -14.5512 -14.5512 -14.5156 -14.5156 -14.4753 -14.4753 -14.4621 -14.4621 0.4517 0.4517 1.7465 1.7465 3.4706 3.4706 4.4187 4.4187 6.2453 6.2453 8.8761 8.8761 9.6394 9.6394 10.1251 10.1251 10.3963 10.3963 10.5491 10.5491 11.7149 11.7149 11.9021 11.9021 12.0780 12.0780 12.9257 12.9257 13.9476 13.9476 14.2001 14.2001 k = 0.0000 0.0000 0.6788 ( 3788 PWs) bands (ev): -36.9400 -36.9400 -36.9353 -36.9353 -16.2512 -16.2512 -16.2296 -16.2296 -14.5509 -14.5509 -14.5124 -14.5124 -14.4750 -14.4750 -14.4615 -14.4615 0.3652 0.3652 1.6762 1.6762 3.5986 3.5986 4.5498 4.5498 6.1820 6.1820 8.9712 8.9712 9.6244 9.6244 10.1218 10.1218 10.3839 10.3839 10.5209 10.5209 11.7106 11.7106 11.9140 11.9140 12.0031 12.0031 12.9377 12.9377 13.9360 13.9360 14.1619 14.1619 k = 0.0000 0.0000 0.6545 ( 3792 PWs) bands (ev): -36.9404 -36.9404 -36.9354 -36.9354 -16.2510 -16.2510 -16.2280 -16.2280 -14.5506 -14.5506 -14.5091 -14.5091 -14.4747 -14.4747 -14.4610 -14.4610 0.2814 0.2814 1.6084 1.6084 3.7237 3.7237 4.6820 4.6820 6.1268 6.1268 9.0620 9.0620 9.6101 9.6101 10.1140 10.1140 10.3714 10.3714 10.4898 10.4898 11.7114 11.7114 11.9046 11.9046 11.9566 11.9566 12.9499 12.9499 13.8900 13.8900 14.1530 14.1530 k = 0.0000 0.0000 0.6303 ( 3792 PWs) bands (ev): -36.9407 -36.9407 -36.9355 -36.9355 -16.2507 -16.2507 -16.2264 -16.2264 -14.5503 -14.5503 -14.5059 -14.5059 -14.4741 -14.4741 -14.4604 -14.4604 0.2003 0.2003 1.5430 1.5430 3.8444 3.8444 4.8150 4.8150 6.0812 6.0812 9.1477 9.1477 9.5963 9.5963 10.1019 10.1019 10.3588 10.3588 10.4564 10.4564 11.7089 11.7089 11.8444 11.8444 11.9766 11.9766 12.9627 12.9627 13.8184 13.8184 14.1268 14.1268 k = 0.0000 0.0000 0.6060 ( 3802 PWs) bands (ev): -36.9411 -36.9411 -36.9356 -36.9356 -16.2504 -16.2504 -16.2247 -16.2247 -14.5500 -14.5500 -14.5026 -14.5026 -14.4734 -14.4734 -14.4597 -14.4597 0.1220 0.1220 1.4802 1.4802 3.9593 3.9593 4.9486 4.9486 6.0471 6.0471 9.2278 9.2278 9.5833 9.5833 10.0857 10.0857 10.3460 10.3460 10.4214 10.4214 11.6762 11.6762 11.8127 11.8127 12.0107 12.0107 12.9768 12.9768 13.7333 13.7333 14.0999 14.0999 k = 0.0000 0.0000 0.5818 ( 3798 PWs) bands (ev): -36.9415 -36.9415 -36.9356 -36.9356 -16.2501 -16.2501 -16.2231 -16.2231 -14.5498 -14.5498 -14.4994 -14.4994 -14.4725 -14.4725 -14.4591 -14.4591 0.0465 0.0465 1.4198 1.4198 4.0664 4.0664 5.0822 5.0822 6.0267 6.0267 9.3016 9.3016 9.5710 9.5710 10.0660 10.0660 10.3327 10.3327 10.3856 10.3856 11.6052 11.6052 11.8251 11.8251 12.0515 12.0515 12.9925 12.9925 13.6407 13.6407 14.0824 14.0824 k = 0.0000 0.0000 0.5576 ( 3796 PWs) bands (ev): -36.9418 -36.9418 -36.9357 -36.9357 -16.2497 -16.2497 -16.2214 -16.2214 -14.5496 -14.5496 -14.4963 -14.4963 -14.4715 -14.4715 -14.4583 -14.4583 -0.0262 -0.0262 1.3619 1.3619 4.1636 4.1636 5.2152 5.2152 6.0224 6.0224 9.3684 9.3684 9.5596 9.5596 10.0431 10.0431 10.3191 10.3191 10.3495 10.3495 11.5199 11.5199 11.8581 11.8581 12.0977 12.0977 13.0102 13.0102 13.5429 13.5429 14.0749 14.0749 k = 0.0000 0.0000 0.5333 ( 3791 PWs) bands (ev): -36.9422 -36.9422 -36.9358 -36.9358 -16.2493 -16.2493 -16.2198 -16.2198 -14.5494 -14.5494 -14.4933 -14.4933 -14.4703 -14.4703 -14.4575 -14.4575 -0.0960 -0.0960 1.3065 1.3065 4.2488 4.2488 5.3473 5.3473 6.0370 6.0370 9.4269 9.4269 9.5498 9.5498 10.0178 10.0178 10.3048 10.3048 10.3139 10.3139 11.4299 11.4299 11.9020 11.9020 12.1486 12.1486 13.0301 13.0301 13.4409 13.4409 14.0781 14.0781 k = 0.0000 0.0000 0.5091 ( 3795 PWs) bands (ev): -36.9425 -36.9425 -36.9360 -36.9360 -16.2489 -16.2489 -16.2182 -16.2182 -14.5493 -14.5493 -14.4905 -14.4905 -14.4690 -14.4690 -14.4565 -14.4565 -0.1629 -0.1629 1.2536 1.2536 4.3200 4.3200 5.4780 5.4780 6.0724 6.0724 9.4741 9.4741 9.5443 9.5443 9.9906 9.9906 10.2793 10.2793 10.2898 10.2898 11.3380 11.3380 11.9540 11.9540 12.2036 12.2036 13.0524 13.0524 13.3354 13.3354 14.0922 14.0922 k = 0.0000 0.0000 0.4848 ( 3801 PWs) bands (ev): -36.9429 -36.9429 -36.9361 -36.9361 -16.2485 -16.2485 -16.2166 -16.2166 -14.5493 -14.5493 -14.4878 -14.4878 -14.4677 -14.4677 -14.4553 -14.4553 -0.2269 -0.2269 1.2031 1.2031 4.3761 4.3761 5.6073 5.6073 6.1296 6.1296 9.4994 9.4994 9.5534 9.5534 9.9619 9.9619 10.2464 10.2464 10.2738 10.2738 11.2452 11.2452 12.0126 12.0126 12.2625 12.2625 13.0771 13.0771 13.2269 13.2269 14.1176 14.1176 k = 0.0000 0.0000 0.4606 ( 3801 PWs) bands (ev): -36.9432 -36.9432 -36.9362 -36.9362 -16.2481 -16.2481 -16.2150 -16.2150 -14.5493 -14.5493 -14.4853 -14.4853 -14.4663 -14.4663 -14.4539 -14.4539 -0.2880 -0.2880 1.1552 1.1552 4.4169 4.4169 5.7359 5.7359 6.2080 6.2080 9.5002 9.5002 9.5794 9.5794 9.9324 9.9324 10.2156 10.2156 10.2568 10.2568 11.1518 11.1518 12.0770 12.0770 12.3247 12.3247 13.0987 13.0987 13.1210 13.1210 14.1540 14.1540 k = 0.0000 0.0000 0.4363 ( 3799 PWs) bands (ev): -36.9436 -36.9436 -36.9363 -36.9363 -16.2476 -16.2476 -16.2135 -16.2135 -14.5493 -14.5493 -14.4831 -14.4831 -14.4649 -14.4649 -14.4523 -14.4523 -0.3461 -0.3461 1.1097 1.1097 4.4434 4.4434 5.8647 5.8647 6.3053 6.3053 9.4934 9.4934 9.6053 9.6053 9.9025 9.9025 10.1875 10.1875 10.2385 10.2385 11.0582 11.0582 12.1464 12.1464 12.3899 12.3899 12.9990 12.9990 13.1366 13.1366 14.2014 14.2014 k = 0.0000 0.0000 0.4121 ( 3799 PWs) bands (ev): -36.9439 -36.9439 -36.9365 -36.9365 -16.2472 -16.2472 -16.2120 -16.2120 -14.5495 -14.5495 -14.4810 -14.4810 -14.4635 -14.4635 -14.4505 -14.4505 -0.4012 -0.4012 1.0667 1.0667 4.4574 4.4574 5.9951 5.9951 6.4179 6.4179 9.4850 9.4850 9.6253 9.6253 9.8726 9.8726 10.1624 10.1624 10.2187 10.2187 10.9643 10.9643 12.2202 12.2202 12.4578 12.4578 12.8828 12.8828 13.1692 13.1692 14.2593 14.2593 k = 0.0000 0.0000 0.3879 ( 3803 PWs) bands (ev): -36.9443 -36.9443 -36.9366 -36.9366 -16.2467 -16.2467 -16.2106 -16.2106 -14.5496 -14.5496 -14.4792 -14.4792 -14.4622 -14.4622 -14.4484 -14.4484 -0.4533 -0.4533 1.0261 1.0261 4.4610 4.4610 6.1280 6.1280 6.5425 6.5425 9.4763 9.4763 9.6386 9.6386 9.8430 9.8430 10.1404 10.1404 10.1971 10.1971 10.8701 10.8701 12.2976 12.2976 12.5278 12.5278 12.7650 12.7650 13.2049 13.2049 14.2798 14.2798 k = 0.0000 0.0000 0.3636 ( 3801 PWs) bands (ev): -36.9446 -36.9446 -36.9367 -36.9367 -16.2463 -16.2463 -16.2093 -16.2093 -14.5498 -14.5498 -14.4776 -14.4776 -14.4609 -14.4609 -14.4462 -14.4462 -0.5024 -0.5024 0.9880 0.9880 4.4568 4.4568 6.2636 6.2636 6.6759 6.6759 9.4678 9.4678 9.6453 9.6453 9.8141 9.8141 10.1215 10.1215 10.1733 10.1733 10.7758 10.7758 12.3772 12.3772 12.5964 12.5964 12.6506 12.6506 13.2431 13.2431 14.2698 14.2698 k = 0.0000 0.0000 0.3394 ( 3801 PWs) bands (ev): -36.9449 -36.9449 -36.9368 -36.9368 -16.2459 -16.2459 -16.2080 -16.2080 -14.5500 -14.5500 -14.4761 -14.4761 -14.4597 -14.4597 -14.4439 -14.4439 -0.5484 -0.5484 0.9524 0.9524 4.4467 4.4467 6.4018 6.4018 6.8157 6.8157 9.4596 9.4596 9.6462 9.6462 9.7861 9.7861 10.1055 10.1055 10.1470 10.1470 10.6812 10.6812 12.4485 12.4485 12.5361 12.5361 12.6776 12.6776 13.2839 13.2839 14.2572 14.2572 k = 0.0000 0.0000 0.3151 ( 3803 PWs) bands (ev): -36.9452 -36.9452 -36.9369 -36.9369 -16.2455 -16.2455 -16.2067 -16.2067 -14.5503 -14.5503 -14.4749 -14.4749 -14.4584 -14.4584 -14.4415 -14.4415 -0.5913 -0.5913 0.9193 0.9193 4.4325 4.4325 6.5420 6.5420 6.9600 6.9600 9.4517 9.4517 9.6422 9.6422 9.7592 9.7592 10.0920 10.0920 10.1179 10.1179 10.5862 10.5862 12.3901 12.3901 12.5617 12.5617 12.7526 12.7526 13.3271 13.3271 14.2423 14.2423 k = 0.0000 0.0000 0.2909 ( 3795 PWs) bands (ev): -36.9454 -36.9454 -36.9370 -36.9370 -16.2451 -16.2451 -16.2056 -16.2056 -14.5506 -14.5506 -14.4739 -14.4739 -14.4572 -14.4572 -14.4392 -14.4392 -0.6312 -0.6312 0.8886 0.8886 4.4157 4.4157 6.6832 6.6832 7.1076 7.1076 9.4443 9.4443 9.6346 9.6346 9.7335 9.7335 10.0803 10.0803 10.0856 10.0856 10.4909 10.4909 12.2749 12.2749 12.6465 12.6465 12.8293 12.8293 13.3724 13.3724 14.2257 14.2257 k = 0.0000 0.0000 0.2667 ( 3799 PWs) bands (ev): -36.9457 -36.9457 -36.9371 -36.9371 -16.2447 -16.2447 -16.2045 -16.2045 -14.5508 -14.5508 -14.4730 -14.4730 -14.4560 -14.4560 -14.4368 -14.4368 -0.6679 -0.6679 0.8604 0.8604 4.3975 4.3975 6.8246 6.8246 7.2572 7.2572 9.4373 9.4373 9.6243 9.6243 9.7093 9.7093 10.0489 10.0489 10.0707 10.0707 10.3952 10.3952 12.1591 12.1591 12.7357 12.7357 12.9069 12.9069 13.4195 13.4195 14.2077 14.2077 k = 0.0000 0.0000 0.2424 ( 3797 PWs) bands (ev): -36.9459 -36.9459 -36.9372 -36.9372 -16.2444 -16.2444 -16.2035 -16.2035 -14.5511 -14.5511 -14.4723 -14.4723 -14.4548 -14.4548 -14.4346 -14.4346 -0.7015 -0.7015 0.8346 0.8346 4.3787 4.3787 6.9650 6.9650 7.4079 7.4079 9.4309 9.4309 9.6123 9.6123 9.6866 9.6866 10.0084 10.0084 10.0618 10.0618 10.2993 10.2993 12.0463 12.0463 12.8262 12.8262 12.9847 12.9847 13.4681 13.4681 14.1887 14.1887 k = 0.0000 0.0000 0.2182 ( 3799 PWs) bands (ev): -36.9461 -36.9461 -36.9373 -36.9373 -16.2440 -16.2440 -16.2025 -16.2025 -14.5514 -14.5514 -14.4717 -14.4717 -14.4536 -14.4536 -14.4325 -14.4325 -0.7319 -0.7319 0.8113 0.8113 4.3602 4.3602 7.1031 7.1031 7.5589 7.5589 9.4249 9.4249 9.5996 9.5996 9.6654 9.6654 9.9632 9.9632 10.0536 10.0536 10.2036 10.2036 11.9386 11.9386 12.9167 12.9167 13.0622 13.0622 13.5179 13.5179 14.1693 14.1693 k = 0.0000 0.0000 0.1939 ( 3799 PWs) bands (ev): -36.9463 -36.9463 -36.9374 -36.9374 -16.2437 -16.2437 -16.2017 -16.2017 -14.5516 -14.5516 -14.4713 -14.4713 -14.4526 -14.4526 -14.4305 -14.4305 -0.7592 -0.7592 0.7905 0.7905 4.3426 4.3426 7.2375 7.2375 7.7093 7.7093 9.4196 9.4196 9.5868 9.5868 9.6458 9.6458 9.9130 9.9130 10.0444 10.0444 10.1100 10.1100 11.8377 11.8377 13.0063 13.0063 13.1385 13.1385 13.5682 13.5682 14.1499 14.1499 k = 0.0000 0.0000 0.1697 ( 3805 PWs) bands (ev): -36.9465 -36.9465 -36.9375 -36.9375 -16.2435 -16.2435 -16.2009 -16.2009 -14.5519 -14.5519 -14.4709 -14.4709 -14.4516 -14.4516 -14.4288 -14.4288 -0.7833 -0.7833 0.7721 0.7721 4.3261 4.3261 7.3666 7.3666 7.8579 7.8579 9.4148 9.4148 9.5744 9.5744 9.6278 9.6278 9.8577 9.8577 10.0042 10.0042 10.0494 10.0494 11.7451 11.7451 13.0937 13.0937 13.2128 13.2128 13.6184 13.6184 14.1310 14.1310 k = 0.0000 0.0000 0.1454 ( 3805 PWs) bands (ev): -36.9467 -36.9467 -36.9375 -36.9375 -16.2432 -16.2432 -16.2003 -16.2003 -14.5521 -14.5521 -14.4706 -14.4706 -14.4507 -14.4507 -14.4272 -14.4272 -0.8042 -0.8042 0.7562 0.7562 4.3113 4.3113 7.4883 7.4883 8.0034 8.0034 9.4106 9.4106 9.5628 9.5628 9.6112 9.6112 9.7968 9.7968 9.9172 9.9172 10.0395 10.0395 11.6623 11.6623 13.1772 13.1772 13.2840 13.2840 13.6676 13.6676 14.1132 14.1132 k = 0.0000 0.0000 0.1212 ( 3809 PWs) bands (ev): -36.9469 -36.9469 -36.9376 -36.9376 -16.2430 -16.2430 -16.1997 -16.1997 -14.5523 -14.5523 -14.4703 -14.4703 -14.4499 -14.4499 -14.4258 -14.4258 -0.8219 -0.8219 0.7427 0.7427 4.2984 4.2984 7.6003 7.6003 8.1440 8.1440 9.4070 9.4070 9.5524 9.5524 9.5956 9.5956 9.7293 9.7293 9.8341 9.8341 10.0340 10.0340 11.5905 11.5905 13.2551 13.2551 13.3504 13.3504 13.7146 13.7146 14.0971 14.0971 k = 0.0000 0.0000 0.0970 ( 3811 PWs) bands (ev): -36.9470 -36.9470 -36.9376 -36.9376 -16.2429 -16.2429 -16.1993 -16.1993 -14.5525 -14.5525 -14.4701 -14.4701 -14.4492 -14.4492 -14.4247 -14.4247 -0.8364 -0.8364 0.7317 0.7317 4.2875 4.2875 7.6997 7.6997 8.2768 8.2768 9.4041 9.4041 9.5430 9.5430 9.5805 9.5805 9.6547 9.6547 9.7638 9.7638 10.0298 10.0298 11.5308 11.5308 13.3250 13.3250 13.4103 13.4103 13.7578 13.7578 14.0830 14.0830 k = 0.0000 0.0000 0.0727 ( 3811 PWs) bands (ev): -36.9470 -36.9470 -36.9377 -36.9377 -16.2428 -16.2428 -16.1989 -16.1989 -14.5526 -14.5526 -14.4700 -14.4700 -14.4487 -14.4487 -14.4238 -14.4238 -0.8477 -0.8477 0.7231 0.7231 4.2789 4.2789 7.7830 7.7830 8.3974 8.3974 9.4018 9.4018 9.5325 9.5325 9.5632 9.5632 9.5813 9.5813 9.7103 9.7103 10.0266 10.0266 11.4838 11.4838 13.3841 13.3841 13.4612 13.4612 13.7953 13.7953 14.0716 14.0716 k = 0.0000 0.0000 0.0485 ( 3799 PWs) bands (ev): -36.9470 -36.9470 -36.9377 -36.9377 -16.2427 -16.2427 -16.1987 -16.1987 -14.5527 -14.5527 -14.4699 -14.4699 -14.4483 -14.4483 -14.4231 -14.4231 -0.8558 -0.8558 0.7170 0.7170 4.2727 4.2727 7.8464 7.8464 8.4984 8.4984 9.4001 9.4001 9.4931 9.4931 9.5376 9.5376 9.5537 9.5537 9.6740 9.6740 10.0243 10.0243 11.4501 11.4501 13.4296 13.4296 13.5005 13.5005 13.8248 13.8248 14.0631 14.0631 k = 0.0000 0.0000 0.0242 ( 3799 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5527 -14.5527 -14.4698 -14.4698 -14.4480 -14.4480 -14.4228 -14.4228 -0.8606 -0.8606 0.7133 0.7133 4.2689 4.2689 7.8864 7.8864 8.5684 8.5684 9.3990 9.3990 9.4425 9.4425 9.5314 9.5314 9.5421 9.5421 9.6539 9.6539 10.0229 10.0229 11.4297 11.4297 13.4583 13.4583 13.5255 13.5255 13.8438 13.8438 14.0579 14.0579 k = 0.0000 0.0000 0.0000 ( 3803 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5528 -14.5528 -14.4698 -14.4698 -14.4480 -14.4480 -14.4226 -14.4226 -0.8622 -0.8622 0.7121 0.7121 4.2677 4.2677 7.9000 7.9000 8.5940 8.5940 9.3984 9.3984 9.4229 9.4229 9.5295 9.5295 9.5380 9.5380 9.6475 9.6475 10.0225 10.0225 11.4229 11.4229 13.4682 13.4682 13.5340 13.5340 13.8504 13.8504 14.0561 14.0561 k = 0.0000 0.0000 0.0000 ( 3803 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5528 -14.5528 -14.4698 -14.4698 -14.4480 -14.4480 -14.4226 -14.4226 -0.8622 -0.8622 0.7121 0.7121 4.2677 4.2677 7.9000 7.9000 8.5940 8.5940 9.3984 9.3984 9.4229 9.4229 9.5295 9.5295 9.5380 9.5380 9.6475 9.6475 10.0225 