Program PWSCF v.5.1.1 starts on 22Jul2015 at 1:59:46 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 64 processors R & G space division: proc/nbgrp/npool/nimage = 64 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: ./ZrBi.save/ 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 18 18 5 1492 1492 225 Max 19 19 6 1507 1507 238 Sum 1185 1185 333 95893 95893 14637 bravais-lattice index = 14 lattice parameter (alat) = 10.8094 a.u. unit-cell volume = 2008.3485 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 200.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.809376 celldm(2)= 1.000000 celldm(3)= 2.504337 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.772547 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.772547 0.634957 0.000000 ) a(3) = ( 0.000000 0.000000 2.504337 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.216692 -0.000000 ) b(2) = ( 0.000000 1.574910 -0.000000 ) b(3) = ( 0.000000 0.000000 0.399307 ) PseudoPot. # 1 for Zr read from file: /home/autes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Bi read from file: /home/autes/Pseudo/Bi_MT_PBE.UPF MD5 check sum: b574f8a1102dd4d1778b4090b55884d0 Pseudo is Norm-conserving, Zval = 5.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1283 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Bi 5.00 208.98040 Bi( 1.00) 2 Sym. Ops., with inversion, found (note: 2 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) 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 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 312 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0061322 0.0171186 -0.0000000), wk = 0.0032051 k( 3) = ( 0.0122643 0.0342372 -0.0000000), wk = 0.0032051 k( 4) = ( 0.0183965 0.0513558 -0.0000000), wk = 0.0032051 k( 5) = ( 0.0245287 0.0684743 -0.0000000), wk = 0.0032051 k( 6) = ( 0.0306609 0.0855929 -0.0000000), wk = 0.0032051 k( 7) = ( 0.0367930 0.1027115 -0.0000000), wk = 0.0032051 k( 8) = ( 0.0429252 0.1198301 -0.0000000), wk = 0.0032051 k( 9) = ( 0.0490574 0.1369486 -0.0000000), wk = 0.0032051 k( 10) = ( 0.0551895 0.1540673 -0.0000000), wk = 0.0032051 k( 11) = ( 0.0613217 0.1711858 -0.0000000), wk = 0.0032051 k( 12) = ( 0.0674539 0.1883044 -0.0000000), wk = 0.0032051 k( 13) = ( 0.0735861 0.2054230 -0.0000000), wk = 0.0032051 k( 14) = ( 0.0797182 0.2225416 -0.0000000), wk = 0.0032051 k( 15) = ( 0.0858504 0.2396602 -0.0000000), wk = 0.0032051 k( 16) = ( 0.0919826 0.2567787 -0.0000000), wk = 0.0032051 k( 17) = ( 0.0981148 0.2738973 -0.0000000), wk = 0.0032051 k( 18) = ( 0.1042469 0.2910159 -0.0000000), wk = 0.0032051 k( 19) = ( 0.1103791 0.3081345 -0.0000000), wk = 0.0032051 k( 20) = ( 0.1165113 0.3252531 -0.0000000), wk = 0.0032051 k( 21) = ( 0.1226434 0.3423717 -0.0000000), wk = 0.0032051 k( 22) = ( 0.1287756 0.3594902 -0.0000000), wk = 0.0032051 k( 23) = ( 0.1349078 0.3766088 -0.0000000), wk = 0.0032051 k( 24) = ( 0.1410399 0.3937274 -0.0000000), wk = 0.0032051 k( 25) = ( 0.1471721 