10.0225 11.4229 11.4229 13.4682 13.4682 13.5340 13.5340 13.8504 13.8504 14.0561 14.0561 k =-0.0238 0.0060 0.0000 ( 3803 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2426 -16.2426 -16.1985 -16.1985 -14.5527 -14.5527 -14.4699 -14.4699 -14.4480 -14.4480 -14.4227 -14.4227 -0.8610 -0.8610 0.7093 0.7093 4.2717 4.2717 7.9008 7.9008 8.5944 8.5944 9.3412 9.3412 9.3909 9.3909 9.5416 9.5416 9.6084 9.6084 9.6539 9.6539 10.0202 10.0202 11.4214 11.4214 13.4681 13.4681 13.5345 13.5345 13.8508 13.8508 14.0604 14.0604 k =-0.0476 0.0120 0.0000 ( 3809 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2425 -16.2425 -16.1986 -16.1986 -14.5525 -14.5525 -14.4700 -14.4700 -14.4479 -14.4479 -14.4227 -14.4227 -0.8574 -0.8574 0.7011 0.7011 4.2836 4.2836 7.9030 7.9030 8.5954 8.5954 9.2219 9.2219 9.3704 9.3704 9.5563 9.5563 9.6510 9.6510 9.7343 9.7343 10.0143 10.0143 11.4168 11.4168 13.4678 13.4678 13.5359 13.5359 13.8520 13.8520 14.0735 14.0735 k =-0.0714 0.0179 0.0000 ( 3807 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2424 -16.2424 -16.1987 -16.1987 -14.5523 -14.5523 -14.4702 -14.4702 -14.4479 -14.4479 -14.4229 -14.4229 -0.8515 -0.8515 0.6876 0.6876 4.3033 4.3033 7.9068 7.9068 8.5971 8.5971 9.0988 9.0988 9.3443 9.3443 9.5699 9.5699 9.6681 9.6681 9.8440 9.8440 10.0099 10.0099 11.4095 11.4095 13.4672 13.4672 13.5385 13.5385 13.8540 13.8540 14.0955 14.0955 k =-0.0952 0.0239 0.0000 ( 3811 PWs) bands (ev): -36.9471 -36.9471 -36.9378 -36.9378 -16.2422 -16.2422 -16.1989 -16.1989 -14.5519 -14.5519 -14.4705 -14.4705 -14.4478 -14.4478 -14.4231 -14.4231 -0.8432 -0.8432 0.6692 0.6692 4.3304 4.3304 7.9119 7.9119 8.5994 8.5994 8.9753 8.9753 9.3160 9.3160 9.5779 9.5779 9.6929 9.6929 9.9190 9.9190 10.0361 10.0361 11.4002 11.4002 13.4662 13.4662 13.5421 13.5421 13.8566 13.8566 14.1264 14.1264 k =-0.1190 0.0299 0.0000 ( 3803 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2420 -16.2420 -16.1991 -16.1991 -14.5514 -14.5514 -14.4708 -14.4708 -14.4477 -14.4477 -14.4234 -14.4234 -0.8326 -0.8326 0.6461 0.6461 4.3643 4.3643 7.9184 7.9184 8.6019 8.6019 8.8526 8.8526 9.2874 9.2874 9.5804 9.5804 9.7244 9.7244 9.9237 9.9237 10.1265 10.1265 11.3898 11.3898 13.4648 13.4648 13.5470 13.5470 13.8597 13.8597 14.1659 14.1659 k =-0.1429 0.0359 0.0000 ( 3801 PWs) bands (ev): -36.9471 -36.9471 -36.9377 -36.9377 -16.2417 -16.2417 -16.1993 -16.1993 -14.5508 -14.5508 -14.4713 -14.4713 -14.4476 -14.4476 -14.4237 -14.4237 -0.8198 -0.8198 0.6188 0.6188 4.4047 4.4047 7.9260 7.9260 8.6037 8.6037 8.7322 8.7322 9.2593 9.2593 9.5792 9.5792 9.7599 9.7599 9.9027 9.9027 10.2360 10.2360 11.3798 11.3798 13.4629 13.4629 13.5530 13.5530 13.8632 13.8632 14.1377 14.1377 k =-0.1667 0.0419 0.0000 ( 3801 PWs) bands (ev): -36.9471 -36.9471 -36.9378 -36.9378 -16.2414 -16.2414 -16.1996 -16.1996 -14.5501 -14.5501 -14.4718 -14.4718 -14.4475 -14.4475 -14.4240 -14.4240 -0.8050 -0.8050 0.5879 0.5879 4.4507 4.4507 7.9347 7.9347 8.5867 8.5867 8.6326 8.6326 9.2321 9.2321 9.5758 9.5758 9.7976 9.7976 9.8742 9.8742 10.3455 10.3455 11.3719 11.3719 13.4605 13.4605 13.5602 13.5602 13.8665 13.8665 14.0452 14.0452 k =-0.1905 0.0478 0.0000 ( 3801 PWs) bands (ev): -36.9470 -36.9470 -36.9378 -36.9378 -16.2411 -16.2411 -16.1999 -16.1999 -14.5494 -14.5494 -14.4724 -14.4724 -14.4474 -14.4474 -14.4244 -14.4244 -0.7882 -0.7882 0.5539 0.5539 4.5015 4.5015 7.9443 7.9443 8.4844 8.4844 8.6210 8.6210 9.2063 9.2063 9.5709 9.5709 9.8364 9.8364 9.8420 9.8420 10.4501 10.4501 11.3685 11.3685 13.4577 13.4577 13.5683 13.5683 13.8677 13.8677 13.9575 13.9575 k =-0.2143 0.0538 0.0000 ( 3797 PWs) bands (ev): -36.9470 -36.9470 -36.9378 -36.9378 -16.2407 -16.2407 -16.2003 -16.2003 -14.5486 -14.5486 -14.4730 -14.4730 -14.4472 -14.4472 -14.4248 -14.4248 -0.7696 -0.7696 0.5175 0.5175 4.5565 4.5565 7.9542 7.9542 8.3702 8.3702 8.6243 8.6243 9.1819 9.1819 9.5650 9.5650 9.8077 9.8077 9.8753 9.8753 10.5461 10.5461 11.3727 11.3727 13.4547 13.4547 13.5772 13.5772 13.8459 13.8459 13.8963 13.8963 k =-0.2381 0.0598 0.0000 ( 3801 PWs) bands (ev): -36.9470 -36.9470 -36.9378 -36.9378 -16.2403 -16.2403 -16.2006 -16.2006 -14.5477 -14.5477 -14.4736 -14.4736 -14.4471 -14.4471 -14.4252 -14.4252 -0.7495 -0.7495 0.4791 0.4791 4.6145 4.6145 7.9641 7.9641 8.2588 8.2588 8.6291 8.6291 9.1591 9.1591 9.5584 9.5584 9.7725 9.7725 9.9138 9.9138 10.6299 10.6299 11.3882 11.3882 13.4515 13.4515 13.5865 13.5865 13.7739 13.7739 13.8896 13.8896 k =-0.2619 0.0658 0.0000 ( 3803 PWs) bands (ev): -36.9470 -36.9470 -36.9379 -36.9379 -16.2399 -16.2399 -16.2010 -16.2010 -14.5468 -14.5468 -14.4743 -14.4743 -14.4470 -14.4470 -14.4256 -14.4256 -0.7280 -0.7280 0.4396 0.4396 4.6747 4.6747 7.9719 7.9719 8.1532 8.1532 8.6344 8.6344 9.1380 9.1380 9.5514 9.5514 9.7374 9.7374 9.9513 9.9513 10.6981 10.6981 11.4185 11.4185 13.4481 13.4481 13.5953 13.5953 13.6979 13.6979 13.8925 13.8925 k =-0.2857 0.0718 0.0000 ( 3802 PWs) bands (ev): -36.9469 -36.9469 -36.9379 -36.9379 -16.2395 -16.2395 -16.2014 -16.2014 -14.5459 -14.5459 -14.4750 -14.4750 -14.4468 -14.4468 -14.4260 -14.4260 -0.7054 -0.7054 0.3997 0.3997 4.7359 4.7359 7.9688 7.9688 8.0633 8.0633 8.6398 8.6398 9.1188 9.1188 9.5442 9.5442 9.7030 9.7030 9.9873 9.9873 10.7488 10.7488 11.4653 11.4653 13.4448 13.4448 13.5962 13.5962 13.6339 13.6339 13.8965 13.8965 k =-0.3095 0.0777 0.0000 ( 3794 PWs) bands (ev): -36.9469 -36.9469 -36.9379 -36.9379 -16.2392 -16.2392 -16.2017 -16.2017 -14.5451 -14.5451 -14.4757 -14.4757 -14.4467 -14.4467 -14.4264 -14.4264 -0.6822 -0.6822 0.3599 0.3599 4.7968 4.7968 7.9178 7.9178 8.0266 8.0266 8.6452 8.6452 9.1014 9.1014 9.5369 9.5369 9.6702 9.6702 10.0214 10.0214 10.7824 10.7824 11.5278 11.5278 13.4416 13.4416 13.5483 13.5483 13.6239 13.6239 13.9008 13.9008 k =-0.3333 0.0837 0.0000 ( 3794 PWs) bands (ev): -36.9469 -36.9469 -36.9379 -36.9379 -16.2388 -16.2388 -16.2021 -16.2021 -14.5442 -14.5442 -14.4764 -14.4764 -14.4465 -14.4465 -14.4267 -14.4267 -0.6589 -0.6589 0.3212 0.3212 4.8562 4.8562 7.8349 7.8349 8.0281 8.0281 8.6504 8.6504 9.0859 9.0859 9.5296 9.5296 9.6397 9.6397 10.0530 10.0530 10.8021 10.8021 11.6022 11.6022 13.4386 13.4386 13.4886 13.4886 13.6318 13.6318 13.9048 13.9048 k =-0.3571 0.0897 0.0000 ( 3800 PWs) bands (ev): -36.9469 -36.9469 -36.9379 -36.9379 -16.2384 -16.2384 -16.2024 -16.2024 -14.5434 -14.5434 -14.4770 -14.4770 -14.4464 -14.4464 -14.4271 -14.4271 -0.6360 -0.6360 0.2845 0.2845 4.9126 4.9126 7.7528 7.7528 8.0359 8.0359 8.6552 8.6552 9.0724 9.0724 9.5226 9.5226 9.6123 9.6123 10.0816 10.0816 10.8118 10.8118 11.6834 11.6834 13.4323 13.4323 13.4375 13.4375 13.6407 13.6407 13.9086 13.9086 k =-0.3810 0.0957 0.0000 ( 3800 PWs) bands (ev): -36.9469 -36.9469 -36.9379 -36.9379 -16.2381 -16.2381 -16.2027 -16.2027 -14.5427 -14.5427 -14.4776 -14.4776 -14.4463 -14.4463 -14.4274 -14.4274 -0.6142 -0.6142 0.2505 0.2505 4.9643 4.9643 7.6784 7.6784 8.0444 8.0444 8.6596 8.6596 9.0610 9.0610 9.5157 9.5157 9.5885 9.5885 10.1068 10.1068 10.8151 10.8151 11.7660 11.7660 13.3863 13.3863 13.4336 13.4336 13.6490 13.6490 13.9117 13.9117 k =-0.4048 0.1017 0.0000 ( 3804 PWs) bands (ev): -36.9469 -36.9469 -36.9380 -36.9380 -16.2379 -16.2379 -16.2030 -16.2030 -14.5421 -14.5421 -14.4781 -14.4781 -14.4462 -14.4462 -14.4277 -14.4277 -0.5944 -0.5944 0.2205 0.2205 5.0098 5.0098 7.6141 7.6141 8.0523 8.0523 8.6634 8.6634 9.0515 9.0515 9.5092 9.5092 9.5689 9.5689 10.1281 10.1281 10.8148 10.8148 11.8448 11.8448 13.3466 13.3466 13.4315 13.4315 13.6565 13.6565 13.9114 13.9114 k =-0.4286 0.1076 0.0000 ( 3784 PWs) bands (ev): -36.9468 -36.9468 -36.9379 -36.9379 -16.2376 -16.2376 -16.2032 -16.2032 -14.5416 -14.5416 -14.4785 -14.4785 -14.4461 -14.4461 -14.4279 -14.4279 -0.5775 -0.5775 0.1955 0.1955 5.0475 5.0475 7.5618 7.5618 8.0590 8.0590 8.6665 8.6665 9.0441 9.0441 9.5032 9.5032 9.5540 9.5540 10.1452 10.1452 10.8129 10.8129 11.9144 11.9144 13.3152 13.3152 13.4298 13.4298 13.6626 13.6626 13.8427 13.8427 k =-0.4524 0.1136 0.0000 ( 3770 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2375 -16.2375 -16.2033 -16.2033 -14.5412 -14.5412 -14.4788 -14.4788 -14.4461 -14.4461 -14.4280 -14.4280 -0.5645 -0.5645 0.1766 0.1766 5.0756 5.0756 7.5232 7.5232 8.0640 8.0640 8.6687 8.6687 9.0389 9.0389 9.4981 9.4981 9.5438 9.5438 10.1577 10.1577 10.8107 10.8107 11.9694 11.9694 13.2925 13.2925 13.4286 13.4286 13.6674 13.6674 13.7793 13.7793 k =-0.4762 0.1196 0.0000 ( 3770 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2374 -16.2374 -16.2034 -16.2034 -14.5409 -14.5409 -14.4790 -14.4790 -14.4460 -14.4460 -14.4281 -14.4281 -0.5562 -0.5562 0.1648 0.1648 5.0931 5.0931 7.4994 7.4994 8.0671 8.0671 8.6701 8.6701 9.0357 9.0357 9.4947 9.4947 9.5380 9.5380 10.1652 10.1652 10.8091 10.8091 12.0050 12.0050 13.2787 13.2787 13.4278 13.4278 13.6706 13.6706 13.7385 13.7385 k =-0.5000 0.1256 0.0000 ( 3762 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2373 -16.2373 -16.2035 -16.2035 -14.5409 -14.5409 -14.4791 -14.4791 -14.4460 -14.4460 -14.4281 -14.4281 -0.5534 -0.5534 0.1608 0.1608 5.0990 5.0990 7.4914 7.4914 8.0681 8.0681 8.6706 8.6706 9.0346 9.0346 9.4934 9.4934 9.5361 9.5361 10.1678 10.1678 10.8085 10.8085 12.0173 12.0173 13.2741 13.2741 13.4275 13.4275 13.6718 13.6718 13.7243 13.7243 k =-0.5000 0.1256 0.0000 ( 3762 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2373 -16.2373 -16.2035 -16.2035 -14.5409 -14.5409 -14.4791 -14.4791 -14.4460 -14.4460 -14.4281 -14.4281 -0.5534 -0.5534 0.1608 0.1608 5.0990 5.0990 7.4914 7.4914 8.0681 8.0681 8.6706 8.6706 9.0346 9.0346 9.4934 9.4934 9.5361 9.5361 10.1678 10.1678 10.8085 10.8085 12.0173 12.0173 13.2741 13.2741 13.4275 13.4275 13.6718 13.6718 13.7243 13.7243 k =-0.4941 0.1489-0.0000 ( 3776 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2374 -16.2374 -16.2035 -16.2035 -14.5409 -14.5409 -14.4792 -14.4792 -14.4461 -14.4461 -14.4282 -14.4282 -0.5525 -0.5525 0.1622 0.1622 5.1005 5.1005 7.4903 7.4903 8.0540 8.0540 8.6702 8.6702 9.0393 9.0393 9.4945 9.4945 9.5373 9.5373 10.1615 10.1615 10.8212 10.8212 12.0222 12.0222 13.2540 13.2540 13.4071 13.4071 13.6926 13.6926 13.7397 13.7397 k =-0.4883 0.1722-0.0000 ( 3780 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2375 -16.2375 -16.2037 -16.2037 -14.5410 -14.5410 -14.4795 -14.4795 -14.4463 -14.4463 -14.4282 -14.4282 -0.5497 -0.5497 0.1664 0.1664 5.1048 5.1048 7.4871 7.4871 8.0132 8.0132 8.6691 8.6691 9.0519 9.0519 9.4979 9.4979 9.5408 9.5408 10.1448 10.1448 10.8572 10.8572 12.0369 12.0369 13.2010 13.2010 13.3592 13.3592 13.7413 13.7413 13.7782 13.7782 k =-0.4824 0.1955-0.0000 ( 3788 PWs) bands (ev): -36.9467 -36.9467 -36.9378 -36.9378 -16.2377 -16.2377 -16.2039 -16.2039 -14.5411 -14.5411 -14.4800 -14.4800 -14.4467 -14.4467 -14.4282 -14.4282 -0.5451 -0.5451 0.1735 0.1735 5.1120 5.1120 7.4815 7.4815 7.9492 7.9492 8.6673 8.6673 9.0683 9.0683 9.5035 9.5035 9.5465 9.5465 10.1234 10.1234 10.9115 10.9115 12.0612 12.0612 13.1277 13.1277 13.3001 13.3001 13.7897 13.7897 13.8252 13.8252 k =-0.4766 0.2188-0.0000 ( 3792 PWs) bands (ev): -36.9467 -36.9467 -36.9377 -36.9377 -16.2379 -16.2379 -16.2042 -16.2042 -14.5412 -14.5412 -14.4808 -14.4808 -14.4473 -14.4473 -14.4283 -14.4283 -0.5386 -0.5386 0.1833 0.1833 5.1221 5.1221 7.4736 7.4736 7.8664 7.8664 8.6647 8.6647 9.0839 9.0839 9.5112 9.5112 9.5545 9.5545 10.1033 10.1033 10.9792 10.9792 12.0950 12.0950 13.0430 13.0430 13.2374 13.2374 13.7491 13.7491 13.8656 13.8656 k =-0.4707 0.2422-0.0000 ( 3782 PWs) bands (ev): -36.9466 -36.9466 -36.9376 -36.9376 -16.2382 -16.2382 -16.2047 -16.2047 -14.5415 -14.5415 -14.4817 -14.4817 -14.4479 -14.4479 -14.4283 -14.4283 -0.5303 -0.5303 0.1960 0.1960 5.1350 5.1350 7.4631 7.4631 7.7687 7.7687 8.6614 8.6614 9.0944 9.0944 9.5210 9.5210 9.5647 9.5647 10.0892 10.0892 11.0560 11.0560 12.1379 12.1379 12.9517 12.9517 13.1739 13.1739 13.6777 13.6777 13.8923 13.8923 k =-0.4649 0.2655-0.0000 ( 3786 PWs) bands (ev): -36.9465 -36.9465 -36.9375 -36.9375 -16.2386 -16.2386 -16.2052 -16.2052 -14.5417 -14.5417 -14.4829 -14.4829 -14.4488 -14.4488 -14.4284 -14.4284 -0.5203 -0.5203 0.2114 0.2114 5.1508 5.1508 7.4499 7.4499 7.6593 7.6593 8.6573 8.6573 9.0970 9.0970 9.5329 9.5329 9.5770 9.5770 10.0842 10.0842 11.1391 11.1391 12.1895 12.1895 12.8565 12.8565 13.1110 13.1110 13.5994 13.5994 13.8943 13.8943 k =-0.4590 0.2888-0.0000 ( 3786 PWs) bands (ev): -36.9463 -36.9463 -36.9374 -36.9374 -16.2391 -16.2391 -16.2058 -16.2058 -14.5421 -14.5421 -14.4843 -14.4843 -14.4497 -14.4497 -14.4284 -14.4284 -0.5085 -0.5085 0.2297 0.2297 5.1694 5.1694 7.4337 7.4337 7.5408 7.5408 8.6525 8.6525 9.0910 9.0910 9.5468 9.5468 9.5914 9.5914 10.0895 10.0895 11.2264 11.2264 12.2494 12.2494 12.7591 12.7591 13.0496 13.0496 13.5177 13.5177 13.8666 13.8666 k =-0.4532 0.3121-0.0000 ( 3794 PWs) bands (ev): -36.9462 -36.9462 -36.9373 -36.9373 -16.2396 -16.2396 -16.2065 -16.2065 -14.5425 -14.5425 -14.4859 -14.4859 -14.4507 -14.4507 -14.4285 -14.4285 -0.4951 -0.4951 0.2507 0.2507 5.1908 5.1908 7.4141 7.4141 7.4151 7.4151 8.6470 8.6470 9.0770 9.0770 9.5626 9.5626 9.6079 9.6079 10.1049 10.1049 11.3165 11.3165 12.3171 12.3171 12.6605 12.6605 12.9901 12.9901 13.4340 13.4340 13.8108 13.8108 k =-0.4473 0.3354-0.0000 ( 3798 PWs) bands (ev): -36.9461 -36.9461 -36.9372 -36.9372 -16.2402 -16.2402 -16.2073 -16.2073 -14.5430 -14.5430 -14.4878 -14.4878 -14.4518 -14.4518 -14.4284 -14.4284 -0.4800 -0.4800 0.2745 0.2745 5.2149 5.2149 7.2831 7.2831 7.3914 7.3914 8.6407 8.6407 9.0566 9.0566 9.5797 9.5797 9.6266 9.6266 10.1289 10.1289 11.4084 11.4084 12.3917 12.3917 12.5615 12.5615 12.9329 12.9329 13.3496 13.3496 13.7333 13.7333 k =-0.4414 0.3587-0.0000 ( 3802 PWs) bands (ev): -36.9459 -36.9459 -36.9370 -36.9370 -16.2409 -16.2409 -16.2081 -16.2081 -14.5436 -14.5436 -14.4898 -14.4898 -14.4530 -14.4530 -14.4284 -14.4284 -0.4633 -0.4633 0.3011 0.3011 5.2417 5.2417 7.1467 7.1467 7.3650 7.3650 8.6337 8.6337 9.0323 9.0323 9.5977 9.5977 9.6476 9.6476 10.1599 10.1599 11.5015 11.5015 12.4609 12.4609 12.4744 12.4744 12.8782 12.8782 13.2652 13.2652 13.6415 13.6415 k =-0.4356 0.3820-0.0000 ( 3802 PWs) bands (ev): -36.9457 -36.9457 -36.9368 -36.9368 -16.2416 -16.2416 -16.2091 -16.2091 -14.5442 -14.5442 -14.4921 -14.4921 -14.4542 -14.4542 -14.4283 -14.4283 -0.4452 -0.4452 0.3305 0.3305 5.2711 5.2711 7.0064 7.0064 7.3349 7.3349 8.6259 8.6259 9.0062 9.0062 9.6158 9.6158 9.6710 9.6710 10.1962 10.1962 11.5952 11.5952 12.3641 12.3641 12.5597 12.5597 12.8265 12.8265 13.1816 13.1816 13.5414 13.5414 k =-0.4297 0.4054-0.0000 ( 3798 PWs) bands (ev): -36.9455 -36.9455 -36.9366 -36.9366 -16.2423 -16.2423 -16.2101 -16.2101 -14.5450 -14.5450 -14.4945 -14.4945 -14.4555 -14.4555 -14.4281 -14.4281 -0.4256 -0.4256 0.3626 0.3626 5.3032 5.3032 6.8630 6.8630 7.3010 7.3010 8.6175 8.6175 8.9802 8.9802 9.6333 9.6333 9.6972 9.6972 10.2364 10.2364 11.6888 11.6888 12.2673 12.2673 12.6495 12.6495 12.7793 12.7793 13.0994 13.0994 13.4372 13.4372 k =-0.4239 0.4287-0.0000 ( 3798 PWs) bands (ev): -36.9453 -36.9453 -36.9364 -36.9364 -16.2431 -16.2431 -16.2111 -16.2111 -14.5459 -14.5459 -14.4971 -14.4971 -14.4568 -14.4568 -14.4279 -14.4279 -0.4047 -0.4047 0.3975 0.3975 5.3379 5.3379 6.7171 6.7171 7.2634 7.2634 8.6083 8.6083 8.9560 8.9560 9.6493 9.6493 9.7261 9.7261 10.2794 10.2794 11.7815 11.7815 12.1732 12.1732 12.7113 12.7113 12.7669 12.7669 13.0193 13.0193 13.3319 13.3319 k =-0.4180 0.4520-0.0000 ( 3800 PWs) bands (ev): -36.9451 -36.9451 -36.9362 -36.9362 -16.2440 -16.2440 -16.2123 -16.2123 -14.5469 -14.5469 -14.4999 -14.4999 -14.4580 -14.4580 -14.4277 -14.4277 -0.3825 -0.3825 0.4352 0.4352 5.3750 5.3750 6.5693 6.5693 7.2223 7.2223 8.5985 8.5985 8.9346 8.9346 9.6632 9.6632 9.7578 9.7578 10.3244 10.3244 11.8699 11.8699 12.0854 12.0854 12.6790 12.6790 12.8509 12.8509 12.9456 12.9456 13.2278 13.2278 k =-0.4122 0.4753-0.0000 ( 3800 PWs) bands (ev): -36.9448 -36.9448 -36.9360 -36.9360 -16.2449 -16.2449 -16.2135 -16.2135 -14.5480 -14.5480 -14.5029 -14.5029 -14.4593 -14.4593 -14.4274 -14.4274 -0.3592 -0.3592 0.4755 0.4755 5.4146 5.4146 6.4200 6.4200 7.1779 7.1779 8.5880 8.5880 8.9168 8.9168 9.6742 9.6742 9.7921 9.7921 10.3707 10.3707 11.9241 11.9241 12.0343 12.0343 12.6389 12.6389 12.8536 12.8536 12.9683 12.9683 13.1274 13.1274 k =-0.4063 0.4986-0.0000 ( 3798 PWs) bands (ev): -36.9446 -36.9446 -36.9357 -36.9357 -16.2459 -16.2459 -16.2147 -16.2147 -14.5492 -14.5492 -14.5060 -14.5060 -14.4605 -14.4605 -14.4270 -14.4270 -0.3348 -0.3348 0.5186 0.5186 5.4565 5.4565 6.2697 6.2697 7.1306 7.1306 8.5770 8.5770 8.9031 8.9031 9.6816 9.6816 9.8288 9.8288 10.4179 10.4179 11.8727 11.8727 12.0915 12.0915 12.6004 12.6004 12.7832 12.7832 13.0194 13.0194 13.0821 13.0821 k =-0.4005 0.5219-0.0000 ( 3798 PWs) bands (ev): -36.9443 -36.9443 -36.9354 -36.9354 -16.2468 -16.2468 -16.2160 -16.2160 -14.5506 -14.5506 -14.5092 -14.5092 -14.4616 -14.4616 -14.4267 -14.4267 -0.3094 -0.3094 0.5644 0.5644 5.5007 5.5007 6.1185 6.1185 7.0807 7.0807 8.5653 8.5653 8.8936 8.8936 9.6845 9.6845 9.8679 9.8679 10.4658 10.4658 11.7929 11.7929 12.1805 12.1805 12.5641 12.5641 12.7126 12.7126 12.9320 12.9320 13.1862 13.1862 k =-0.3946 0.5452-0.0000 ( 3798 PWs) bands (ev): -36.9441 -36.9441 -36.9352 -36.9352 -16.2478 -16.2478 -16.2173 -16.2173 -14.5521 -14.5521 -14.5125 -14.5125 -14.4626 -14.4626 -14.4262 -14.4262 -0.2832 -0.2832 0.6129 0.6129 5.5470 5.5470 5.9670 5.9670 7.0289 7.0289 8.5532 8.5532 8.8884 8.8884 9.6821 9.6821 9.9092 9.9092 10.5142 10.5142 11.7124 11.7124 12.2735 12.2735 12.5300 12.5300 12.6451 12.6451 12.8454 12.8454 13.2979 13.2979 k =-0.3887 0.5685-0.0000 ( 3794 PWs) bands (ev): -36.9438 -36.9438 -36.9349 -36.9349 -16.2489 -16.2489 -16.2187 -16.2187 -14.5537 -14.5537 -14.5159 -14.5159 -14.4636 -14.4636 -14.4257 -14.4257 -0.2563 -0.2563 0.6641 0.6641 5.5953 5.5953 5.8154 5.8154 6.9756 6.9756 8.5407 8.5407 8.8874 8.8874 9.6735 9.6735 9.9526 9.9526 10.5630 10.5630 11.6348 11.6348 12.3661 12.3661 12.4979 12.4979 12.5826 12.5826 12.7651 12.7651 13.4117 13.4117 k =-0.3829 0.5919-0.0000 ( 3794 PWs) bands (ev): -36.9435 -36.9435 -36.9347 -36.9347 -16.2499 -16.2499 -16.2201 -16.2201 -14.5554 -14.5554 -14.5193 -14.5193 -14.4645 -14.4645 -14.4252 -14.4252 -0.2288 -0.2288 0.7179 0.7179 5.6426 5.6426 5.6667 5.6667 6.9213 6.9213 8.5277 8.5277 8.8904 8.8904 9.6579 9.6579 9.9978 9.9978 10.6119 10.6119 11.5613 11.5613 12.4462 12.4462 12.4671 12.4671 12.5371 12.5371 12.6919 12.6919 13.5267 13.5267 k =-0.3770 0.6152-0.0000 ( 3798 PWs) bands (ev): -36.9432 -36.9432 -36.9344 -36.9344 -16.2510 -16.2510 -16.2215 -16.2215 -14.5572 -14.5572 -14.5228 -14.5228 -14.4653 -14.4653 -14.4247 -14.4247 -0.2008 -0.2008 0.7744 0.7744 5.5116 5.5116 5.6985 5.6985 6.8666 6.8666 8.5145 8.5145 8.8972 8.8972 9.6348 9.6348 10.0448 10.0448 10.6611 10.6611 11.4923 11.4923 12.4312 12.4312 12.4480 12.4480 12.5807 12.5807 12.6267 12.6267 13.6420 13.6420 k =-0.3712 0.6385-0.0000 ( 3794 PWs) bands (ev): -36.9429 -36.9429 -36.9342 -36.9342 -16.2521 -16.2521 -16.2229 -16.2229 -14.5590 -14.5590 -14.5263 -14.5263 -14.4660 -14.4660 -14.4241 -14.4241 -0.1726 -0.1726 0.8336 0.8336 5.3609 5.3609 5.7521 5.7521 6.8120 6.8120 8.5010 8.5010 8.9076 8.9076 9.6037 9.6037 10.0935 10.0935 10.7103 10.7103 11.4278 11.4278 12.3850 12.3850 12.4182 12.4182 12.5694 12.5694 12.6720 12.6720 13.7570 13.7570 k =-0.3653 0.6618-0.0000 ( 3800 PWs) bands (ev): -36.9427 -36.9427 -36.9339 -36.9339 -16.2532 -16.2532 -16.2243 -16.2243 -14.5610 -14.5610 -14.5298 -14.5298 -14.4666 -14.4666 -14.4236 -14.4236 -0.1441 -0.1441 0.8954 0.8954 5.2108 5.2108 5.8073 5.8073 6.7579 6.7579 8.4874 8.4874 8.9212 8.9212 9.5645 9.5645 10.1436 10.1436 10.7596 10.7596 11.3678 11.3678 12.3357 12.3357 12.3915 12.3915 12.5211 12.5211 12.7681 12.7681 13.8706 13.8706 k =-0.3595 0.6851-0.0000 ( 3792 PWs) bands (ev): -36.9424 -36.9424 -36.9336 -36.9336 -16.2542 -16.2542 -16.2258 -16.2258 -14.5630 -14.5630 -14.5332 -14.5332 -14.4671 -14.4671 -14.4230 -14.4230 -0.1156 -0.1156 0.9598 0.9598 5.0615 5.0615 5.8638 5.8638 6.7049 6.7049 8.4737 8.4737 8.9378 8.9378 9.5175 9.5175 10.1950 10.1950 10.8088 10.8088 11.3119 11.3119 12.2887 12.2887 12.3662 12.3662 12.4816 12.4816 12.8653 12.8653 13.9809 13.9809 k =-0.3536 0.7084-0.0000 ( 3792 PWs) bands (ev): -36.9421 -36.9421 -36.9334 -36.9334 -16.2553 -16.2553 -16.2272 -16.2272 -14.5650 -14.5650 -14.5366 -14.5366 -14.4676 -14.4676 -14.4223 -14.4223 -0.0873 -0.0873 1.0268 1.0268 4.9132 4.9132 5.9213 5.9213 6.6534 6.6534 8.4600 8.4600 8.9571 8.9571 9.4632 9.4632 10.2474 10.2474 10.8580 10.8580 11.2596 11.2596 12.2452 12.2452 12.3411 12.3411 12.4507 12.4507 12.9628 12.9628 14.0844 14.0844 k =-0.3478 0.7317-0.0000 ( 3792 PWs) bands (ev): -36.9419 -36.9419 -36.9331 -36.9331 -16.2564 -16.2564 -16.2285 -16.2285 -14.5670 -14.5670 -14.5400 -14.5400 -14.4680 -14.4680 -14.4217 -14.4217 -0.0592 -0.0592 1.0965 1.0965 4.7662 4.7662 5.9796 5.9796 6.6037 6.6037 8.4465 8.4465 8.9789 8.9789 9.4023 9.4023 10.3007 10.3007 10.9070 10.9070 11.2104 11.2104 12.2057 12.2057 12.3157 12.3157 12.4281 12.4281 13.0599 13.0599 14.1712 14.1712 k =-0.3419 0.7551-0.0000 ( 3800 PWs) bands (ev): -36.9416 -36.9416 -36.9329 -36.9329 -16.2574 -16.2574 -16.2299 -16.2299 -14.5690 -14.5690 -14.5433 -14.5433 -14.4683 -14.4683 -14.4211 -14.4211 -0.0316 -0.0316 1.1687 1.1687 4.6204 4.6204 6.0383 6.0383 6.5562 6.5562 8.4332 8.4332 9.0029 9.0029 9.3360 9.3360 10.3546 10.3546 10.9558 10.9558 11.1637 11.1637 12.1708 12.1708 12.2893 12.2893 12.4130 12.4130 13.1556 13.1556 14.2089 14.2089 k =-0.3360 0.7784-0.0000 ( 3794 PWs) bands (ev): -36.9414 -36.9414 -36.9326 -36.9326 -16.2584 -16.2584 -16.2312 -16.2312 -14.5710 -14.5710 -14.5464 -14.5464 -14.4685 -14.4685 -14.4205 -14.4205 -0.0045 -0.0045 1.2435 1.2435 4.4761 4.4761 6.0970 6.0970 6.5113 6.5113 8.4201 8.4201 9.0290 9.0290 9.2654 9.2654 10.4089 10.4089 11.0041 11.0041 11.1192 11.1192 12.1407 12.1407 12.2614 12.2614 12.4047 12.4047 13.2490 13.2490 14.1724 14.1724 k =-0.3302 0.8017-0.0000 ( 3796 PWs) bands (ev): -36.9411 -36.9411 -36.9324 -36.9324 -16.2594 -16.2594 -16.2325 -16.2325 -14.5730 -14.5730 -14.5495 -14.5495 -14.4687 -14.4687 -14.4199 -14.4199 0.0217 0.0217 1.3208 1.3208 4.3334 4.3334 6.1554 6.1554 6.4692 6.4692 8.4075 8.4075 9.0569 9.0569 9.1917 9.1917 10.4631 10.4631 11.0507 11.0507 11.0774 11.0774 12.1158 12.1158 12.2312 12.2312 12.4018 12.4018 13.3379 13.3379 14.1185 14.1185 k =-0.3243 0.8250-0.0000 ( 3792 PWs) bands (ev): -36.9409 -36.9409 -36.9322 -36.9322 -16.2603 -16.2603 -16.2337 -16.2337 -14.5749 -14.5749 -14.5524 -14.5524 -14.4688 -14.4688 -14.4193 -14.4193 0.0471 0.0471 1.4007 1.4007 4.1924 4.1924 6.2127 6.2127 6.4303 6.4303 8.3953 8.3953 9.0861 9.0861 9.1167 9.1167 10.5170 10.5170 11.0335 11.0335 11.1002 11.1002 12.0962 12.0962 12.1982 12.1982 12.4031 12.4031 13.4191 13.4191 14.0645 14.0645 k =-0.3185 0.8483-0.0000 ( 3796 PWs) bands (ev): -36.9407 -36.9407 -36.9320 -36.9320 -16.2612 -16.2612 -16.2348 -16.2348 -14.5767 -14.5767 -14.5551 -14.5551 -14.4689 -14.4689 -14.4187 -14.4187 0.0713 0.0713 1.4831 1.4831 4.0533 4.0533 6.2684 6.2684 6.3950 6.3950 8.3836 8.3836 9.0403 9.0403 9.1179 9.1179 10.5703 10.5703 10.9935 10.9935 11.1462 11.1462 12.0821 12.0821 12.1621 12.1621 12.4072 12.4072 13.4862 13.4862 14.0186 14.0186 k =-0.3126 0.8716-0.0000 ( 3800 PWs) bands (ev): -36.9405 -36.9405 -36.9318 -36.9318 -16.2621 -16.2621 -16.2359 -16.2359 -14.5785 -14.5785 -14.5577 -14.5577 -14.4690 -14.4690 -14.4182 -14.4182 0.0943 0.0943 1.5680 1.5680 3.9160 3.9160 6.3210 6.3210 6.3641 6.3641 8.3726 8.3726 8.9658 8.9658 9.1502 9.1502 10.6225 10.6225 10.9545 10.9545 11.1912 11.1912 12.0733 12.0733 12.1228 12.1228 12.4124 12.4124 13.5295 13.5295 13.9908 13.9908 k =-0.3068 0.8949-0.0000 ( 3796 PWs) bands (ev): -36.9403 -36.9403 -36.9316 -36.9316 -16.2629 -16.2629 -16.2369 -16.2369 -14.5801 -14.5801 -14.5601 -14.5601 -14.4691 -14.4691 -14.4177 -14.4177 0.1159 0.1159 1.6555 1.6555 3.7808 3.7808 6.3328 6.3328 6.3747 6.3747 8.3623 8.3623 8.8939 8.8939 9.1837 9.1837 10.6732 10.6732 10.9168 10.9168 11.2346 11.2346 12.0629 12.0629 12.0871 12.0871 12.4174 12.4174 13.5396 13.5396 13.9839 13.9839 k =-0.3009 0.9183-0.0000 ( 3796 PWs) bands (ev): -36.9401 -36.9401 -36.9314 -36.9314 -16.2636 -16.2636 -16.2378 -16.2378 -14.5816 -14.5816 -14.5623 -14.5623 -14.4691 -14.4691 -14.4172 -14.4172 0.1359 0.1359 1.7454 1.7454 3.6477 3.6477 6.3098 6.3098 6.4201 6.4201 8.3528 8.3528 8.8260 8.8260 9.2184 9.2184 10.7218 10.7218 10.8807 10.8807 11.2760 11.2760 12.0228 12.0228 12.0832 12.0832 12.4208 12.4208 13.5184 13.5184 13.9744 13.9744 k =-0.2951 0.9416-0.0000 ( 3800 PWs) bands (ev): -36.9400 -36.9400 -36.9313 -36.9313 -16.2643 -16.2643 -16.2387 -16.2387 -14.5830 -14.5830 -14.5643 -14.5643 -14.4691 -14.4691 -14.4167 -14.4167 0.1541 0.1541 1.8377 1.8377 3.5169 3.5169 6.2901 6.2901 6.4611 6.4611 8.3441 8.3441 8.7638 8.7638 9.2539 9.2539 10.7664 10.7664 10.8479 10.8479 11.3149 11.3149 11.9700 11.9700 12.0940 12.0940 12.4214 12.4214 13.4774 13.4774 13.9569 13.9569 k =-0.2892 0.9649-0.0000 ( 3806 PWs) bands (ev): -36.9399 -36.9399 -36.9312 -36.9312 -16.2649 -16.2649 -16.2394 -16.2394 -14.5842 -14.5842 -14.5661 -14.5661 -14.4692 -14.4692 -14.4162 -14.4162 0.1705 0.1705 1.9325 1.9325 3.3884 3.3884 6.2746 6.2746 6.4958 6.4958 8.3364 8.3364 8.7088 8.7088 9.2903 9.2903 10.7904 10.7904 10.8347 10.8347 11.3506 11.3506 11.9119 11.9119 12.1124 12.1124 12.4180 12.4180 13.4280 13.4280 13.9417 13.9417 k =-0.2833 0.9882-0.0000 ( 3814 PWs) bands (ev): -36.9398 -36.9398 -36.9311 -36.9311 -16.2655 -16.2655 -16.2400 -16.2400 -14.5853 -14.5853 -14.5676 -14.5676 -14.4692 -14.4692 -14.4158 -14.4158 0.1849 0.1849 2.0298 2.0298 3.2624 3.2624 6.2635 6.2635 6.5230 6.5230 8.3296 8.3296 8.6625 8.6625 9.3274 9.3274 10.7683 10.7683 10.8666 10.8666 11.3824 11.3824 11.8493 11.8493 12.1378 12.1378 12.4100 12.4100 13.3772 13.3772 13.9315 13.9315 k =-0.2775 1.0115-0.0000 ( 3814 PWs) bands (ev): -36.9397 -36.9397 -36.9309 -36.9309 -16.2659 -16.2659 -16.2405 -16.2405 -14.5863 -14.5863 -14.5689 -14.5689 -14.4692 -14.4692 -14.4155 -14.4155 0.1972 0.1972 2.1294 2.1294 3.1389 3.1389 6.2569 6.2569 6.5413 6.5413 8.3239 8.3239 8.6264 8.6264 9.3651 9.3651 10.7377 10.7377 10.9060 10.9060 11.4094 11.4094 11.7827 11.7827 12.1698 12.1698 12.3968 12.3968 13.3294 13.3294 13.9268 13.9268 k =-0.2716 1.0348-0.0000 ( 3810 PWs) bands (ev): -36.9396 -36.9396 -36.9309 -36.9309 -16.2663 -16.2663 -16.2409 -16.2409 -14.5871 -14.5871 -14.5699 -14.5699 -14.4693 -14.4693 -14.4151 -14.4151 0.2071 0.2071 2.2315 2.2315 3.0181 3.0181 6.2550 6.2550 6.5498 6.5498 8.3194 8.3194 8.6016 8.6016 9.4034 9.4034 10.7069 10.7069 10.9447 10.9447 11.4307 11.4307 11.7127 11.7127 12.2080 12.2080 12.3783 12.3783 13.2874 13.2874 13.9273 13.9273 k =-0.2658 1.0581-0.0000 ( 3812 PWs) bands (ev): -36.9396 -36.9396 -36.9308 -36.9308 -16.2667 -16.2667 -16.2412 -16.2412 -14.5878 -14.5878 -14.5707 -14.5707 -14.4693 -14.4693 -14.4148 -14.4148 0.2147 0.2147 2.3359 2.3359 2.9000 2.9000 6.2577 6.2577 6.5478 6.5478 8.3161 8.3161 8.5889 8.5889 9.4420 9.4420 10.6765 10.6765 10.9820 10.9820 11.4453 11.4453 11.6401 11.6401 12.2520 12.2520 12.3545 12.3545 13.2533 13.2533 13.9323 13.9323 k =-0.2658 1.0581-0.0000 ( 3812 PWs) bands (ev): -36.9396 -36.9396 -36.9308 -36.9308 -16.2667 -16.2667 -16.2412 -16.2412 -14.5878 -14.5878 -14.5707 -14.5707 -14.4693 -14.4693 -14.4148 -14.4148 0.2147 0.2147 2.3359 2.3359 2.9000 2.9000 6.2577 6.2577 6.5478 6.5478 8.3161 8.3161 8.5889 8.5889 9.4420 9.4420 10.6765 10.6765 10.9820 10.9820 11.4453 11.4453 11.6401 11.6401 12.2520 12.2520 12.3545 12.3545 13.2533 13.2533 13.9323 13.9323 k =-0.2658 1.0581 0.0242 ( 3808 PWs) bands (ev): -36.9395 -36.9395 -36.9308 -36.9308 -16.2667 -16.2667 -16.2413 -16.2413 -14.5877 -14.5877 -14.5707 -14.5707 -14.4694 -14.4694 -14.4149 -14.4149 0.2159 0.2159 2.3371 2.3371 2.9013 2.9013 6.2593 6.2593 6.5424 6.5424 8.3145 8.3145 8.5906 8.5906 9.4396 9.4396 10.6745 10.6745 10.9663 10.9663 11.4486 11.4486 11.6294 11.6294 12.2539 12.2539 12.3627 12.3627 13.2618 13.2618 13.9175 13.9175 k =-0.2658 1.0581 0.0485 ( 3804 PWs) bands (ev): -36.9395 -36.9395 -36.9307 -36.9307 -16.2668 -16.2668 -16.2414 -16.2414 -14.5876 -14.5876 -14.5707 -14.5707 -14.4697 -14.4697 -14.4153 -14.4153 0.2195 0.2195 2.3408 2.3408 2.9052 2.9052 6.2639 6.2639 6.5263 6.5263 8.3099 8.3099 8.5956 8.5956 9.4325 9.4325 10.6683 10.6683 10.9224 10.9224 11.4550 11.4550 11.5981 11.5981 12.2605 12.2605 12.3864 12.3864 13.2869 13.2869 13.8793 13.8793 k =-0.2658 1.0581 0.0727 ( 3798 PWs) bands (ev): -36.9394 -36.9394 -36.9307 -36.9307 -16.2668 -16.2668 -16.2415 -16.2415 -14.5875 -14.5875 -14.5707 -14.5707 -14.4702 -14.4702 -14.4158 -14.4158 0.2255 0.2255 2.3470 2.3470 2.9116 2.9116 6.2717 6.2717 6.4996 6.4996 8.3024 8.3024 8.6040 8.6040 9.4204 9.4204 10.6577 10.6577 10.8581 10.8581 11.4564 11.4564 11.5489 11.5489 12.2734 12.2734 12.4241 12.4241 13.3269 13.3269 13.8298 13.8298 k =-0.2658 1.0581 0.0970 ( 3796 PWs) bands (ev): -36.9393 -36.9393 -36.9307 -36.9307 -16.2670 -16.2670 -16.2418 -16.2418 -14.5873 -14.5873 -14.5707 -14.5707 -14.4709 -14.4709 -14.4166 -14.4166 0.2339 0.2339 2.3556 2.3556 2.9206 2.9206 6.2825 6.2825 6.4626 6.4626 8.2925 8.2925 8.6156 8.6156 9.4030 9.4030 10.6420 10.6420 10.7808 10.7808 11.4424 11.4424 11.4887 11.4887 12.2945 12.2945 12.4739 12.4739 13.3796 13.3796 13.7785 13.7785 k =-0.2658 1.0581 0.1212 ( 3789 PWs) bands (ev): -36.9392 -36.9392 -36.9306 -36.9306 -16.2671 -16.2671 -16.2421 -16.2421 -14.5871 -14.5871 -14.5707 -14.5707 -14.4717 -14.4717 -14.4176 -14.4176 0.2446 0.2446 2.3667 2.3667 2.9322 2.9322 6.2963 6.2963 6.4155 6.4155 8.2806 8.2806 8.6304 8.6304 9.3801 9.3801 10.6185 10.6185 10.6982 10.6982 11.3870 11.3870 11.4432 11.4432 12.3243 12.3243 12.5341 12.5341 13.4424 13.4424 13.7307 13.7307 k =-0.2658 1.0581 0.1454 ( 3785 PWs) bands (ev): -36.9391 -36.9391 -36.9305 -36.9305 -16.2673 -16.2673 -16.2425 -16.2425 -14.5868 -14.5868 -14.5707 -14.5707 -14.4727 -14.4727 -14.4188 -14.4188 0.2578 0.2578 2.3802 2.3802 2.9462 2.9462 6.3130 6.3130 6.3590 6.3590 8.2673 8.2673 8.6482 8.6482 9.3510 9.3510 10.5739 10.5739 10.6269 10.6269 11.2990 11.2990 11.4060 11.4060 12.3622 12.3622 12.6031 12.6031 13.5119 13.5119 13.6904 13.6904 k =-0.2658 1.0581 0.1697 ( 3787 PWs) bands (ev): -36.9389 -36.9389 -36.9305 -36.9305 -16.2675 -16.2675 -16.2429 -16.2429 -14.5864 -14.5864 -14.5707 -14.5707 -14.4739 -14.4739 -14.4202 -14.4202 0.2733 0.2733 2.3962 2.3962 2.9628 2.9628 6.2928 6.2928 6.3332 6.3332 8.2530 8.2530 8.6690 8.6690 9.3152 9.3152 10.4942 10.4942 10.5834 10.5834 11.1990 11.1990 11.3606 11.3606 12.4068 12.4068 12.6796 12.6796 13.5795 13.5795 13.6653 13.6653 k =-0.2658 1.0581 0.1939 ( 3785 PWs) bands (ev): -36.9388 -36.9388 -36.9304 -36.9304 -16.2678 -16.2678 -16.2434 -16.2434 -14.5861 -14.5861 -14.5707 -14.5707 -14.4752 -14.4752 -14.4217 -14.4217 0.2912 0.2912 2.4145 2.4145 2.9819 2.9819 6.2188 6.2188 6.3556 6.3556 8.2381 8.2381 8.6925 8.6925 9.2721 9.2721 10.4046 10.4046 10.5440 10.5440 11.0923 11.0923 11.3068 11.3068 12.4564 12.4564 12.7622 12.7622 13.6019 13.6019 13.6973 13.6973 k =-0.2658 1.0581 0.2182 ( 3786 PWs) bands (ev): -36.9386 -36.9386 -36.9303 -36.9303 -16.2680 -16.2680 -16.2440 -16.2440 -14.5857 -14.5857 -14.5707 -14.5707 -14.4767 -14.4767 -14.4235 -14.4235 0.3115 0.3115 2.4352 2.4352 3.0035 3.0035 6.1369 6.1369 6.3810 6.3810 8.2230 8.2230 8.7185 8.7185 9.2210 9.2210 10.3154 10.3154 10.4988 10.4988 10.9826 10.9826 11.2464 11.2464 12.5096 12.5096 12.8497 12.8497 13.5886 13.5886 13.7750 13.7750 k =-0.2658 1.0581 0.2424 ( 3788 PWs) bands (ev): -36.9384 -36.9384 -36.9302 -36.9302 -16.2683 -16.2683 -16.2446 -16.2446 -14.5853 -14.5853 -14.5707 -14.5707 -14.4783 -14.4783 -14.4254 -14.4254 0.3342 0.3342 2.4583 2.4583 3.0274 3.0274 6.0479 6.0479 6.4091 6.4091 8.2078 8.2078 8.7467 8.7467 9.1615 9.1615 10.2296 10.2296 10.4446 10.4446 10.8738 10.8738 11.1812 11.1812 12.5654 12.5654 12.9408 12.9408 13.5759 13.5759 13.8606 13.8606 k =-0.2658 1.0581 0.2667 ( 3788 PWs) bands (ev): -36.9381 -36.9381 -36.9301 -36.9301 -16.2687 -16.2687 -16.2453 -16.2453 -14.5848 -14.5848 -14.5708 -14.5708 -14.4800 -14.4800 -14.4275 -14.4275 0.3593 0.3593 2.4836 2.4836 3.0537 3.0537 5.9525 5.9525 6.4398 6.4398 8.1928 8.1928 8.7769 8.7769 9.0933 9.0933 10.1485 10.1485 10.3784 10.3784 10.7701 10.7701 11.1127 11.1127 12.6230 12.6230 13.0341 13.0341 13.5683 13.5683 13.9478 13.9478 k =-0.2658 1.0581 0.2909 ( 3788 PWs) bands (ev): -36.9379 -36.9379 -36.9300 -36.9300 -16.2690 -16.2690 -16.2461 -16.2461 -14.5844 -14.5844 -14.5708 -14.5708 -14.4817 -14.4817 -14.4297 -14.4297 0.3867 0.3867 2.5113 2.5113 3.0824 3.0824 5.8516 5.8516 6.4730 6.4730 8.1780 8.1780 8.8083 8.8083 9.0169 9.0169 10.0729 10.0729 10.2979 10.2979 10.6758 10.6758 11.0423 11.0423 12.6819 12.6819 13.1283 13.1283 13.5663 13.5663 14.0347 14.0347 k =-0.2658 1.0581 0.3151 ( 3786 PWs) bands (ev): -36.9376 -36.9376 -36.9299 -36.9299 -16.2694 -16.2694 -16.2469 -16.2469 -14.5839 -14.5839 -14.5708 -14.5708 -14.4836 -14.4836 -14.4320 -14.4320 0.4166 0.4166 2.5412 2.5412 3.1133 3.1133 5.7458 5.7458 6.5086 6.5086 8.1633 8.1633 8.8391 8.8391 8.9342 8.9342 10.0026 10.0026 10.2026 10.2026 10.5931 10.5931 10.9710 10.9710 12.7421 12.7421 13.2221 13.2221 13.5699 13.5699 14.1195 14.1195 k =-0.2658 1.0581 0.3394 ( 3784 PWs) bands (ev): -36.9373 -36.9373 -36.9298 -36.9298 -16.2698 -16.2698 -16.2477 -16.2477 -14.5834 -14.5834 -14.5709 -14.5709 -14.4855 -14.4855 -14.4345 -14.4345 0.4488 0.4488 2.5733 2.5733 3.1464 3.1464 5.6359 5.6359 6.5463 6.5463 8.1486 8.1486 8.8294 8.8294 8.8852 8.8852 9.9367 9.9367 10.0957 10.0957 10.5211 10.5211 10.8997 10.8997 12.8033 12.8033 13.3143 13.3143 13.5787 13.5787 14.2010 14.2010 k =-0.2658 1.0581 0.3636 ( 3784 PWs) bands (ev): -36.9371 -36.9371 -36.9296 -36.9296 -16.2702 -16.2702 -16.2486 -16.2486 -14.5830 -14.5830 -14.5710 -14.5710 -14.4875 -14.4875 -14.4370 -14.4370 0.4834 0.4834 2.6076 2.6076 3.1817 3.1817 5.5225 5.5225 6.5859 6.5859 8.1338 8.1338 8.7367 8.7367 8.9129 8.9129 9.8728 9.8728 9.9833 9.9833 10.4576 10.4576 10.8292 10.8292 12.8655 12.8655 13.4036 13.4036 13.5928 13.5928 14.2774 14.2774 k =-0.2658 1.0581 0.3879 ( 3786 PWs) bands (ev): -36.9368 -36.9368 -36.9295 -36.9295 -16.2706 -16.2706 -16.2496 -16.2496 -14.5826 -14.5826 -14.5710 -14.5710 -14.4895 -14.4895 -14.4396 -14.4396 0.5204 0.5204 2.6439 2.6439 3.2190 3.2190 5.4062 5.4062 6.6273 6.6273 8.1185 8.1185 8.6343 8.6343 8.9443 8.9443 9.8015 9.8015 9.8782 9.8782 10.4002 10.4002 10.7602 10.7602 12.9288 12.9288 13.4886 13.4886 13.6123 13.6123 14.3470 14.3470 k =-0.2658 1.0581 0.4121 ( 3786 PWs) bands (ev): -36.9364 -36.9364 -36.9294 -36.9294 -16.2711 -16.2711 -16.2505 -16.2505 -14.5823 -14.5823 -14.5711 -14.5711 -14.4915 -14.4915 -14.4423 -14.4423 0.5597 0.5597 2.6822 2.6822 3.2583 3.2583 5.2877 5.2877 6.6701 6.6701 8.1025 8.1025 8.5279 8.5279 8.9735 8.9735 9.7051 9.7051 9.8011 9.8011 10.3474 10.3474 10.6933 10.6933 12.9933 12.9933 13.5670 13.5670 13.6388 13.6388 14.4079 14.4079 k =-0.2658 1.0581 0.4363 ( 3782 PWs) bands (ev): -36.9361 -36.9361 -36.9293 -36.9293 -16.2715 -16.2715 -16.2515 -16.2515 -14.5819 -14.5819 -14.5712 -14.5712 -14.4934 -14.4934 -14.4450 -14.4450 0.6014 0.6014 2.7224 2.7224 3.2994 3.2994 5.1674 5.1674 6.7140 6.7140 8.0851 8.0851 8.4192 8.4192 8.9977 8.9977 9.5945 9.5945 9.7446 9.7446 10.2983 10.2983 10.6291 10.6291 13.0591 13.0591 13.6314 13.6314 13.6786 13.6786 14.4592 14.4592 k =-0.2658 1.0581 0.4606 ( 3778 PWs) bands (ev): -36.9358 -36.9358 -36.9291 -36.9291 -16.2719 -16.2719 -16.2526 -16.2526 -14.5817 -14.5817 -14.5713 -14.5713 -14.4953 -14.4953 -14.4477 -14.4477 0.6455 0.6455 2.7644 2.7644 3.3424 3.3424 5.0459 5.0459 6.7584 6.7584 8.0658 8.0658 8.3098 8.3098 9.0127 9.0127 9.4876 9.4876 9.6950 9.6950 10.2530 10.2530 10.5679 10.5679 13.1261 13.1261 13.6759 13.6759 13.7371 13.7371 14.5015 14.5015 k =-0.2658 1.0581 0.4848 ( 3773 PWs) bands (ev): -36.9354 -36.9354 -36.9290 -36.9290 -16.2724 -16.2724 -16.2537 -16.2537 -14.5815 -14.5815 -14.5715 -14.5715 -14.4971 -14.4971 -14.4505 -14.4505 0.6919 0.6919 2.8080 2.8080 3.3869 3.3869 4.9236 4.9236 6.8027 6.8027 8.0436 8.0436 8.2012 8.2012 9.0117 9.0117 9.3956 9.3956 9.6484 9.6484 10.2116 10.2116 10.5101 10.5101 13.1945 13.1945 13.7143 13.7143 13.8001 13.8001 14.5366 14.5366 k =-0.2658 1.0581 0.5091 ( 3776 PWs) bands (ev): -36.9351 -36.9351 -36.9289 -36.9289 -16.2728 -16.2728 -16.2548 -16.2548 -14.5814 -14.5814 -14.5717 -14.5717 -14.4989 -14.4989 -14.4533 -14.4533 0.7407 0.7407 2.8531 2.8531 3.4328 3.4328 4.8011 4.8011 6.8460 6.8460 8.0177 8.0177 8.0949 8.0949 8.9860 8.9860 9.3288 9.3288 9.6031 9.6031 10.1746 10.1746 10.4562 10.4562 13.2642 13.2642 13.7539 13.7539 13.8603 13.8603 14.5666 14.5666 k =-0.2658 1.0581 0.5333 ( 3774 PWs) bands (ev): -36.9347 -36.9347 -36.9287 -36.9287 -16.2732 -16.2732 -16.2559 -16.2559 -14.5813 -14.5813 -14.5719 -14.5719 -14.5005 -14.5005 -14.4560 -14.4560 0.7919 0.7919 2.8995 2.8995 3.4801 3.4801 4.6788 4.6788 6.8870 6.8870 7.9853 7.9853 7.9943 7.9943 8.9331 8.9331 9.2904 9.2904 9.5586 9.5586 10.1429 10.1429 10.4064 10.4064 13.3354 13.3354 13.7962 13.7962 13.9161 13.9161 14.5933 14.5933 k =-0.2658 1.0581 0.5576 ( 3774 PWs) bands (ev): -36.9344 -36.9344 -36.9286 -36.9286 -16.2736 -16.2736 -16.2570 -16.2570 -14.5813 -14.5813 -14.5721 -14.5721 -14.5020 -14.5020 -14.4588 -14.4588 0.8453 0.8453 2.9469 2.9469 3.5285 3.5285 4.5571 4.5571 6.9238 6.9238 7.8970 7.8970 7.9497 7.9497 8.8631 8.8631 9.2714 9.2714 9.5144 9.5144 10.1171 10.1171 10.3609 10.3609 13.4080 13.4080 13.8413 13.8413 13.9677 13.9677 14.6177 14.6177 k =-0.2658 1.0581 0.5818 ( 3774 PWs) bands (ev): -36.9340 -36.9340 -36.9285 -36.9285 -16.2740 -16.2740 -16.2581 -16.2581 -14.5814 -14.5814 -14.5725 -14.5725 -14.5033 -14.5033 -14.4615 -14.4615 0.9012 0.9012 2.9948 2.9948 3.5777 3.5777 4.4367 4.4367 6.9538 6.9538 7.8114 7.8114 7.9042 7.9042 8.7888 8.7888 9.2599 9.2599 9.4704 9.4704 10.0978 10.0978 10.3198 10.3198 13.4820 13.4820 13.8891 13.8891 14.0154 14.0154 14.6406 14.6406 k =-0.2658 1.0581 0.6060 ( 3781 PWs) bands (ev): -36.9337 -36.9337 -36.9285 -36.9285 -16.2744 -16.2744 -16.2593 -16.2593 -14.5816 -14.5816 -14.5728 -14.5728 -14.5044 -14.5044 -14.4641 -14.4641 0.9593 0.9593 3.0428 3.0428 3.6274 3.6274 4.3183 4.3183 6.9733 6.9733 7.7396 7.7396 7.8497 7.8497 8.7187 8.7187 9.2483 9.2483 9.4263 9.4263 10.0852 10.0852 10.2832 10.2832 13.5573 13.5573 13.9392 13.9392 14.0603 14.0603 14.6625 14.6625 k =-0.2658 1.0581 0.6303 ( 3784 PWs) bands (ev): -36.9333 -36.9333 -36.9284 -36.9284 -16.2748 -16.2748 -16.2604 -16.2604 -14.5818 -14.5818 -14.5733 -14.5733 -14.5054 -14.5054 -14.4667 -14.4667 1.0198 1.0198 3.0900 3.0900 3.6775 3.6775 4.2026 4.2026 6.9780 6.9780 7.6863 7.6863 7.7856 7.7856 8.6572 8.6572 9.2331 9.2331 9.3822 9.3822 10.0791 10.0791 10.2510 10.2510 13.6338 13.6338 13.9909 13.9909 14.1036 14.1036 14.6836 14.6836 k =-0.2658 1.0581 0.6545 ( 3790 PWs) bands (ev): -36.9330 -36.9330 -36.9284 -36.9284 -16.2751 -16.2751 -16.2615 -16.2615 -14.5820 -14.5820 -14.5738 -14.5738 -14.5062 -14.5062 -14.4693 -14.4693 1.0826 1.0826 3.1351 3.1351 3.7274 3.7274 4.0912 4.0912 6.9648 6.9648 7.6551 7.6551 7.7123 7.7123 8.6059 8.6059 9.2128 9.2128 9.3382 9.3382 10.0789 10.0789 10.2232 10.2232 13.7113 13.7113 14.0427 14.0427 14.1473 14.1473 14.7041 14.7041 k =-0.2658 1.0581 0.6788 ( 3790 PWs) bands (ev): -36.9327 -36.9327 -36.9283 -36.9283 -16.2754 -16.2754 -16.2626 -16.2626 -14.5823 -14.5823 -14.5743 -14.5743 -14.5068 -14.5068 -14.4718 -14.4718 1.1477 1.1477 3.1759 3.1759 3.7768 3.7768 3.9860 3.9860 6.9332 6.9332 7.6279 7.6279 7.6498 7.6498 8.5648 8.5648 9.1872 9.1872 9.2943 9.2943 10.0834 10.0834 10.1996 10.1996 13.7896 13.7896 14.0927 14.0927 14.1942 14.1942 