0.4108460 -0.0000000), wk = 0.0032051 k( 26) = ( 0.1533043 0.4279646 -0.0000000), wk = 0.0032051 k( 27) = ( 0.1594365 0.4450831 -0.0000000), wk = 0.0032051 k( 28) = ( 0.1655686 0.4622017 -0.0000000), wk = 0.0032051 k( 29) = ( 0.1717008 0.4793203 -0.0000000), wk = 0.0032051 k( 30) = ( 0.1778330 0.4964389 -0.0000000), wk = 0.0032051 k( 31) = ( 0.1839651 0.5135575 -0.0000000), wk = 0.0032051 k( 32) = ( 0.1900973 0.5306761 -0.0000000), wk = 0.0032051 k( 33) = ( 0.1962295 0.5477946 -0.0000000), wk = 0.0032051 k( 34) = ( 0.2023617 0.5649132 -0.0000000), wk = 0.0032051 k( 35) = ( 0.2084938 0.5820318 -0.0000000), wk = 0.0032051 k( 36) = ( 0.2146260 0.5991504 -0.0000000), wk = 0.0032051 k( 37) = ( 0.2207582 0.6162690 -0.0000000), wk = 0.0032051 k( 38) = ( 0.2268904 0.6333876 -0.0000000), wk = 0.0032051 k( 39) = ( 0.2330225 0.6505061 -0.0000000), wk = 0.0032051 k( 40) = ( 0.2391547 0.6676247 -0.0000000), wk = 0.0032051 k( 41) = ( 0.2452869 0.6847433 -0.0000000), wk = 0.0032051 k( 42) = ( 0.2514190 0.7018619 -0.0000000), wk = 0.0032051 k( 43) = ( 0.2575512 0.7189805 -0.0000000), wk = 0.0032051 k( 44) = ( 0.2636834 0.7360990 -0.0000000), wk = 0.0032051 k( 45) = ( 0.2698156 0.7532176 -0.0000000), wk = 0.0032051 k( 46) = ( 0.2759477 0.7703362 -0.0000000), wk = 0.0032051 k( 47) = ( 0.2820799 0.7874548 -0.0000000), wk = 0.0032051 k( 48) = ( 0.2820799 0.7874548 -0.0000000), wk = 0.0032051 k( 49) = ( 0.2644499 0.7874548 -0.0000000), wk = 0.0032051 k( 50) = ( 0.2468199 0.7874548 -0.0000000), wk = 0.0032051 k( 51) = ( 0.2291899 0.7874548 -0.0000000), wk = 0.0032051 k( 52) = ( 0.2115599 0.7874548 -0.0000000), wk = 0.0032051 k( 53) = ( 0.1939299 0.7874548 -0.0000000), wk = 0.0032051 k( 54) = ( 0.1762999 0.7874548 -0.0000000), wk = 0.0032051 k( 55) = ( 0.1586700 0.7874548 -0.0000000), wk = 0.0032051 k( 56) = ( 0.1410399 0.7874548 -0.0000000), wk = 0.0032051 k( 57) = ( 0.1234100 0.7874548 -0.0000000), wk = 0.0032051 k( 58) = ( 0.1057800 0.7874548 -0.0000000), wk = 0.0032051 k( 59) = ( 0.0881500 0.7874548 -0.0000000), wk = 0.0032051 k( 60) = ( 0.0705200 0.7874548 -0.0000000), wk = 0.0032051 k( 61) = ( 0.0528900 0.7874548 -0.0000000), wk = 0.0032051 k( 62) = ( 0.0352600 0.7874548 -0.0000000), wk = 0.0032051 k( 63) = ( 0.0176300 0.7874548 -0.0000000), wk = 0.0032051 k( 64) = ( 0.0000000 0.7874548 -0.0000000), wk = 0.0032051 k( 65) = ( 0.0000000 0.7874548 -0.0000000), wk = 0.0032051 k( 66) = ( 0.0000000 0.7874548 0.0181503), wk = 0.0032051 k( 67) = ( 0.0000000 0.7874548 0.0363007), wk = 0.0032051 k( 68) = ( 0.0000000 0.7874548 0.0544510), wk = 0.0032051 k( 69) = ( 0.0000000 0.7874548 0.0726013), wk = 0.0032051 k( 70) = ( 0.0000000 0.7874548 0.0907516), wk = 0.0032051 k( 71) = ( 0.0000000 0.7874548 0.1089020), wk = 0.0032051 k( 72) = ( 0.0000000 0.7874548 0.1270523), wk = 0.0032051 k( 73) = ( 0.0000000 0.7874548 0.1452026), wk = 0.0032051 k( 74) = ( 0.0000000 0.7874548 0.1633529), wk = 0.0032051 k( 75) = ( 0.0000000 0.7874548 