14.7241 14.7241 k =-0.2658 1.0581 0.7030 ( 3784 PWs) bands (ev): -36.9323 -36.9323 -36.9282 -36.9282 -16.2757 -16.2757 -16.2637 -16.2637 -14.5826 -14.5826 -14.5749 -14.5749 -14.5072 -14.5072 -14.4742 -14.4742 1.2151 1.2151 3.2090 3.2090 3.8252 3.8252 3.8906 3.8906 6.8868 6.8868 7.5416 7.5416 7.6601 7.6601 8.5329 8.5329 9.1571 9.1571 9.2508 9.2508 10.0915 10.0915 10.1801 10.1801 13.8686 13.8686 14.1386 14.1386 14.2470 14.2470 14.7435 14.7435 k =-0.2658 1.0581 0.7272 ( 3782 PWs) bands (ev): -36.9320 -36.9320 -36.9282 -36.9282 -16.2759 -16.2759 -16.2648 -16.2648 -14.5829 -14.5829 -14.5756 -14.5756 -14.5074 -14.5074 -14.4765 -14.4765 1.2848 1.2848 3.2284 3.2284 3.8107 3.8107 3.8722 3.8722 6.8308 6.8308 7.4493 7.4493 7.6872 7.6872 8.5087 8.5087 9.1233 9.1233 9.2076 9.2076 10.1017 10.1017 10.1645 10.1645 13.9479 13.9479 14.1800 14.1800 14.3069 14.3069 14.7625 14.7625 k =-0.2658 1.0581 0.7515 ( 3786 PWs) bands (ev): -36.9317 -36.9317 -36.9282 -36.9282 -16.2761 -16.2761 -16.2658 -16.2658 -14.5832 -14.5832 -14.5764 -14.5764 -14.5074 -14.5074 -14.4788 -14.4788 1.3568 1.3568 3.2259 3.2259 3.7547 3.7547 3.9168 3.9168 6.7704 6.7704 7.3544 7.3544 7.7250 7.7250 8.4907 8.4907 9.0868 9.0868 9.1650 9.1650 10.1126 10.1126 10.1527 10.1527 14.0269 14.0269 14.2180 14.2180 14.3732 14.3732 14.7810 14.7810 k =-0.2658 1.0581 0.7757 ( 3782 PWs) bands (ev): -36.9313 -36.9313 -36.9281 -36.9281 -16.2762 -16.2762 -16.2669 -16.2669 -14.5834 -14.5834 -14.5771 -14.5771 -14.5073 -14.5073 -14.4810 -14.4810 1.4310 1.4310 3.1949 3.1949 3.7286 3.7286 3.9586 3.9586 6.7096 6.7096 7.2587 7.2587 7.7700 7.7700 8.4772 8.4772 9.0486 9.0486 9.1233 9.1233 10.1224 10.1224 10.1455 10.1455 14.1053 14.1053 14.2542 14.2542 14.4446 14.4446 14.7991 14.7991 k =-0.2658 1.0581 0.8000 ( 3788 PWs) bands (ev): -36.9311 -36.9311 -36.9282 -36.9282 -16.2763 -16.2763 -16.2678 -16.2678 -14.5837 -14.5837 -14.5779 -14.5779 -14.5070 -14.5070 -14.4831 -14.4831 1.5074 1.5074 3.1369 3.1369 3.7309 3.7309 3.9967 3.9967 6.6516 6.6516 7.1636 7.1636 7.8197 7.8197 8.4670 8.4670 9.0099 9.0099 9.0827 9.0827 10.1276 10.1276 10.1450 10.1450 14.1821 14.1821 14.2899 14.2899 14.5199 14.5199 14.8166 14.8166 k =-0.2658 1.0581 0.8242 ( 3786 PWs) bands (ev): -36.9307 -36.9307 -36.9282 -36.9282 -16.2763 -16.2763 -16.2688 -16.2688 -14.5839 -14.5839 -14.5787 -14.5787 -14.5065 -14.5065 -14.4851 -14.4851 1.5860 1.5860 3.0596 3.0596 3.7535 3.7535 4.0303 4.0303 6.5988 6.5988 7.0705 7.0705 7.8724 7.8724 8.4587 8.4587 8.9715 8.9715 9.0435 9.0435 10.1278 10.1278 10.1508 10.1508 14.2561 14.2561 14.3263 14.3263 14.5981 14.5981 14.8336 14.8336 k =-0.2658 1.0581 0.8484 ( 3781 PWs) bands (ev): -36.9305 -36.9305 -36.9282 -36.9282 -16.2763 -16.2763 -16.2697 -16.2697 -14.5841 -14.5841 -14.5794 -14.5794 -14.5059 -14.5059 -14.4870 -14.4870 1.6668 1.6668 2.9709 2.9709 3.7881 3.7881 4.0586 4.0586 6.5531 6.5531 6.9805 6.9805 7.9267 7.9267 8.4508 8.4508 8.9347 8.9347 9.0062 9.0062 10.1278 10.1278 10.1574 10.1574 14.3252 14.3252 14.3646 14.3646 14.6782 14.6782 14.8502 14.8502 k =-0.2658 1.0581 0.8727 ( 3788 PWs) bands (ev): -36.9302 -36.9302 -36.9283 -36.9283 -16.2762 -16.2762 -16.2705 -16.2705 -14.5842 -14.5842 -14.5802 -14.5802 -14.5052 -14.5052 -14.4889 -14.4889 1.7497 1.7497 2.8762 2.8762 3.8288 3.8288 4.0807 4.0807 6.5160 6.5160 6.8947 6.8947 7.9818 7.9818 8.4418 8.4418 8.9008 8.9008 8.9709 8.9709 10.1291 10.1291 10.1626 10.1626 14.3832 14.3832 14.4093 14.4093 14.7586 14.7586 14.8667 14.8667 k =-0.2658 1.0581 0.8969 ( 3788 PWs) bands (ev): -36.9300 -36.9300 -36.9283 -36.9283 -16.2761 -16.2761 -16.2713 -16.2713 -14.5843 -14.5843 -14.5809 -14.5809 -14.5044 -14.5044 -14.4907 -14.4907 1.8347 1.8347 2.7785 2.7785 3.8721 3.8721 4.0960 4.0960 6.4887 6.4887 6.8140 6.8140 8.0369 8.0369 8.4302 8.4302 8.8712 8.8712 8.9382 8.9382 10.1318 10.1318 10.1660 10.1660 14.4264 14.4264 14.4617 14.4617 14.8355 14.8355 14.8854 14.8854 k =-0.2658 1.0581 0.9212 ( 3786 PWs) bands (ev): -36.9297 -36.9297 -36.9284 -36.9284 -16.2759 -16.2759 -16.2720 -16.2720 -14.5843 -14.5843 -14.5815 -14.5815 -14.5034 -14.5034 -14.4924 -14.4924 1.9218 1.9218 2.6797 2.6797 3.9154 3.9154 4.1039 4.1039 6.4722 6.4722 6.7396 6.7396 8.0913 8.0913 8.4144 8.4144 8.8475 8.8475 8.9084 8.9084 10.1357 10.1357 10.1674 10.1674 14.4636 14.4636 14.5098 14.5098 14.8856 14.8856 14.9241 14.9241 k =-0.2658 1.0581 0.9454 ( 3792 PWs) bands (ev): -36.9295 -36.9295 -36.9285 -36.9285 -16.2757 -16.2757 -16.2727 -16.2727 -14.5842 -14.5842 -14.5821 -14.5821 -14.5024 -14.5024 -14.4941 -14.4941 2.0108 2.0108 2.5808 2.5808 3.9571 3.9571 4.1041 4.1041 6.4671 6.4671 6.6723 6.6723 8.1442 8.1442 8.3931 8.3931 8.8310 8.8310 8.8819 8.8819 10.1405 10.1405 10.1670 10.1670 14.4976 14.4976 14.5470 14.5470 14.9053 14.9053 14.9644 14.9644 k =-0.2658 1.0581 0.9697 ( 3788 PWs) bands (ev): -36.9293 -36.9293 -36.9286 -36.9286 -16.2754 -16.2754 -16.2733 -16.2733 -14.5841 -14.5841 -14.5827 -14.5827 -14.5012 -14.5012 -14.4956 -14.4956 2.1018 2.1018 2.4824 2.4824 3.9957 3.9957 4.0964 4.0964 6.4736 6.4736 6.6132 6.6132 8.1948 8.1948 8.3658 8.3658 8.8223 8.8223 8.8594 8.8594 10.1458 10.1458 10.1649 10.1649 14.5273 14.5273 14.5710 14.5710 14.9210 14.9210 14.9682 14.9682 k =-0.2658 1.0581 0.9939 ( 3792 PWs) bands (ev): -36.9291 -36.9291 -36.9288 -36.9288 -16.2751 -16.2751 -16.2738 -16.2738 -14.5839 -14.5839 -14.5831 -14.5831 -14.5000 -14.5000 -14.4970 -14.4970 2.1945 2.1945 2.3851 2.3851 4.0298 4.0298 4.0811 4.0811 6.4913 6.4913 6.5636 6.5636 8.2413 8.2413 8.3334 8.3334 8.8211 8.8211 8.8417 8.8417 10.1511 10.1511 10.1615 10.1615 14.5498 14.5498 14.5816 14.5816 14.9355 14.9355 14.9604 14.9604 k =-0.2658 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2749 -16.2749 -16.2741 -16.2741 -14.5836 -14.5836 -14.5835 -14.5835 -14.4991 -14.4991 -14.4980 -14.4980 2.2869 2.2869 2.2912 2.2912 4.0569 4.0569 4.0604 4.0604 6.5128 6.5128 6.5313 6.5313 8.2715 8.2715 8.3079 8.3079 8.8245 8.8245 8.8320 8.8320 10.1549 10.1549 10.1584 10.1584 14.5593 14.5593 14.5833 14.5833 14.9480 14.9480 14.9498 14.9498 k =-0.2658 1.0581 1.0181 ( 3794 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2749 -16.2749 -16.2741 -16.2741 -14.5836 -14.5836 -14.5835 -14.5835 -14.4991 -14.4991 -14.4980 -14.4980 2.2869 2.2869 2.2912 2.2912 4.0569 4.0569 4.0604 4.0604 6.5128 6.5128 6.5313 6.5313 8.2715 8.2715 8.3079 8.3079 8.8245 8.8245 8.8320 8.8320 10.1549 10.1549 10.1584 10.1584 14.5593 14.5593 14.5833 14.5833 14.9480 14.9480 14.9498 14.9498 k =-0.2716 1.0348 1.0181 ( 3794 PWs) bands (ev): -36.9290 -36.9290 -36.9290 -36.9290 -16.2748 -16.2748 -16.2737 -16.2737 -14.5831 -14.5831 -14.5828 -14.5828 -14.4992 -14.4992 -14.4980 -14.4980 2.2842 2.2842 2.2895 2.2895 4.0325 4.0325 4.0375 4.0375 6.5354 6.5354 6.5529 6.5529 8.2942 8.2942 8.3311 8.3311 8.8385 8.8385 8.8451 8.8451 10.1474 10.1474 10.1524 10.1524 14.5475 14.5475 14.5672 14.5672 14.9190 14.9190 14.9281 14.9281 k =-0.2775 1.0115 1.0181 ( 3790 PWs) bands (ev): -36.9291 -36.9291 -36.9291 -36.9291 -16.2746 -16.2746 -16.2732 -16.2732 -14.5825 -14.5825 -14.5819 -14.5819 -14.4992 -14.4992 -14.4981 -14.4981 2.2807 2.2807 2.2870 2.2870 4.0011 4.0011 4.0075 4.0075 6.5692 6.5692 6.5859 6.5859 8.3186 8.3186 8.3559 8.3559 8.8544 8.8544 8.8603 8.8603 10.1379 10.1379 10.1442 10.1442 14.5310 14.5310 14.5449 14.5449 14.8742 14.8742 14.8904 14.8904 k =-0.2833 0.9882 1.0181 ( 3790 PWs) bands (ev): -36.9292 -36.9292 -36.9292 -36.9292 -16.2743 -16.2743 -16.2727 -16.2727 -14.5818 -14.5818 -14.5808 -14.5808 -14.4993 -14.4993 -14.4981 -14.4981 2.2766 2.2766 2.2837 2.2837 3.9635 3.9635 3.9712 3.9712 6.6134 6.6134 6.6294 6.6294 8.3445 8.3445 8.3825 8.3825 8.8722 8.8722 8.8776 8.8776 10.1263 10.1263 10.1337 10.1337 14.5110 14.5110 14.5179 14.5179 14.8219 14.8219 14.8455 14.8455 k =-0.2892 0.9649 1.0181 ( 3790 PWs) bands (ev): -36.9293 -36.9293 -36.9293 -36.9293 -16.2740 -16.2740 -16.2721 -16.2721 -14.5809 -14.5809 -14.5796 -14.5796 -14.4994 -14.4994 -14.4982 -14.4982 2.2718 2.2718 2.2798 2.2798 3.9206 3.9206 3.9293 3.9293 6.6670 6.6670 6.6827 6.6827 8.3717 8.3717 8.4106 8.4106 8.8921 8.8921 8.8971 8.8971 10.1123 10.1123 10.1207 10.1207 14.4876 14.4876 14.4883 14.4883 14.7691 14.7691 14.8003 14.8003 k =-0.2951 0.9416 1.0181 ( 3790 PWs) bands (ev): -36.9294 -36.9294 -36.9294 -36.9294 -16.2735 -16.2735 -16.2714 -16.2714 -14.5798 -14.5798 -14.5782 -14.5782 -14.4995 -14.4995 -14.4983 -14.4983 2.2663 2.2663 2.2752 2.2752 3.8731 3.8731 3.8827 3.8827 6.7291 6.7291 6.7446 6.7446 8.4003 8.4003 8.4402 8.4402 8.9140 8.9140 8.9189 8.9189 10.0959 10.0959 10.1051 10.1051 14.4556 14.4556 14.4640 14.4640 14.7197 14.7197 14.7582 14.7582 k =-0.3009 0.9183 1.0181 ( 3786 PWs) bands (ev): -36.9296 -36.9296 -36.9296 -36.9296 -16.2731 -16.2731 -16.2707 -16.2707 -14.5785 -14.5785 -14.5767 -14.5767 -14.4996 -14.4996 -14.4983 -14.4983 2.2602 2.2602 2.2699 2.2699 3.8220 3.8220 3.8324 3.8324 6.7988 6.7988 6.8144 6.8144 8.4299 8.4299 8.4711 8.4711 8.9381 8.9381 8.9430 8.9430 10.0772 10.0772 10.0869 10.0869 14.4232 14.4232 14.4387 14.4387 14.6754 14.6754 14.7202 14.7202 k =-0.3068 0.8949 1.0181 ( 3788 PWs) bands (ev): -36.9297 -36.9297 -36.9297 -36.9297 -16.2725 -16.2725 -16.2699 -16.2699 -14.5772 -14.5772 -14.5750 -14.5750 -14.4997 -14.4997 -14.4984 -14.4984 2.2536 2.2536 2.2640 2.2640 3.7680 3.7680 3.7791 3.7791 6.8752 6.8752 6.8911 6.8911 8.4606 8.4606 8.5031 8.5031 8.9644 8.9644 8.9696 8.9696 10.0561 10.0561 10.0662 10.0662 14.3917 14.3917 14.4132 14.4132 14.6366 14.6366 14.6863 14.6863 k =-0.3126 0.8716 1.0181 ( 3792 PWs) bands (ev): -36.9299 -36.9299 -36.9299 -36.9299 -16.2719 -16.2719 -16.2691 -16.2691 -14.5756 -14.5756 -14.5733 -14.5733 -14.4998 -14.4998 -14.4984 -14.4984 2.2463 2.2463 2.2574 2.2574 3.7120 3.7120 3.7236 3.7236 6.9573 6.9573 6.9737 6.9737 8.4920 8.4920 8.5361 8.5361 8.9931 8.9931 8.9987 8.9987 10.0330 10.0330 10.0431 10.0431 14.3621 14.3621 14.3883 14.3883 14.6031 14.6031 14.6561 14.6561 k =-0.3185 0.8483 1.0181 ( 3800 PWs) bands (ev): -36.9302 -36.9302 -36.9302 -36.9302 -16.2712 -16.2712 -16.2682 -16.2682 -14.5740 -14.5740 -14.5715 -14.5715 -14.4999 -14.4999 -14.4984 -14.4984 2.2386 2.2386 2.2503 2.2503 3.6545 3.6545 3.6665 3.6665 7.0443 7.0443 7.0615 7.0615 8.5242 8.5242 8.5700 8.5700 9.0241 9.0241 9.0304 9.0304 10.0081 10.0081 10.0179 10.0179 14.3351 14.3351 14.3646 14.3646 14.5746 14.5746 14.6289 14.6289 k =-0.3243 0.8250 1.0181 ( 3800 PWs) bands (ev): -36.9304 -36.9304 -36.9304 -36.9304 -16.2705 -16.2705 -16.2673 -16.2673 -14.5723 -14.5723 -14.5696 -14.5696 -14.4999 -14.4999 -14.4983 -14.4983 2.2303 2.2303 2.2426 2.2426 3.5962 3.5962 3.6085 3.6085 7.1354 7.1354 7.1536 7.1536 8.5569 8.5569 8.6044 8.6044 9.0575 9.0575 9.0647 9.0647 9.9817 9.9817 9.9909 9.9909 14.3110 14.3110 14.3425 14.3425 14.5503 14.5503 14.6040 14.6040 k =-0.3302 0.8017 1.0181 ( 3800 PWs) bands (ev): -36.9306 -36.9306 -36.9306 -36.9306 -16.2697 -16.2697 -16.2664 -16.2664 -14.5705 -14.5705 -14.5677 -14.5677 -14.4998 -14.4998 -14.4982 -14.4982 2.2215 2.2215 2.2344 2.2344 3.5376 3.5376 3.5501 3.5501 7.2299 7.2299 7.2493 7.2493 8.5901 8.5901 8.6392 8.6392 9.0933 9.0933 9.1015 9.1015 9.9544 9.9544 9.9625 9.9625 14.2900 14.2900 14.3221 14.3221 14.5295 14.5295 14.5805 14.5805 k =-0.3360 0.7784 1.0181 ( 3796 PWs) bands (ev): -36.9308 -36.9308 -36.9308 -36.9308 -16.2689 -16.2689 -16.2654 -16.2654 -14.5687 -14.5687 -14.5658 -14.5658 -14.4997 -14.4997 -14.4980 -14.4980 2.2123 2.2123 2.2256 2.2256 3.4791 3.4791 3.4917 3.4917 7.3270 7.3270 7.3476 7.3476 8.6236 8.6236 8.6742 8.6742 9.1314 9.1314 9.1409 9.1409 9.9268 9.9268 9.9334 9.9334 14.2719 14.2719 14.3033 14.3033 14.5113 14.5113 14.5576 14.5576 k =-0.3419 0.7551 1.0181 ( 3792 PWs) bands (ev): -36.9310 -36.9310 -36.9310 -36.9310 -16.2680 -16.2680 -16.2644 -16.2644 -14.5669 -14.5669 -14.5639 -14.5639 -14.4996 -14.4996 -14.4976 -14.4976 2.2027 2.2027 2.2164 2.2164 3.4211 3.4211 3.4338 3.4338 7.4258 7.4258 7.4479 7.4479 8.6575 8.6575 8.7093 8.7093 9.1718 9.1718 9.1826 9.1826 9.8998 9.8998 9.9042 9.9042 14.2562 14.2562 14.2858 14.2858 14.4949 14.4949 14.5341 14.5341 k =-0.3478 0.7317 1.0181 ( 3796 PWs) bands (ev): -36.9313 -36.9313 -36.9313 -36.9313 -16.2671 -16.2671 -16.2634 -16.2634 -14.5650 -14.5650 -14.5620 -14.5620 -14.4993 -14.4993 -14.4972 -14.4972 2.1927 2.1927 2.2066 2.2066 3.3640 3.3640 3.3766 3.3766 7.5257 7.5257 7.5493 7.5493 8.6918 8.6918 8.7444 8.7444 9.2139 9.2139 9.2264 9.2264 9.8742 9.8742 9.8758 9.8758 14.2421 14.2421 14.2686 14.2686 14.4794 14.4794 14.5090 14.5090 k =-0.3536 0.7084 1.0181 ( 3796 PWs) bands (ev): -36.9315 -36.9315 -36.9315 -36.9315 -16.2662 -16.2662 -16.2624 -16.2624 -14.5632 -14.5632 -14.5602 -14.5602 -14.4989 -14.4989 -14.4967 -14.4967 2.1823 2.1823 2.1965 2.1965 3.3080 3.3080 3.3205 3.3205 7.6256 7.6256 7.6508 7.6508 8.7267 8.7267 8.7795 8.7795 9.2573 9.2573 9.2717 9.2717 9.8491 9.8491 9.8514 9.8514 14.2284 14.2284 14.2506 14.2506 14.4639 14.4639 14.4813 14.4813 k =-0.3595 0.6851 1.0181 ( 3792 PWs) bands (ev): -36.9318 -36.9318 -36.9318 -36.9318 -16.2652 -16.2652 -16.2613 -16.2613 -14.5614 -14.5614 -14.5585 -14.5585 -14.4983 -14.4983 -14.4960 -14.4960 2.1715 2.1715 2.1858 2.1858 3.2535 3.2535 3.2658 3.2658 7.7247 7.7247 7.7512 7.7512 8.7625 8.7625 