0.1815033), wk = 0.0032051 k( 76) = ( 0.0000000 0.7874548 0.1996536), wk = 0.0032051 k( 77) = ( 0.0000000 0.7874548 0.1996536), wk = 0.0032051 k( 78) = ( 0.0176300 0.7874548 0.1996536), wk = 0.0032051 k( 79) = ( 0.0352600 0.7874548 0.1996536), wk = 0.0032051 k( 80) = ( 0.0528900 0.7874548 0.1996536), wk = 0.0032051 k( 81) = ( 0.0705200 0.7874548 0.1996536), wk = 0.0032051 k( 82) = ( 0.0881500 0.7874548 0.1996536), wk = 0.0032051 k( 83) = ( 0.1057800 0.7874548 0.1996536), wk = 0.0032051 k( 84) = ( 0.1234100 0.7874548 0.1996536), wk = 0.0032051 k( 85) = ( 0.1410399 0.7874548 0.1996536), wk = 0.0032051 k( 86) = ( 0.1586700 0.7874548 0.1996536), wk = 0.0032051 k( 87) = ( 0.1762999 0.7874548 0.1996536), wk = 0.0032051 k( 88) = ( 0.1939299 0.7874548 0.1996536), wk = 0.0032051 k( 89) = ( 0.2115599 0.7874548 0.1996536), wk = 0.0032051 k( 90) = ( 0.2291899 0.7874548 0.1996536), wk = 0.0032051 k( 91) = ( 0.2468199 0.7874548 0.1996536), wk = 0.0032051 k( 92) = ( 0.2644499 0.7874548 0.1996536), wk = 0.0032051 k( 93) = ( 0.2820799 0.7874548 0.1996536), wk = 0.0032051 k( 94) = ( 0.2820799 0.7874548 0.1996536), wk = 0.0032051 k( 95) = ( 0.2759477 0.7703362 0.1996536), wk = 0.0032051 k( 96) = ( 0.2698156 0.7532176 0.1996536), wk = 0.0032051 k( 97) = ( 0.2636834 0.7360990 0.1996536), wk = 0.0032051 k( 98) = ( 0.2575512 0.7189805 0.1996536), wk = 0.0032051 k( 99) = ( 0.2514190 0.7018619 0.1996536), wk = 0.0032051 k( 100) = ( 0.2452869 0.6847433 0.1996536), wk = 0.0032051 k( 101) = ( 0.2391547 0.6676247 0.1996536), wk = 0.0032051 k( 102) = ( 0.2330225 0.6505061 0.1996536), wk = 0.0032051 k( 103) = ( 0.2268904 0.6333876 0.1996536), wk = 0.0032051 k( 104) = ( 0.2207582 0.6162690 0.1996536), wk = 0.0032051 k( 105) = ( 0.2146260 0.5991504 0.1996536), wk = 0.0032051 k( 106) = ( 0.2084938 0.5820318 0.1996536), wk = 0.0032051 k( 107) = ( 0.2023617 0.5649132 0.1996536), wk = 0.0032051 k( 108) = ( 0.1962295 0.5477946 0.1996536), wk = 0.0032051 k( 109) = ( 0.1900973 0.5306761 0.1996536), wk = 0.0032051 k( 110) = ( 0.1839651 0.5135575 0.1996536), wk = 0.0032051 k( 111) = ( 0.1778330 0.4964389 0.1996536), wk = 0.0032051 k( 112) = ( 0.1717008 0.4793203 0.1996536), wk = 0.0032051 k( 113) = ( 0.1655686 0.4622017 0.1996536), wk = 0.0032051 k( 114) = ( 0.1594365 0.4450831 0.1996536), wk = 0.0032051 k( 115) = ( 0.1533043 0.4279646 0.1996536), wk = 0.0032051 k( 116) = ( 0.1471721 0.4108460 0.1996536), wk = 0.0032051 k( 117) = ( 0.1410399 0.3937274 0.1996536), wk = 0.0032051 k( 118) = ( 0.1349078 0.3766088 0.1996536), wk = 0.0032051 k( 119) = ( 0.1287756 0.3594902 0.1996536), wk = 0.0032051 k( 120) = ( 0.1226434 0.3423717 0.1996536), wk = 0.0032051 k( 121) = ( 0.1165113 0.3252531 0.1996536), wk = 0.0032051 k( 122) = ( 0.1103791 0.3081345 0.1996536), wk = 0.0032051 k( 123) = ( 0.1042469 0.2910159 0.1996536), wk = 0.0032051 k( 124) = ( 0.0981148 0.2738973 0.1996536), wk = 0.0032051 k( 125) = ( 0.0919826 0.2567787 0.1996536), wk = 0.0032051 k( 126) = ( 0.0858504 0.2396602 0.1996536), wk = 0.0032051 k( 127) = ( 0.0797182 0.2225416 0.1996536), wk = 0.0032051 k( 128) = ( 0.0735861 0.2054230 0.1996536), wk = 0.0032051 k( 129) = ( 0.0674539 0.1883044 0.1996536), wk = 0.0032051 k( 130) = ( 0.0613217 0.1711858 0.1996536), wk = 0.0032051 k( 131) = ( 0.0551895 0.1540673 0.1996536), wk = 0.0032051 k( 132) = ( 0.0490574 0.1369486 0.1996536), wk = 0.0032051 k( 133) = ( 0.0429252 0.1198301 0.1996536), wk = 0.0032051 k( 134) = ( 0.0367930 0.1027115 0.1996536), wk = 0.0032051 k( 135) = ( 0.0306609 0.0855929 0.1996536), wk = 0.0032051 k( 136) = ( 0.0245287 0.0684743 0.1996536), wk = 0.0032051 k( 137) = ( 0.0183965 0.0513558 0.1996536), wk = 0.0032051 k( 138) = ( 0.0122643 0.0342372 0.1996536), wk = 0.0032051 k( 139) = ( 0.0061322 0.0171186 0.1996536), wk = 0.0032051 k( 140) = ( 0.0000000 0.0000000 0.1996536), wk = 0.0032051 k( 141) = ( 0.0000000 0.0000000 0.1996536), wk = 0.0032051 k( 142) = ( 0.0000000 0.0000000 0.1815033), wk = 0.0032051 k( 143) = ( 0.0000000 0.0000000 0.1633529), wk = 0.0032051 k( 144) = ( 0.0000000 0.0000000 0.1452026), wk = 0.0032051 k( 145) = ( 0.0000000 0.0000000 0.1270523), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.1089020), wk = 0.0032051 k( 147) = ( 0.0000000 0.0000000 0.0907516), wk = 0.0032051 k( 148) = ( 0.0000000 0.0000000 0.0726013), wk = 0.0032051 k( 149) = ( 0.0000000 0.0000000 0.0544510), wk = 0.0032051 k( 150) = ( 0.0000000 0.0000000 0.0363007), wk = 0.0032051 k( 151) = ( 0.0000000 0.0000000 0.0181503), wk = 0.0032051 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 154) = ( -0.0166667 0.0059703 0.0000000), wk = 0.0032051 k( 155) = ( -0.0333333 0.0119406 0.0000000), wk = 0.0032051 k( 156) = ( -0.0500000 0.0179109 0.0000000), wk = 0.0032051 k( 157) = ( -0.0666667 0.0238812 0.0000000), wk = 0.0032051 k( 158) = ( -0.0833333 0.0298514 0.0000000), wk = 0.0032051 k( 159) = ( -0.1000000 0.0358217 0.0000000), wk = 0.0032051 k( 160) = ( -0.1166667 0.0417920 0.0000000), wk = 0.0032051 k( 161) = ( -0.1333333 0.0477623 0.0000000), wk = 0.0032051 k( 162) = ( -0.1500000 0.0537326 0.0000000), wk = 0.0032051 k( 163) = ( -0.1666667 0.0597029 0.0000000), wk = 0.0032051 k( 164) = ( -0.1833333 0.0656732 0.0000000), wk = 0.0032051 k( 165) = ( -0.2000000 0.0716435 0.0000000), wk = 0.0032051 k( 166) = ( -0.2166667 0.0776137 0.0000000), wk = 0.0032051 k( 167) = ( -0.2333333 0.0835840 0.0000000), wk = 0.0032051 k( 168) = ( -0.2500000 0.0895543 0.0000000), wk = 0.0032051 k( 169) = ( -0.2666667 0.0955246 0.0000000), wk = 0.0032051 k( 170) = ( -0.2833333 0.1014949 0.0000000), wk = 0.0032051 k( 171) = ( -0.3000000 0.1074652 0.0000000), wk = 0.0032051 k( 172) = ( -0.3166667 0.1134355 0.0000000), wk = 0.0032051 k( 173) = ( -0.3333333 0.1194058 0.0000000), wk = 0.0032051 k( 174) = ( -0.3500000 0.1253760 0.0000000), wk = 0.0032051 k( 175) = ( -0.3666667 0.1313463 0.0000000), wk = 0.0032051 k( 176) = ( -0.3833333 0.1373166 0.0000000), wk = 