8.8147 8.8147 9.3012 9.3012 9.3178 9.3178 9.8257 9.8257 9.8329 9.8329 14.2127 14.2127 14.2296 14.2296 14.4482 14.4482 14.4515 14.4515 k =-0.3653 0.6618 1.0181 ( 3792 PWs) bands (ev): -36.9320 -36.9320 -36.9320 -36.9320 -16.2642 -16.2642 -16.2603 -16.2603 -14.5598 -14.5598 -14.5569 -14.5569 -14.4977 -14.4977 -14.4952 -14.4952 2.1604 2.1604 2.1748 2.1748 3.2006 3.2006 3.2127 3.2127 7.8218 7.8218 7.8495 7.8495 8.7997 8.7997 8.8500 8.8500 9.3442 9.3442 9.3632 9.3632 9.8075 9.8075 9.8207 9.8207 14.1914 14.1914 14.2029 14.2029 14.4219 14.4219 14.4332 14.4332 k =-0.3712 0.6385 1.0181 ( 3794 PWs) bands (ev): -36.9323 -36.9323 -36.9323 -36.9323 -16.2632 -16.2632 -16.2593 -16.2593 -14.5582 -14.5582 -14.5555 -14.5555 -14.4968 -14.4968 -14.4942 -14.4942 2.1491 2.1491 2.1635 2.1635 3.1495 3.1495 3.1613 3.1613 7.9157 7.9157 7.9440 7.9440 8.8389 8.8389 8.8859 8.8859 9.3847 9.3847 9.4061 9.4061 9.7970 9.7970 9.8174 9.8174 14.1595 14.1595 14.1672 14.1672 14.3969 14.3969 14.4208 14.4208 k =-0.3770 0.6152 1.0181 ( 3798 PWs) bands (ev): -36.9326 -36.9326 -36.9326 -36.9326 -16.2623 -16.2623 -16.2583 -16.2583 -14.5567 -14.5567 -14.5541 -14.5541 -14.4959 -14.4959 -14.4931 -14.4931 2.1375 2.1375 2.1518 2.1518 3.1005 3.1005 3.1119 3.1119 8.0049 8.0049 8.0331 8.0331 8.8810 8.8810 8.9227 8.9227 9.4207 9.4207 9.4436 9.4436 9.7977 9.7977 9.8256 9.8256 14.1130 14.1130 14.1201 14.1201 14.3813 14.3813 14.4134 14.4134 k =-0.3829 0.5919 1.0181 ( 3798 PWs) bands (ev): -36.9329 -36.9329 -36.9329 -36.9329 -16.2613 -16.2613 -16.2573 -16.2573 -14.5554 -14.5554 -14.5530 -14.5530 -14.4947 -14.4947 -14.4918 -14.4918 2.1257 2.1257 2.1398 2.1398 3.0535 3.0535 3.0646 3.0646 8.0879 8.0879 8.1151 8.1151 8.9269 8.9269 8.9611 8.9611 9.4507 9.4507 9.4730 9.4730 9.8129 9.8129 9.8476 9.8476 14.0515 14.0515 14.0611 14.0611 14.3764 14.3764 14.4122 14.4122 k =-0.3887 0.5685 1.0181 ( 3802 PWs) bands (ev): -36.9331 -36.9331 -36.9331 -36.9331 -16.2603 -16.2603 -16.2564 -16.2564 -14.5542 -14.5542 -14.5520 -14.5520 -14.4934 -14.4934 -14.4904 -14.4904 2.1137 2.1137 2.1275 2.1275 3.0088 3.0088 3.0195 3.0195 8.1631 8.1631 8.1882 8.1882 8.9774 8.9774 9.0014 9.0014 9.4749 9.4749 9.4933 9.4933 9.8445 9.8445 9.8841 9.8841 13.9777 13.9777 13.9912 13.9912 14.3809 14.3809 14.4176 14.4176 k =-0.3946 0.5452 1.0181 ( 3802 PWs) bands (ev): -36.9334 -36.9334 -36.9334 -36.9334 -16.2593 -16.2593 -16.2555 -16.2555 -14.5532 -14.5532 -14.5512 -14.5512 -14.4920 -14.4920 -14.4888 -14.4888 2.1016 2.1016 2.1151 2.1151 2.9665 2.9665 2.9766 2.9766 8.2290 8.2290 8.2509 8.2509 9.0329 9.0329 9.0440 9.0440 9.4951 9.4951 9.5061 9.5061 9.8913 9.8913 9.9342 9.9342 13.8948 13.8948 13.9123 13.9123 14.3928 14.3928 14.4293 14.4293 k =-0.4005 0.5219 1.0181 ( 3802 PWs) bands (ev): -36.9336 -36.9336 -36.9336 -36.9336 -16.2583 -16.2583 -16.2546 -16.2546 -14.5523 -14.5523 -14.5505 -14.5505 -14.4904 -14.4904 -14.4872 -14.4872 2.0894 2.0894 2.1025 2.1025 2.9265 2.9265 2.9362 2.9362 8.2847 8.2847 8.3026 8.3026 9.0887 9.0887 9.0929 9.0929 9.5142 9.5142 9.5153 9.5153 9.9506 9.9506 9.9959 9.9959 13.8050 13.8050 13.8263 13.8263 14.4107 14.4107 14.4467 14.4467 k =-0.4063 0.4986 1.0181 ( 3806 PWs) bands (ev): -36.9339 -36.9339 -36.9339 -36.9339 -16.2573 -16.2573 -16.2537 -16.2537 -14.5516 -14.5516 -14.5499 -14.5499 -14.4887 -14.4887 -14.4855 -14.4855 2.0773 2.0773 2.0899 2.0899 2.8890 2.8890 2.8981 2.8981 8.3295 8.3295 8.3431 8.3431 9.1348 9.1348 9.1557 9.1557 9.5249 9.5249 9.5351 9.5351 10.0196 10.0196 10.0671 10.0671 13.7099 13.7099 13.7347 13.7347 14.4333 14.4333 14.4693 14.4693 k =-0.4122 0.4753 1.0181 ( 3798 PWs) bands (ev): -36.9341 -36.9341 -36.9341 -36.9341 -16.2564 -16.2564 -16.2529 -16.2529 -14.5510 -14.5510 -14.5495 -14.5495 -14.4870 -14.4870 -14.4837 -14.4837 2.0652 2.0652 2.0773 2.0773 2.8540 2.8540 2.8626 2.8626 8.3638 8.3638 8.3733 8.3733 9.1805 9.1805 9.2182 9.2182 9.5387 9.5387 9.5604 9.5604 10.0963 10.0963 10.1461 10.1461 13.6108 13.6108 13.6387 13.6387 14.4595 14.4595 14.4966 14.4966 k =-0.4180 0.4520 1.0181 ( 3806 PWs) bands (ev): -36.9344 -36.9344 -36.9344 -36.9344 -16.2555 -16.2555 -16.2522 -16.2522 -14.5505 -14.5505 -14.5492 -14.5492 -14.4851 -14.4851 -14.4819 -14.4819 2.0533 2.0533 2.0648 2.0648 2.8215 2.8215 2.8295 2.8295 8.3885 8.3885 8.3944 8.3944 9.2240 9.2240 9.2760 9.2760 9.5607 9.5607 9.5920 9.5920 10.1795 10.1795 10.2317 10.2317 13.5084 13.5084 13.5390 13.5390 14.4873 14.4873 14.5275 14.5275 k =-0.4239 0.4287 1.0181 ( 3800 PWs) bands (ev): -36.9346 -36.9346 -36.9346 -36.9346 -16.2546 -16.2546 -16.2514 -16.2514 -14.5502 -14.5502 -14.5489 -14.5489 -14.4832 -14.4832 -14.4801 -14.4801 2.0417 2.0417 2.0524 2.0524 2.7915 2.7915 2.7989 2.7989 8.4048 8.4048 8.4079 8.4079 9.2633 9.2633 9.3244 9.3244 9.5942 9.5942 9.6306 9.6306 10.2683 10.2683 10.3229 10.3229 13.4033 13.4033 13.4365 13.4365 14.5132 14.5132 14.5584 14.5584 k =-0.4297 0.4054 1.0181 ( 3804 PWs) bands (ev): -36.9348 -36.9348 -36.9348 -36.9348 -16.2538 -16.2538 -16.2508 -16.2508 -14.5499 -14.5499 -14.5488 -14.5488 -14.4814 -14.4814 -14.4783 -14.4783 2.0304 2.0304 2.0404 2.0404 2.7640 2.7640 2.7708 2.7708 8.4142 8.4142 8.4152 8.4152 9.2975 9.2975 9.3609 9.3609 9.6404 9.6404 9.6761 9.6761 10.3621 10.3621 10.4192 10.4192 13.2960 13.2960 13.3315 13.3315 14.5303 14.5303 14.5739 14.5739 k =-0.4356 0.3820 1.0181 ( 3804 PWs) bands (ev): -36.9350 -36.9350 -36.9350 -36.9350 -16.2530 -16.2530 -16.2502 -16.2502 -14.5497 -14.5497 -14.5487 -14.5487 -14.4795 -14.4795 -14.4766 -14.4766 2.0195 2.0195 2.0288 2.0288 2.7390 2.7390 2.7451 2.7451 8.4179 8.4179 8.4182 8.4182 9.3265 9.3265 9.3867 9.3867 9.6962 9.6962 9.7267 9.7267 10.4605 10.4605 10.5197 10.5197 13.1869 13.1869 13.2244 13.2244 14.5327 14.5327 14.5623 14.5623 k =-0.4414 0.3587 1.0181 ( 3804 PWs) bands (ev): -36.9352 -36.9352 -36.9352 -36.9352 -16.2523 -16.2523 -16.2496 -16.2496 -14.5495 -14.5495 -14.5487 -14.5487 -14.4777 -14.4777 -14.4749 -14.4749 2.0092 2.0092 2.0177 2.0177 2.7164 2.7164 2.7219 2.7219 8.4170 8.4170 8.4182 8.4182 9.3509 9.3509 9.4050 9.4050 9.7571 9.7571 9.7805 9.7805 10.5629 10.5629 10.6239 10.6239 13.0763 13.0763 13.1158 13.1158 14.5217 14.5217 14.5401 14.5401 k =-0.4473 0.3354 1.0181 ( 3800 PWs) bands (ev): -36.9354 -36.9354 -36.9354 -36.9354 -16.2515 -16.2515 -16.2491 -16.2491 -14.5495 -14.5495 -14.5487 -14.5487 -14.4760 -14.4760 -14.4734 -14.4734 1.9995 1.9995 2.0072 2.0072 2.6962 2.6962 2.7011 2.7011 8.4137 8.4137 8.4154 8.4154 9.3715 9.3715 9.4185 9.4185 9.8188 9.8188 9.8352 9.8352 10.6689 10.6689 10.7311 10.7311 12.9645 12.9645 13.0059 13.0059 14.5031 14.5031 14.5147 14.5147 k =-0.4532 0.3121 1.0181 ( 3804 PWs) bands (ev): -36.9355 -36.9355 -36.9355 -36.9355 -16.2509 -16.2509 -16.2487 -16.2487 -14.5494 -14.5494 -14.5488 -14.5488 -14.4744 -14.4744 -14.4720 -14.4720 1.9906 1.9906 1.9974 1.9974 2.6783 2.6783 2.6826 2.6826 8.4088 8.4088 8.4106 8.4106 9.3889 9.3889 9.4289 9.4289 9.8784 9.8784 9.8888 9.8888 10.7777 10.7777 10.8406 10.8406 12.8521 12.8521 12.8951 12.8951 14.4807 14.4807 14.4882 14.4882 k =-0.4590 0.2888 1.0181 ( 3816 PWs) bands (ev): -36.9357 -36.9357 -36.9357 -36.9357 -16.2503 -16.2503 -16.2484 -16.2484 -14.5494 -14.5494 -14.5489 -14.5489 -14.4729 -14.4729 -14.4707 -14.4707 1.9825 1.9825 1.9885 1.9885 2.6627 2.6627 2.6664 2.6664 8.4030 8.4030 8.4049 8.4049 9.4038 9.4038 9.4373 9.4373 9.9339 9.9339 9.9396 9.9396 10.8886 10.8886 10.9514 10.9514 12.7396 12.7396 12.7839 12.7839 14.4569 14.4569 14.4618 14.4618 k =-0.4649 0.2655 1.0181 ( 3816 PWs) bands (ev): -36.9358 -36.9358 -36.9358 -36.9358 -16.2497 -16.2497 -16.2481 -16.2481 -14.5494 -14.5494 -14.5490 -14.5490 -14.4715 -14.4715 -14.4696 -14.4696 1.9753 1.9753 1.9805 1.9805 2.6493 2.6493 2.6524 2.6524 8.3970 8.3970 8.3987 8.3987 9.4166 9.4166 9.4441 9.4441 9.9840 9.9840 9.9862 9.9862 11.0005 11.0005 11.0624 11.0624 12.6278 12.6278 12.6731 12.6731 14.4333 14.4333 14.4363 14.4363 k =-0.4707 0.2422 1.0181 ( 3812 PWs) bands (ev): -36.9359 -36.9359 -36.9359 -36.9359 -16.2492 -16.2492 -16.2478 -16.2478 -14.5494 -14.5494 -14.5490 -14.5490 -14.4703 -14.4703 -14.4687 -14.4687 1.9692 1.9692 1.9735 1.9735 2.6381 2.6381 2.6407 2.6407 8.3912 8.3912 8.3927 8.3927 9.4274 9.4274 9.4495 9.4495 10.0276 10.0276 10.0276 10.0276 11.1120 11.1120 11.1720 11.1720 12.5179 12.5179 12.5634 12.5634 14.4111 14.4111 14.4129 14.4129 k =-0.4766 0.2188 1.0181 ( 3812 PWs) bands (ev): -36.9360 -36.9360 -36.9360 -36.9360 -16.2488 -16.2488 -16.2477 -16.2477 -14.5494 -14.5494 -14.5491 -14.5491 -14.4692 -14.4692 -14.4680 -14.4680 1.9641 1.9641 1.9676 1.9676 2.6290 2.6290 2.6311 2.6311 8.3860 8.3860 8.3872 8.3872 9.4364 9.4364 9.4535 9.4535 10.0629 10.0629 10.0641 10.0641 11.2212 11.2212 11.2777 11.2777 12.4121 12.4121 12.4567 12.4567 14.3914 14.3914 14.3924 14.3924 k =-0.4824 0.1955 1.0181 ( 3816 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2484 -16.2484 -16.2476 -16.2476 -14.5494 -14.5494 -14.5492 -14.5492 -14.4684 -14.4684 -14.4674 -14.4674 1.9602 1.9602 1.9628 1.9628 2.6221 2.6221 2.6236 2.6236 8.3817 8.3817 8.3826 8.3826 9.4438 9.4438 9.4563 9.4563 10.0913 10.0913 10.0928 10.0928 11.3248 11.3248 11.3756 11.3756 12.3141 12.3141 12.3557 12.3557 14.3750 14.3750 14.3755 14.3755 k =-0.4883 0.1722 1.0181 ( 3812 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2481 -16.2481 -16.2476 -16.2476 -14.5494 -14.5494 -14.5493 -14.5493 -14.4677 -14.4677 -14.4670 -14.4670 1.9575 1.9575 1.9592 1.9592 2.6172 2.6172 2.6182 2.6182 8.3785 8.3785 8.3791 8.3791 9.4495 9.4495 9.4577 9.4577 10.1121 10.1121 10.1135 10.1135 11.4173 11.4173 11.4582 11.4582 12.2310 12.2310 12.2657 12.2657 14.3627 14.3627 14.3629 14.3629 k =-0.4941 0.1489 1.0181 ( 3812 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2479 -16.2479 -16.2476 -16.2476 -14.5494 -14.5494 -14.5493 -14.5493 -14.4672 -14.4672 -14.4669 -14.4669 1.9561 1.9561 1.9569 1.9569 2.6144 2.6144 2.6149 2.6149 8.3766 8.3766 8.3769 8.3769 9.4538 9.4538 9.4578 9.4578 10.1250 10.1250 10.1258 10.1258 11.4890 11.4890 11.5131 11.5131 12.1753 12.1753 12.1962 12.1962 14.3551 14.3551 14.3551 14.3551 k =-0.5000 0.1256 1.0181 ( 3820 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5494 -14.5494 -14.5494 -14.5494 -14.4670 -14.4670 -14.4670 -14.4670 1.9559 1.9559 1.9559 1.9559 2.6136 2.6136 2.6136 2.6136 8.3760 8.3760 8.3760 8.3760 9.4565 9.4565 9.4565 9.4565 10.1296 10.1296 10.1296 10.1296 11.5249 11.5249 11.5249 11.5249 12.1622 12.1622 12.1622 12.1622 14.3525 14.3525 14.3525 14.3525 k =-0.5000 0.1256 1.0181 ( 3820 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5494 -14.5494 -14.5494 -14.5494 -14.4670 -14.4670 -14.4670 -14.4670 1.9559 1.9559 1.9559 1.9559 2.6136 2.6136 2.6136 2.6136 8.3760 8.3760 8.3760 8.3760 9.4565 9.4565 9.4565 9.4565 10.1296 10.1296 10.1296 10.1296 11.5249 11.5249 11.5249 11.5249 12.1622 12.1622 12.1622 12.1622 14.3525 14.3525 14.3525 14.3525 k =-0.5000 0.1256 0.9939 ( 3812 PWs) bands (ev): -36.9363 -36.9363 -36.9360 -36.9360 -16.2483 -16.2483 -16.2471 -16.2471 -14.5503 -14.5503 -14.5482 -14.5482 -14.4674 -14.4674 -14.4665 -14.4665 1.8491 1.8491 2.0592 2.0592 2.5134 2.5134 2.7216 2.7216 8.2797 8.2797 8.4729 8.4729 9.3916 9.3916 9.5219 9.5219 10.0907 10.0907 10.1706 10.1706 11.4417 11.4417 11.6084 11.6084 12.0774 12.0774 12.2486 12.2486 14.3378 14.3378 14.3604 14.3604 k =-0.5000 0.1256 0.9697 ( 3804 PWs) bands (ev): -36.9365 -36.9365 -36.9358 -36.9358 -16.2488 -16.2488 -16.2463 -16.2463 -14.5511 -14.5511 -14.5469 -14.5469 -14.4679 -14.4679 -14.4660 -14.4660 1.7422 1.7422 2.1471 2.1471 2.4329 2.4329 2.8341 2.8341 8.1843 8.1843 8.5697 8.5697 9.3277 9.3277 9.5874 9.5874 10.0537 10.0537 10.2137 10.2137 11.3592 11.3592 11.6915 11.6915 11.9950 11.9950 12.3364 12.3364 14.3159 14.3159 14.3614 14.3614 k =-0.5000 0.1256 0.9454 ( 3806 PWs) bands (ev): -36.9367 -36.9367 -36.9357 -36.9357 -16.2492 -16.2492 -16.2455 -16.2455 -14.5517 -14.5517 -14.5454 -14.5454 -14.4684 -14.4684 -14.4656 -14.4656 1.6363 1.6363 2.1754 2.1754 2.4161 2.4161 2.9500 2.9500 8.0903 8.0903 8.6651 8.6651 9.2659 9.2659 9.6526 9.6526 10.0185 10.0185 10.2590 10.2590 11.2778 11.2778 11.7708 11.7708 11.9179 11.9179 12.4253 12.4253 14.2869 14.2869 14.3550 14.3550 k =-0.5000 0.1256 0.9212 ( 3814 PWs) bands (ev): -36.9370 -36.9370 -36.9356 -36.9356 -16.2495 -16.2495 -16.2446 -16.2446 -14.5521 -14.5521 -14.5437 -14.5437 -14.4689 -14.4689 -14.4651 -14.4651 1.5318 1.5318 2.1205 2.1205 2.4868 2.4868 3.0688 3.0688 7.9980 7.9980 8.7570 8.7570 9.2081 9.2081 9.7173 9.7173 9.9852 9.9852 10.3066 10.3066 11.1978 11.1978 11.8045 11.8045 11.8878 11.8878 12.5153 12.5153 14.2508 14.2508 14.3399 14.3399 k =-0.5000 0.1256 0.8969 ( 3810 PWs) bands (ev): -36.9372 -36.9372 -36.9356 -36.9356 -16.2498 -16.2498 -16.2436 -16.2436 -14.5523 -14.5523 -14.5418 -14.5418 -14.4693 -14.4693 -14.4647 -14.4647 1.4292 1.4292 2.0354 2.0354 2.5915 2.5915 3.1903 3.1903 7.9076 7.9076 8.8392 8.8392 9.1603 9.1603 9.7808 9.7808 9.9539 9.9539 10.3566 10.3566 11.1195 11.1195 11.7415 11.7415 11.9558 11.9558 12.6061 12.6061 14.2081 14.2081 14.3133 14.3133 k =-0.5000 0.1256 0.8727 ( 3816 PWs) bands (ev): -36.9375 -36.9375 -36.9355 -36.9355 -16.2500 -16.2500 -16.2426 -16.2426 -14.5524 -14.5524 -14.5398 -14.5398 -14.4697 -14.4697 -14.4643 -14.4643 1.3286 