0.0032051 k( 177) = ( -0.4000000 0.1432869 0.0000000), wk = 0.0032051 k( 178) = ( -0.4166667 0.1492572 0.0000000), wk = 0.0032051 k( 179) = ( -0.4333333 0.1552275 0.0000000), wk = 0.0032051 k( 180) = ( -0.4500000 0.1611978 0.0000000), wk = 0.0032051 k( 181) = ( -0.4666667 0.1671681 0.0000000), wk = 0.0032051 k( 182) = ( -0.4833333 0.1731383 0.0000000), wk = 0.0032051 k( 183) = ( -0.5000000 0.1791086 0.0000000), wk = 0.0032051 k( 184) = ( -0.5000000 0.1791086 0.0000000), wk = 0.0032051 k( 185) = ( -0.4939467 0.1960072 -0.0000000), wk = 0.0032051 k( 186) = ( -0.4878933 0.2129056 -0.0000000), wk = 0.0032051 k( 187) = ( -0.4818400 0.2298042 -0.0000000), wk = 0.0032051 k( 188) = ( -0.4757867 0.2467026 -0.0000000), wk = 0.0032051 k( 189) = ( -0.4697333 0.2636012 -0.0000000), wk = 0.0032051 k( 190) = ( -0.4636800 0.2804997 -0.0000000), wk = 0.0032051 k( 191) = ( -0.4576267 0.2973982 -0.0000000), wk = 0.0032051 k( 192) = ( -0.4515733 0.3142967 -0.0000000), wk = 0.0032051 k( 193) = ( -0.4455200 0.3311952 -0.0000000), wk = 0.0032051 k( 194) = ( -0.4394666 0.3480937 -0.0000000), wk = 0.0032051 k( 195) = ( -0.4334133 0.3649922 -0.0000000), wk = 0.0032051 k( 196) = ( -0.4273600 0.3818907 -0.0000000), wk = 0.0032051 k( 197) = ( -0.4213066 0.3987892 -0.0000000), wk = 0.0032051 k( 198) = ( -0.4152533 0.4156877 -0.0000000), wk = 0.0032051 k( 199) = ( -0.4092000 0.4325862 -0.0000000), wk = 0.0032051 k( 200) = ( -0.4031466 0.4494847 -0.0000000), wk = 0.0032051 k( 201) = ( -0.3970933 0.4663832 -0.0000000), wk = 0.0032051 k( 202) = ( -0.3910400 0.4832817 -0.0000000), wk = 0.0032051 k( 203) = ( -0.3849866 0.5001802 -0.0000000), wk = 0.0032051 k( 204) = ( -0.3789333 0.5170787 -0.0000000), wk = 0.0032051 k( 205) = ( -0.3728799 0.5339772 -0.0000000), wk = 0.0032051 k( 206) = ( -0.3668266 0.5508757 -0.0000000), wk = 0.0032051 k( 207) = ( -0.3607733 0.5677742 -0.0000000), wk = 0.0032051 k( 208) = ( -0.3547199 0.5846727 -0.0000000), wk = 0.0032051 k( 209) = ( -0.3486666 0.6015712 -0.0000000), wk = 0.0032051 k( 210) = ( -0.3426133 0.6184698 -0.0000000), wk = 0.0032051 k( 211) = ( -0.3365599 0.6353682 -0.0000000), wk = 0.0032051 k( 212) = ( -0.3305066 0.6522668 -0.0000000), wk = 0.0032051 k( 213) = ( -0.3244533 0.6691652 -0.0000000), wk = 0.0032051 k( 214) = ( -0.3183999 0.6860638 -0.0000000), wk = 0.0032051 k( 215) = ( -0.3123466 0.7029623 -0.0000000), wk = 0.0032051 k( 216) = ( -0.3062933 0.7198608 -0.0000000), wk = 0.0032051 k( 217) = ( -0.3002399 0.7367593 -0.0000000), wk = 0.0032051 k( 218) = ( -0.2941866 0.7536578 -0.0000000), wk = 0.0032051 k( 219) = ( -0.2881332 0.7705563 -0.0000000), wk = 0.0032051 k( 220) = ( -0.2820799 0.7874548 -0.0000000), wk = 0.0032051 k( 221) = ( -0.2820799 0.7874548 -0.0000000), wk = 0.0032051 k( 222) = ( -0.2820799 0.7874548 0.0181503), wk = 0.0032051 k( 223) = ( -0.2820799 0.7874548 0.0363007), wk = 0.0032051 k( 224) = ( -0.2820799 0.7874548 0.0544510), wk = 0.0032051 k( 225) = ( -0.2820799 0.7874548 