1.3286 1.9438 1.9438 2.7067 2.7067 3.3143 3.3143 7.8194 7.8194 8.8953 8.8953 9.1387 9.1387 9.8413 9.8413 9.9263 9.9263 10.4089 10.4089 11.0432 11.0432 11.6675 11.6675 12.0360 12.0360 12.6977 12.6977 14.1594 14.1594 14.2722 14.2722 k =-0.5000 0.1256 0.8484 ( 3836 PWs) bands (ev): -36.9378 -36.9378 -36.9355 -36.9355 -16.2501 -16.2501 -16.2415 -16.2415 -14.5523 -14.5523 -14.5376 -14.5376 -14.4701 -14.4701 -14.4639 -14.4639 1.2301 1.2301 1.8515 1.8515 2.8263 2.8263 3.4406 3.4406 7.7336 7.7336 8.9007 8.9007 9.1675 9.1675 9.8761 9.8761 9.9244 9.9244 10.4637 10.4637 10.9691 10.9691 11.5942 11.5942 12.1168 12.1168 12.7898 12.7898 14.1056 14.1056 14.2156 14.2156 k =-0.5000 0.1256 0.8242 ( 3832 PWs) bands (ev): -36.9381 -36.9381 -36.9355 -36.9355 -16.2501 -16.2501 -16.2403 -16.2403 -14.5521 -14.5521 -14.5352 -14.5352 -14.4705 -14.4705 -14.4635 -14.4635 1.1338 1.1338 1.7602 1.7602 2.9486 2.9486 3.5692 3.5692 7.6505 7.6505 8.8654 8.8654 9.2363 9.2363 9.8573 9.8573 9.9759 9.9759 10.5210 10.5210 10.8975 10.8975 11.5230 11.5230 12.1967 12.1967 12.8824 12.8824 14.0477 14.0477 14.1458 14.1458 k =-0.5000 0.1256 0.8000 ( 3832 PWs) bands (ev): -36.9384 -36.9384 -36.9355 -36.9355 -16.2501 -16.2501 -16.2391 -16.2391 -14.5517 -14.5517 -14.5327 -14.5327 -14.4708 -14.4708 -14.4631 -14.4631 1.0398 1.0398 1.6706 1.6706 3.0726 3.0726 3.7000 3.7000 7.5704 7.5704 8.8142 8.8142 9.3198 9.3198 9.8310 9.8310 10.0340 10.0340 10.5807 10.5807 10.8289 10.8289 11.4546 11.4546 12.2750 12.2750 12.9751 12.9751 13.9868 13.9868 14.0670 14.0670 k =-0.5000 0.1256 0.7757 ( 3830 PWs) bands (ev): -36.9387 -36.9387 -36.9355 -36.9355 -16.2499 -16.2499 -16.2378 -16.2378 -14.5513 -14.5513 -14.5300 -14.5300 -14.4711 -14.4711 -14.4627 -14.4627 0.9482 0.9482 1.5831 1.5831 3.1978 3.1978 3.8329 3.8329 7.4936 7.4936 8.7574 8.7574 9.4072 9.4072 9.8044 9.8044 10.0913 10.0913 10.6427 10.6427 10.7635 10.7635 11.3895 11.3895 12.3513 12.3513 13.0676 13.0676 13.9237 13.9237 13.9830 13.9830 k =-0.5000 0.1256 0.7515 ( 3828 PWs) bands (ev): -36.9390 -36.9390 -36.9355 -36.9355 -16.2498 -16.2498 -16.2364 -16.2364 -14.5507 -14.5507 -14.5272 -14.5272 -14.4713 -14.4713 -14.4623 -14.4623 0.8590 0.8590 1.4977 1.4977 3.3237 3.3237 3.9679 3.9679 7.4204 7.4204 8.6986 8.6986 9.4938 9.4938 9.7780 9.7780 10.1468 10.1468 10.6950 10.6950 10.7140 10.7140 11.3284 11.3284 12.4253 12.4253 13.1594 13.1594 13.8584 13.8584 13.8977 13.8977 k =-0.5000 0.1256 0.7272 ( 3828 PWs) bands (ev): -36.9393 -36.9393 -36.9355 -36.9355 -16.2495 -16.2495 -16.2351 -16.2351 -14.5500 -14.5500 -14.5244 -14.5244 -14.4715 -14.4715 -14.4619 -14.4619 0.7722 0.7722 1.4148 1.4148 3.4499 3.4499 4.1049 4.1049 7.3512 7.3512 8.6392 8.6392 9.5767 9.5767 9.7527 9.7527 10.1997 10.1997 10.6417 10.6417 10.7763 10.7763 11.2721 11.2721 12.4967 12.4967 13.2498 13.2498 13.7869 13.7869 13.8185 13.8185 k =-0.5000 0.1256 0.7030 ( 3824 PWs) bands (ev): -36.9396 -36.9396 -36.9355 -36.9355 -16.2492 -16.2492 -16.2336 -16.2336 -14.5493 -14.5493 -14.5214 -14.5214 -14.4715 -14.4715 -14.4615 -14.4615 0.6879 0.6879 1.3342 1.3342 3.5760 3.5760 4.2437 4.2437 7.2863 7.2863 8.5800 8.5800 9.6499 9.6499 9.7324 9.7324 10.2495 10.2495 10.5877 10.5877 10.8459 10.8459 11.2214 11.2214 12.5653 12.5653 13.3370 13.3370 13.7044 13.7044 13.7536 13.7536 k =-0.5000 0.1256 0.6788 ( 3822 PWs) bands (ev): -36.9400 -36.9400 -36.9356 -36.9356 -16.2489 -16.2489 -16.2322 -16.2322 -14.5486 -14.5486 -14.5184 -14.5184 -14.4715 -14.4715 -14.4611 -14.4611 0.6061 0.6061 1.2562 1.2562 3.7015 3.7015 4.3844 4.3844 7.2261 7.2261 8.5214 8.5214 9.6771 9.6771 9.7517 9.7517 10.2952 10.2952 10.5384 10.5384 10.9177 10.9177 11.1776 11.1776 12.6307 12.6307 13.4160 13.4160 13.6184 13.6184 13.7020 13.7020 k =-0.5000 0.1256 0.6545 ( 3810 PWs) bands (ev): -36.9403 -36.9403 -36.9356 -36.9356 -16.2485 -16.2485 -16.2307 -16.2307 -14.5478 -14.5478 -14.5153 -14.5153 -14.4714 -14.4714 -14.4607 -14.4607 0.5269 0.5269 1.1806 1.1806 3.8260 3.8260 4.5269 4.5269 7.1713 7.1713 8.4636 8.4636 9.6571 9.6571 9.8102 9.8102 10.3352 10.3352 10.4954 10.4954 10.9907 10.9907 11.1428 11.1428 12.6928 12.6928 13.4660 13.4660 13.5409 13.5409 13.6736 13.6736 k =-0.5000 0.1256 0.6303 ( 3806 PWs) bands (ev): -36.9406 -36.9406 -36.9356 -36.9356 -16.2481 -16.2481 -16.2292 -16.2292 -14.5470 -14.5470 -14.5122 -14.5122 -14.4711 -14.4711 -14.4602 -14.4602 0.4502 0.4502 1.1077 1.1077 3.9487 3.9487 4.6709 4.6709 7.1223 7.1223 8.4069 8.4069 9.6298 9.6298 9.8662 9.8662 10.3644 10.3644 10.4633 10.4633 11.0569 11.0569 11.1260 11.1260 12.7515 12.7515 13.4235 13.4235 13.5093 13.5093 13.6952 13.6952 k =-0.5000 0.1256 0.6060 ( 3792 PWs) bands (ev): -36.9409 -36.9409 -36.9357 -36.9357 -16.2476 -16.2476 -16.2277 -16.2277 -14.5462 -14.5462 -14.5091 -14.5091 -14.4708 -14.4708 -14.4597 -14.4597 0.3762 0.3762 1.0373 1.0373 4.0691 4.0691 4.8166 4.8166 7.0799 7.0799 8.3514 8.3514 9.6004 9.6004 9.9129 9.9129 10.3695 10.3695 10.4551 10.4551 11.0765 11.0765 11.1681 11.1681 12.8066 12.8066 13.3411 13.3411 13.4798 13.4798 13.7587 13.7587 k =-0.5000 0.1256 0.5818 ( 3792 PWs) bands (ev): -36.9413 -36.9413 -36.9358 -36.9358 -16.2471 -16.2471 -16.2262 -16.2262 -14.5454 -14.5454 -14.5060 -14.5060 -14.4703 -14.4703 -14.4591 -14.4591 0.3049 0.3049 0.9695 0.9695 4.1863 4.1863 4.9636 4.9636 7.0447 7.0447 8.2972 8.2972 9.5699 9.5699 9.9483 9.9483 10.3506 10.3506 10.4701 10.4701 11.0734 11.0734 11.2456 11.2456 12.8578 12.8578 13.2558 13.2558 13.4441 13.4441 13.8357 13.8357 k =-0.5000 0.1256 0.5576 ( 3788 PWs) bands (ev): -36.9416 -36.9416 -36.9359 -36.9359 -16.2466 -16.2466 -16.2247 -16.2247 -14.5446 -14.5446 -14.5030 -14.5030 -14.4697 -14.4697 -14.4584 -14.4584 0.2362 0.2362 0.9043 0.9043 4.2994 4.2994 5.1120 5.1120 7.0177 7.0177 8.2445 8.2445 9.5384 9.5384 9.9720 9.9720 10.3255 10.3255 10.4897 10.4897 11.0763 11.0763 11.3300 11.3300 12.9051 12.9051 13.1712 13.1712 13.4100 13.4100 13.9153 13.9153 k =-0.5000 0.1256 0.5333 ( 3788 PWs) bands (ev): -36.9420 -36.9420 -36.9360 -36.9360 -16.2460 -16.2460 -16.2232 -16.2232 -14.5439 -14.5439 -14.5001 -14.5001 -14.4689 -14.4689 -14.4576 -14.4576 0.1702 0.1702 0.8418 0.8418 4.4075 4.4075 5.2615 5.2615 6.9997 6.9997 8.1934 8.1934 9.5063 9.5063 9.9840 9.9840 10.3012 10.3012 10.5064 10.5064 11.0876 11.0876 11.4178 11.4178 12.9472 12.9472 13.0888 13.0888 13.3802 13.3802 13.9941 13.9941 k =-0.5000 0.1256 0.5091 ( 3792 PWs) bands (ev): -36.9423 -36.9423 -36.9361 -36.9361 -16.2454 -16.2454 -16.2217 -16.2217 -14.5433 -14.5433 -14.4973 -14.4973 -14.4681 -14.4681 -14.4567 -14.4567 0.1070 0.1070 0.7819 0.7819 4.5097 4.5097 5.4119 5.4119 6.9917 6.9917 8.1440 8.1440 9.4736 9.4736 9.9856 9.9856 10.2791 10.2791 10.5180 10.5180 11.1062 11.1062 11.5085 11.5085 12.9703 12.9703 13.0228 13.0228 13.3561 13.3561 14.0698 14.0698 k =-0.5000 0.1256 0.4848 ( 3792 PWs) bands (ev): -36.9427 -36.9427 -36.9362 -36.9362 -16.2449 -16.2449 -16.2203 -16.2203 -14.5427 -14.5427 -14.4948 -14.4948 -14.4671 -14.4671 -14.4557 -14.4557 0.0465 0.0465 0.7247 0.7247 4.6047 4.6047 5.5631 5.5631 6.9946 6.9946 8.0964 8.0964 9.4407 9.4407 9.9782 9.9782 10.2597 10.2597 10.5235 10.5235 11.1302 11.1302 11.6017 11.6017 12.9114 12.9114 13.0363 13.0363 13.3382 13.3382 14.1371 14.1371 k =-0.5000 0.1256 0.4606 ( 3800 PWs) bands (ev): -36.9431 -36.9431 -36.9364 -36.9364 -16.2443 -16.2443 -16.2188 -16.2188 -14.5422 -14.5422 -14.4924 -14.4924 -14.4660 -14.4660 -14.4545 -14.4545 -0.0112 -0.0112 0.6702 0.6702 4.6918 4.6918 5.7149 5.7149 7.0094 7.0094 8.0508 8.0508 9.4079 9.4079 9.9637 9.9637 10.2427 10.2427 10.5223 10.5223 11.1572 11.1572 11.6974 11.6974 12.8322 12.8322 13.0677 13.0677 13.3268 13.3268 14.1430 14.1430 k =-0.5000 0.1256 0.4363 ( 3796 PWs) bands (ev): -36.9434 -36.9434 -36.9365 -36.9365 -16.2437 -16.2437 -16.2174 -16.2174 -14.5418 -14.5418 -14.4902 -14.4902 -14.4647 -14.4647 -14.4532 -14.4532 -0.0661 -0.0661 0.6184 0.6184 4.7700 4.7700 5.8670 5.8670 7.0366 7.0366 8.0073 8.0073 9.3753 9.3753 9.9436 9.9436 10.2280 10.2280 10.5143 10.5143 11.1847 11.1847 11.7954 11.7954 12.7523 12.7523 13.0977 13.0977 13.3220 13.3220 14.1173 14.1173 k =-0.5000 0.1256 0.4121 ( 3794 PWs) bands (ev): -36.9437 -36.9437 -36.9366 -36.9366 -16.2431 -16.2431 -16.2161 -16.2161 -14.5414 -14.5414 -14.4883 -14.4883 -14.4634 -14.4634 -14.4517 -14.4517 -0.1181 -0.1181 0.5693 0.5693 4.8388 4.8388 6.0190 6.0190 7.0769 7.0769 7.9659 7.9659 9.3433 9.3433 9.9195 9.9195 10.2156 10.2156 10.4993 10.4993 11.2104 11.2104 11.8955 11.8955 12.6733 12.6733 13.1252 13.1252 13.3234 13.3234 14.0920 14.0920 k =-0.5000 0.1256 0.3879 ( 3790 PWs) bands (ev): -36.9440 -36.9440 -36.9367 -36.9367 -16.2426 -16.2426 -16.2148 -16.2148 -14.5411 -14.5411 -14.4866 -14.4866 -14.4620 -14.4620 -14.4501 -14.4501 -0.1673 -0.1673 0.5229 0.5229 4.8979 4.8979 6.1706 6.1706 7.1301 7.1301 7.9270 7.9270 9.3120 9.3120 9.8926 9.8926 10.2051 10.2051 10.4772 10.4772 11.2323 11.2323 11.9977 11.9977 12.5957 12.5957 13.1501 13.1501 13.3308 13.3308 14.0685 14.0685 k =-0.5000 0.1256 0.3636 ( 3790 PWs) bands (ev): -36.9443 -36.9443 -36.9368 -36.9368 -16.2420 -16.2420 -16.2135 -16.2135 -14.5409 -14.5409 -14.4852 -14.4852 -14.4606 -14.4606 -14.4483 -14.4483 -0.2137 -0.2137 0.4793 0.4793 4.9475 4.9475 6.3213 6.3213 7.1961 7.1961 7.8906 7.8906 9.2816 9.2816 9.8637 9.8637 10.1964 10.1964 10.4481 10.4481 11.2486 11.2486 12.1016 12.1016 12.5203 12.5203 13.1725 13.1725 13.3436 13.3436 14.0471 14.0471 k =-0.5000 0.1256 0.3394 ( 3790 PWs) bands (ev): -36.9447 -36.9447 -36.9369 -36.9369 -16.2415 -16.2415 -16.2123 -16.2123 -14.5407 -14.5407 -14.4840 -14.4840 -14.4591 -14.4591 -14.4464 -14.4464 -0.2571 -0.2571 0.4385 0.4385 4.9881 4.9881 6.4705 6.4705 7.2740 7.2740 7.8571 7.8571 9.2525 9.2525 9.8338 9.8338 10.1892 10.1892 10.4121 10.4121 11.2575 11.2575 12.2070 12.2070 12.4479 12.4479 13.1925 13.1925 13.3612 13.3612 14.0277 14.0277 k =-0.5000 0.1256 0.3151 ( 3796 PWs) bands (ev): -36.9449 -36.9449 -36.9371 -36.9371 -16.2410 -16.2410 -16.2111 -16.2111 -14.5406 -14.5406 -14.4830 -14.4830 -14.4576 -14.4576 -14.4445 -14.4445 -0.2977 -0.2977 0.4004 0.4004 5.0203 5.0203 6.6175 6.6175 7.3628 7.3628 7.8268 7.8268 9.2247 9.2247 9.8033 9.8033 10.1833 10.1833 10.3693 10.3693 11.2578 11.2578 12.3136 12.3136 12.3796 12.3796 13.2104 13.2104 13.3827 13.3827 14.0104 14.0104 k =-0.5000 0.1256 0.2909 ( 3792 PWs) bands (ev): -36.9452 -36.9452 -36.9372 -36.9372 -16.2405 -16.2405 -16.2101 -16.2101 -14.5405 -14.5405 -14.4822 -14.4822 -14.4562 -14.4562 -14.4426 -14.4426 -0.3353 -0.3353 0.3651 0.3651 5.0453 5.0453 6.7613 6.7613 7.4612 7.4612 7.8002 7.8002 9.1985 9.1985 9.7728 9.7728 10.1784 10.1784 10.3201 10.3201 11.2484 11.2484 12.3157 12.3157 12.4217 12.4217 13.2263 13.2263 13.4074 13.4074 13.9949 13.9949 k =-0.5000 0.1256 0.2667 ( 3782 PWs) bands (ev): -36.9454 -36.9454 -36.9373 -36.9373 -16.2400 -16.2400 -16.2090 -16.2090 -14.5405 -14.5405 -14.4815 -14.4815 -14.4548 -14.4548 -14.4406 -14.4406 -0.3699 -0.3699 0.3326 0.3326 5.0641 5.0641 6.9006 6.9006 7.5675 7.5675 7.7782 7.7782 9.1738 9.1738 9.7425 9.7425 10.1739 10.1739 10.2651 10.2651 11.2288 11.2288 12.2584 12.2584 12.5296 12.5296 13.2405 13.2405 13.4346 13.4346 13.9813 13.9813 k =-0.5000 0.1256 0.2424 ( 3782 PWs) bands (ev): -36.9456 -36.9456 -36.9374 -36.9374 -16.2396 -16.2396 -16.2081 -16.2081 -14.5405 -14.5405 -14.4809 -14.4809 -14.4534 -14.4534 -14.4387 -14.4387 -0.4017 -0.4017 0.3028 0.3028 5.0777 5.0777 7.0332 7.0332 7.6793 7.6793 7.7629 7.7629 9.1510 9.1510 9.7126 9.7126 10.1672 10.1672 10.2069 10.2069 11.1992 11.1992 12.2078 12.2078 12.6375 12.6375 13.2530 13.2530 13.4633 13.4633 13.9694 13.9694 k =-0.5000 0.1256 0.2182 ( 3788 PWs) bands (ev): -36.9458 -36.9458 -36.9375 -36.9375 -16.2392 -16.2392 -16.2072 -16.2072 -14.5405 -14.5405 -14.4805 -14.4805 -14.4521 -14.4521 -14.4369 -14.4369 -0.4304 -0.4304 0.2759 0.2759 5.0871 5.0871 7.1564 7.1564 7.7475 7.7475 7.8039 7.8039 9.1299 9.1299 9.6834 9.6834 10.1278 10.1278 10.1764 10.1764 11.1604 11.1604 12.1643 12.1643 12.7444 12.7444 13.2643 13.2643 13.4926 13.4926 13.9590 13.9590 k =-0.5000 0.1256 0.1939 ( 3796 PWs) bands (ev): -36.9461 -36.9461 -36.9376 -36.9376 -16.2388 -16.2388 -16.2065 -16.2065 -14.5405 -14.5405 -14.4801 -14.4801 -14.4509 -14.4509 -14.4352 -14.4352 -0.4561 -0.4561 0.2518 0.2518 5.0933 5.0933 7.2655 7.2655 7.7520 7.7520 7.9229 7.9229 9.1108 9.1108 9.6550 9.6550 10.0576 10.0576 10.1719 10.1719 11.1141 11.1141 12.1279 12.1279 12.8492 12.8492 13.2744 13.2744 13.5218 13.5218 13.9501 13.9501 k =-0.5000 0.1256 0.1697 ( 3794 PWs) bands (ev): -36.9462 -36.9462 -36.9377 -36.9377 -16.2385 -16.2385 -16.2058 -16.2058 -14.5406 -14.5406 -14.4798 -14.4798 -14.4498 -14.4498 -14.4336 -14.4336 -0.4789 -0.4789 0.2305 0.2305 5.0971 5.0971 7.3543 7.3543 7.7701 7.7701 8.0457 8.0457 9.0938 9.0938 9.6275 9.6275 9.9806 9.9806 10.1701 10.1701 11.0627 11.0627 12.0981 12.0981 12.9504 12.9504 13.2840 13.2840 13.5500 13.5500 13.9427 13.9427 k =-0.5000 0.1256 0.1454 ( 3786 PWs) bands (ev): -36.9464 -36.9464 -36.9377 -36.9377 -16.2382 -16.2382 -16.2052 -16.2052 -14.5407 -14.5407 -14.4796 -14.4796 -14.4489 -14.4489 -14.4322 -14.4322 -0.4986 -0.4986 0.2120 0.2120 5.0992 5.0992 7.4174 7.4174 7.8075 7.8075 8.1683 8.1683 9.0787 9.0787 9.6012 9.6012 9.8996 9.8996 10.1691 10.1691 11.0092 11.0092 12.0742 12.0742 13.0457 13.0457 13.2937 13.2937 13.5764 13.5764 13.9364 13.9364 k =-0.5000 0.1256 0.1212 ( 3782 PWs) bands (ev): -36.9465 -36.9465 -36.9377 -36.9377 -16.2379 -16.2379 -16.2047 -16.2047 -14.5407 -14.5407 -14.4794 -14.4794 -14.4480 -14.4480 -14.4310 -14.4310 -0.5153 -0.5153 0.1964 0.1964 5.1000 5.1000 7.4554 7.4554 7.8615 7.8615 8.2881 8.2881 9.0658 9.0658 9.5764 9.5764 9.8166 9.8166 10.1685 10.1685 10.9566 10.9566 12.0553 12.0553 13.1313 13.1313 13.3055 13.3055 13.6005 13.6005 13.9006 13.9006 k =-0.5000 0.1256 0.0970 ( 3780 PWs) bands (ev): -36.9466 -36.9466 -36.9378 -36.9378 -16.2377 -16.2377 -16.2042 -16.2042 -14.5408 -14.5408 -14.4793 -14.4793 -14.4473 -14.4473 -14.4300 -14.4300 -0.5290 -0.5290 0.1836 0.1836 5.1001 5.1001 7.4754 7.4754 7.9227 7.9227 8.4018 8.4018 9.0550 9.0550 9.5536 9.5536 9.7342 9.7342 10.1681 10.1681 10.9081 10.9081 12.0409 12.0409 13.2003 13.2003 13.3235 13.3235 13.6218 13.6218 13.8423 13.8423 k =-0.5000 0.1256 0.0727 ( 3776 PWs) bands (ev): -36.9467 -36.9467 -36.9378 -36.9378 -16.2375 -16.2375 -16.2039 -16.2039 -14.5408 -14.5408 -14.4792 -14.4792 -14.4467 -14.4467 -14.4292 -14.4292 -0.5397 -0.5397 0.1736 0.1736 5.0998 5.0998 7.4850 7.4850 7.9806 7.9806 8.5050 8.5050 9.0464 9.0464 9.5333 9.5333 9.6569 9.6569 10.1679 10.1679 10.8668 10.8668 12.0302 12.0302 13.2436 13.2436 13.3537 13.3537 13.6400 13.6400 13.7946 13.7946 k =-0.5000 0.1256 0.0485 ( 3780 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2374 -16.2374 -16.2037 -16.2037 -14.5408 -14.5408 -14.4791 -14.4791 -14.4463 -14.4463 -14.4286 -14.4286 -0.5473 -0.5473 0.1665 0.1665 5.0994 5.0994 7.4893 7.4893 8.0274 8.0274 8.5907 8.5907 9.0400 9.0400 9.5158 9.5158 9.5917 9.5917 10.1678 10.1678 10.8351 10.8351 12.0229 12.0229 13.2637 13.2637 13.3901 13.3901 13.6551 13.6551 13.7582 13.7582 k =-0.5000 0.1256 0.0242 ( 3780 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2374 -16.2374 -16.2035 -16.2035 -14.5409 -14.5409 -14.4791 -14.4791 -14.4461 -14.4461 -14.4283 -14.4283 -0.5519 -0.5519 0.1622 0.1622 5.0991 5.0991 7.4910 7.4910 8.0577 8.0577 8.6494 8.6494 9.0360 9.0360 9.5009 9.5009 9.5494 9.5494 10.1678 10.1678 10.8153 10.8153 12.0187 12.0187 13.2718 13.2718 13.4175 13.4175 13.6667 13.6667 13.7337 13.7337 k =-0.5000 0.1256 0.0000 ( 3762 PWs) bands (ev): -36.9468 -36.9468 -36.9378 -36.9378 -16.2373 -16.2373 -16.2035 -16.2035 -14.5409 -14.5409 -14.4791 -14.4791 -14.4460 -14.4460 -14.4281 -14.4281 -0.5534 -0.5534 0.1608 0.1608 5.0990 5.0990 7.4914 7.4914 8.0681 8.0681 8.6706 8.6706 9.0346 9.0346 9.4934 9.4934 9.5361 9.5361 10.1678 10.1678 10.8085 10.8085 12.0173 12.0173 13.2741 13.2741 13.4275 13.4275 13.6718 13.6718 13.7243 13.7243 k = 0.0000 0.0000 1.0181 ( 3800 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5466 -14.5466 -14.5466 -14.5466 -14.4701 -14.4701 -14.4701 -14.4701 1.8061 1.8061 1.8061 1.8061 2.8861 2.8861 2.8861 2.8861 7.4634 7.4634 7.4634 7.4634 9.8983 9.8983 9.8983 9.8983 10.5726 10.5726 10.5726 10.5726 12.2117 12.2117 12.2117 12.2117 12.4222 12.4222 12.4222 12.4222 13.9468 13.9468 13.9468 13.9468 k =-0.0238 0.0060 1.0181 ( 3806 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5466 -14.5466 -14.5466 -14.5466 -14.4701 -14.4701 -14.4701 -14.4701 1.8067 1.8067 1.8067 1.8067 2.8847 2.8847 2.8847 2.8847 7.4669 7.4669 7.4669 7.4669 9.8993 9.8993 9.8993 9.8993 10.5681 10.5681 10.5681 10.5681 12.2101 12.2101 12.2101 12.2101 12.4152 12.4152 12.4152 12.4152 13.9562 13.9562 13.9562 13.9562 k =-0.0476 0.0120 1.0181 ( 3802 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5466 -14.5466 -14.5466 -14.5466 -14.4700 -14.4700 -14.4700 -14.4700 1.8087 1.8087 1.8087 1.8087 2.8806 2.8806 2.8806 2.8806 7.4774 7.4774 7.4774 7.4774 9.9023 9.9023 9.9023 9.9023 10.5547 10.5547 10.5547 10.5547 12.2054 12.2054 12.2054 12.2054 12.3949 12.3949 12.3949 12.3949 13.9839 13.9839 13.9839 13.9839 k =-0.0714 0.0179 1.0181 ( 3798 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5467 -14.5467 -14.5467 -14.5467 -14.4699 -14.4699 -14.4699 -14.4699 1.8119 1.8119 1.8119 1.8119 2.8738 2.8738 2.8738 2.8738 7.4948 7.4948 7.4948 7.4948 9.9072 9.9072 9.9072 9.9072 10.5324 10.5324 10.5324 10.5324 12.1976 12.1976 12.1976 12.1976 12.3632 12.3632 12.3632 12.3632 14.0282 14.0282 14.0282 14.0282 k =-0.0952 0.0239 1.0181 ( 3802 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5468 -14.5468 -14.5468 -14.5468 -14.4698 -14.4698 -14.4698 -14.4698 1.8163 1.8163 1.8163 1.8163 2.8645 2.8645 2.8645 2.8645 7.5189 7.5189 7.5189 7.5189 9.9140 9.9140 9.9140 9.9140 10.5015 10.5015 10.5015 10.5015 12.1863 12.1863 12.1863 12.1863 12.3231 12.3231 12.3231 12.3231 14.0868 14.0868 14.0868 14.0868 k =-0.1190 0.0299 1.0181 ( 3806 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5470 -14.5470 -14.5470 -14.5470 -14.4697 -14.4697 -14.4697 -14.4697 1.8220 1.8220 1.8220 1.8220 2.8528 2.8528 2.8528 2.8528 7.5495 7.5495 7.5495 7.5495 9.9226 9.9226 9.9226 9.9226 10.4622 10.4622 10.4622 10.4622 12.1701 12.1701 12.1701 12.1701 12.2792 12.2792 12.2792 12.2792 14.1571 14.1571 14.1571 14.1571 k =-0.1429 0.0359 1.0181 ( 3802 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5471 -14.5471 -14.5471 -14.5471 -14.4695 -14.4695 -14.4695 -14.4695 1.8288 1.8288 1.8288 1.8288 2.8390 2.8390 2.8390 2.8390 7.5864 7.5864 7.5864 7.5864 9.9330 9.9330 9.9330 9.9330 10.4150 10.4150 10.4150 10.4150 12.1448 12.1448 12.1448 12.1448 12.2385 12.2385 12.2385 12.2385 14.2365 14.2365 14.2365 14.2365 k =-0.1667 0.0419 1.0181 ( 3802 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5473 -14.5473 -14.5473 -14.5473 -14.4693 -14.4693 -14.4693 -14.4693 1.8366 1.8366 1.8366 1.8366 2.8233 2.8233 2.8233 2.8233 7.6291 7.6291 7.6291 7.6291 9.9448 9.9448 9.9448 9.9448 10.3604 10.3604 10.3604 10.3604 12.1048 12.1048 12.1048 12.1048 12.2090 12.2090 12.2090 12.2090 14.3217 14.3217 14.3217 14.3217 k =-0.1905 0.0478 1.0181 ( 3806 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5475 -14.5475 -14.5475 -14.5475 -14.4691 -14.4691 -14.4691 -14.4691 1.8455 1.8455 1.8455 1.8455 2.8060 2.8060 2.8060 2.8060 7.6773 7.6773 7.6773 7.6773 9.9580 9.9580 9.9580 9.9580 10.2991 10.2991 10.2991 10.2991 12.0523 12.0523 12.0523 12.0523 12.1908 12.1908 12.1908 12.1908 14.4038 14.4038 14.4038 14.4038 k =-0.2143 0.0538 1.0181 ( 3806 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5477 -14.5477 -14.5477 -14.5477 -14.4689 -14.4689 -14.4689 -14.4689 1.8551 1.8551 1.8551 1.8551 2.7875 2.7875 2.7875 2.7875 7.7305 7.7305 7.7305 7.7305 9.9721 9.9721 9.9721 9.9721 10.2322 10.2322 10.2322 10.2322 11.9939 11.9939 11.9939 11.9939 12.1790 12.1790 12.1790 12.1790 14.4409 14.4409 14.4409 14.4409 k =-0.2381 0.0598 1.0181 ( 3792 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5479 -14.5479 -14.5479 -14.5479 -14.4686 -14.4686 -14.4686 -14.4686 1.8654 1.8654 1.8654 1.8654 2.7680 2.7680 2.7680 2.7680 7.7882 7.7882 7.7882 7.7882 9.9865 9.9865 9.9865 9.9865 10.1609 10.1609 10.1609 10.1609 11.9337 11.9337 11.9337 11.9337 12.1708 12.1708 12.1708 12.1708 14.4422 14.4422 14.4422 14.4422 k =-0.2619 0.0658 1.0181 ( 3796 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2476 -16.2476 -16.2476 -16.2476 -14.5481 -14.5481 -14.5481 -14.5481 -14.4684 -14.4684 -14.4684 -14.4684 1.8763 1.8763 1.8763 1.8763 2.7480 2.7480 2.7480 2.7480 7.8497 7.8497 7.8497 7.8497 9.9983 9.9983 9.9983 9.9983 10.0888 10.0888 10.0888 10.0888 11.8740 11.8740 11.8740 11.8740 12.1652 12.1652 12.1652 12.1652 14.4364 14.4364 14.4364 14.4364 k =-0.2857 0.0718 1.0181 ( 3800 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2477 -16.2477 -16.2477 -16.2477 -14.5483 -14.5483 -14.5483 -14.5483 -14.4682 -14.4682 -14.4682 -14.4682 1.8874 1.8874 1.8874 1.8874 2.7279 2.7279 2.7279 2.7279 7.9143 7.9143 7.9143 7.9143 9.9818 9.9818 9.9818 9.9818 10.0425 10.0425 10.0425 10.0425 11.8161 11.8161 11.8161 11.8161 12.1615 12.1615 12.1615 12.1615 14.4278 14.4278 14.4278 14.4278 k =-0.3095 0.0777 1.0181 ( 3810 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5485 -14.5485 -14.5485 -14.5485 -14.4679 -14.4679 -14.4679 -14.4679 1.8987 1.8987 1.8987 1.8987 2.7081 2.7081 2.7081 2.7081 7.9811 7.9811 7.9811 7.9811 9.9121 9.9121 9.9121 9.9121 10.0478 10.0478 10.0478 10.0478 11.7613 11.7613 11.7613 11.7613 12.1594 12.1594 12.1594 12.1594 14.4175 14.4175 14.4175 14.4175 k =-0.3333 0.0837 1.0181 ( 3810 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5487 -14.5487 -14.5487 -14.5487 -14.4677 -14.4677 -14.4677 -14.4677 1.9098 1.9098 1.9098 1.9098 2.6890 2.6890 2.6890 2.6890 8.0490 8.0490 8.0490 8.0490 9.8328 9.8328 9.8328 9.8328 10.0622 10.0622 10.0622 10.0622 11.7103 11.7103 11.7103 11.7103 12.1584 12.1584 12.1584 12.1584 14.4062 14.4062 14.4062 14.4062 k =-0.3571 0.0897 1.0181 ( 3814 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5489 -14.5489 -14.5489 -14.5489 -14.4675 -14.4675 -14.4675 -14.4675 1.9204 1.9204 1.9204 1.9204 2.6711 2.6711 2.6711 2.6711 8.1165 8.1165 8.1165 8.1165 9.7534 9.7534 9.7534 9.7534 10.0773 10.0773 10.0773 10.0773 11.6641 11.6641 11.6641 11.6641 12.1583 12.1583 12.1583 12.1583 14.3946 14.3946 14.3946 14.3946 k =-0.3810 0.0957 1.0181 ( 3818 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5490 -14.5490 -14.5490 -14.5490 -14.4674 -14.4674 -14.4674 -14.4674 1.9302 1.9302 1.9302 1.9302 2.6548 2.6548 2.6548 2.6548 8.1819 8.1819 8.1819 8.1819 9.6773 9.6773 9.6773 9.6773 10.0917 10.0917 10.0917 10.0917 11.6235 11.6235 11.6235 11.6235 12.1588 12.1588 12.1588 12.1588 14.3834 14.3834 14.3834 14.3834 k =-0.4048 0.1017 1.0181 ( 3816 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5491 -14.5491 -14.5491 -14.5491 -14.4672 -14.4672 -14.4672 -14.4672 1.9388 1.9388 1.9388 1.9388 2.6407 2.6407 2.6407 2.6407 8.2429 8.2429 8.2429 8.2429 9.6070 9.6070 9.6070 9.6070 10.1044 10.1044 10.1044 10.1044 11.5890 11.5890 11.5890 11.5890 12.1597 12.1597 12.1597 12.1597 14.3732 14.3732 14.3732 14.3732 k =-0.4286 0.1076 1.0181 ( 3810 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5492 -14.5492 -14.5492 -14.5492 -14.4671 -14.4671 -14.4671 -14.4671 1.9460 1.9460 1.9460 1.9460 2.6292 2.6292 2.6292 2.6292 8.2964 8.2964 8.2964 8.2964 9.5461 9.5461 9.5461 9.5461 10.1150 10.1150 10.1150 10.1150 11.5614 11.5614 11.5614 11.5614 12.1606 12.1606 12.1606 12.1606 14.3645 14.3645 14.3645 14.3645 k =-0.4524 0.1136 1.0181 ( 3804 PWs) bands (ev): -36.9361 -36.9361 -36.9361 -36.9361 -16.2477 -16.2477 -16.2477 -16.2477 -14.5493 -14.5493 -14.5493 -14.5493 -14.4670 -14.4670 -14.4670 -14.4670 1.9514 1.9514 1.9514 1.9514 2.6207 2.6207 2.6207 2.6207 8.3389 8.3389 8.3389 8.3389 9.4982 9.4982 9.4982 9.4982 10.1230 10.1230 10.1230 10.1230 11.5413 11.5413 11.5413 11.5413 12.1615 12.1615 12.1615 12.1615 14.3580 14.3580 14.3580 14.3580 k =-0.4762 0.1196 1.0181 ( 3808 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5494 -14.5494 -14.5494 -14.5494 -14.4670 -14.4670 -14.4670 -14.4670 1.9547 1.9547 1.9547 1.9547 2.6154 2.6154 2.6154 2.6154 8.3664 8.3664 8.3664 8.3664 9.4673 9.4673 9.4673 9.4673 10.1279 10.1279 10.1279 10.1279 11.5290 11.5290 11.5290 11.5290 12.1620 12.1620 12.1620 12.1620 14.3539 14.3539 14.3539 14.3539 k =-0.5000 0.1256 1.0181 ( 3820 PWs) bands (ev): -36.9362 -36.9362 -36.9362 -36.9362 -16.2477 -16.2477 -16.2477 -16.2477 -14.5494 -14.5494 -14.5494 -14.5494 -14.4670 -14.4670 -14.4670 -14.4670 1.9559 1.9559 1.9559 1.9559 2.6136 2.6136 2.6136 2.6136 8.3760 8.3760 8.3760 8.3760 9.4565 9.4565 9.4565 9.4565 10.1296 10.1296 10.1296 10.1296 11.5249 11.5249 11.5249 11.5249 12.1622 12.1622 12.1622 12.1622 14.3525 14.3525 14.3525 14.3525 Writing output data file ZrGe2.save init_run : 3.72s CPU 12.95s WALL ( 1 calls) electrons : 739.28s CPU 748.73s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.33s CPU 1.35s WALL ( 1 calls) Called by electrons: c_bands : 739.18s CPU 748.42s WALL ( 1 calls) v_of_rho : 0.14s CPU 0.90s WALL ( 1 calls) v_h : 0.00s CPU 0.01s WALL ( 1 calls) v_xc : 0.13s CPU 0.50s WALL ( 1 calls) newd : 0.31s CPU 0.46s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.19s WALL ( 414 calls) cegterg : 640.46s CPU 645.48s WALL ( 768 calls) Called by sum_band: Called by *egterg: h_psi : 346.02s CPU 353.91s WALL ( 12050 calls) s_psi : 26.37s CPU 26.85s WALL ( 12050 calls) g_psi : 0.64s CPU 0.69s WALL ( 10868 calls) cdiaghg : 213.47s CPU 211.47s WALL ( 11282 calls) cegterg:over : 50.11s CPU 46.90s WALL ( 10868 calls) cegterg:upda : 9.95s CPU 13.20s WALL ( 10868 calls) cegterg:last : 8.60s CPU 9.39s WALL ( 2093 calls) Called by h_psi: h_psi:vloc : 291.73s CPU 298.50s WALL ( 12050 calls) h_psi:vnl : 54.00s CPU 54.70s WALL ( 12050 calls) add_vuspsi : 16.95s CPU 20.78s WALL ( 12050 calls) General routines calbec : 37.02s CPU 33.85s WALL ( 12050 calls) fft : 0.13s CPU 0.88s WALL ( 19 calls) ffts : 0.04s CPU 0.09s WALL ( 4 calls) fftw : 276.91s CPU 280.26s WALL ( 1281896 calls) interpolate : 0.05s CPU 0.09s WALL ( 4 calls) davcio : 0.04s CPU 3.00s WALL ( 828 calls) Parallel routines fft_scatter : 149.50s CPU 149.31s WALL ( 1281919 calls) PWSCF : 13m28.83s CPU 16m11.95s WALL This run was terminated on: 13:33:17 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. 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