0.0726013), wk = 0.0032051 k( 226) = ( -0.2820799 0.7874548 0.0907516), wk = 0.0032051 k( 227) = ( -0.2820799 0.7874548 0.1089020), wk = 0.0032051 k( 228) = ( -0.2820799 0.7874548 0.1270523), wk = 0.0032051 k( 229) = ( -0.2820799 0.7874548 0.1452026), wk = 0.0032051 k( 230) = ( -0.2820799 0.7874548 0.1633529), wk = 0.0032051 k( 231) = ( -0.2820799 0.7874548 0.1815033), wk = 0.0032051 k( 232) = ( -0.2820799 0.7874548 0.1996536), wk = 0.0032051 k( 233) = ( -0.2820799 0.7874548 0.1996536), wk = 0.0032051 k( 234) = ( -0.2881332 0.7705563 0.1996536), wk = 0.0032051 k( 235) = ( -0.2941866 0.7536578 0.1996536), wk = 0.0032051 k( 236) = ( -0.3002399 0.7367593 0.1996536), wk = 0.0032051 k( 237) = ( -0.3062933 0.7198608 0.1996536), wk = 0.0032051 k( 238) = ( -0.3123466 0.7029623 0.1996536), wk = 0.0032051 k( 239) = ( -0.3183999 0.6860638 0.1996536), wk = 0.0032051 k( 240) = ( -0.3244533 0.6691652 0.1996536), wk = 0.0032051 k( 241) = ( -0.3305066 0.6522668 0.1996536), wk = 0.0032051 k( 242) = ( -0.3365599 0.6353682 0.1996536), wk = 0.0032051 k( 243) = ( -0.3426133 0.6184698 0.1996536), wk = 0.0032051 k( 244) = ( -0.3486666 0.6015712 0.1996536), wk = 0.0032051 k( 245) = ( -0.3547199 0.5846727 0.1996536), wk = 0.0032051 k( 246) = ( -0.3607733 0.5677742 0.1996536), wk = 0.0032051 k( 247) = ( -0.3668266 0.5508757 0.1996536), wk = 0.0032051 k( 248) = ( -0.3728799 0.5339772 0.1996536), wk = 0.0032051 k( 249) = ( -0.3789333 0.5170787 0.1996536), wk = 0.0032051 k( 250) = ( -0.3849866 0.5001802 0.1996536), wk = 0.0032051 k( 251) = ( -0.3910400 0.4832817 0.1996536), wk = 0.0032051 k( 252) = ( -0.3970933 0.4663832 0.1996536), wk = 0.0032051 k( 253) = ( -0.4031466 0.4494847 0.1996536), wk = 0.0032051 k( 254) = ( -0.4092000 0.4325862 0.1996536), wk = 0.0032051 k( 255) = ( -0.4152533 0.4156877 0.1996536), wk = 0.0032051 k( 256) = ( -0.4213066 0.3987892 0.1996536), wk = 0.0032051 k( 257) = ( -0.4273600 0.3818907 0.1996536), wk = 0.0032051 k( 258) = ( -0.4334133 0.3649922 0.1996536), wk = 0.0032051 k( 259) = ( -0.4394666 0.3480937 0.1996536), wk = 0.0032051 k( 260) = ( -0.4455200 0.3311952 0.1996536), wk = 0.0032051 k( 261) = ( -0.4515733 0.3142967 0.1996536), wk = 0.0032051 k( 262) = ( -0.4576267 0.2973982 0.1996536), wk = 0.0032051 k( 263) = ( -0.4636800 0.2804997 0.1996536), wk = 0.0032051 k( 264) = ( -0.4697333 0.2636012 0.1996536), wk = 0.0032051 k( 265) = ( -0.4757867 0.2467026 0.1996536), wk = 0.0032051 k( 266) = ( -0.4818400 0.2298042 0.1996536), wk = 0.0032051 k( 267) = ( -0.4878933 0.2129056 0.1996536), wk = 0.0032051 k( 268) = ( -0.4939467 0.1960072 0.1996536), wk = 0.0032051 k( 269) = ( -0.5000000 0.1791086 0.1996536), wk = 0.0032051 k( 270) = ( -0.5000000 0.1791086 0.1996536), wk = 0.0032051 k( 271) = ( -0.5000000 0.1791086 0.1815033), wk = 0.0032051 k( 272) = ( -0.5000000 0.1791086 0.1633529), wk = 0.0032051 k( 273) = ( -0.5000000 0.1791086 0.1452026), wk = 0.0032051 k( 274) = ( -0.5000000 0.1791086 0.1270523), wk = 0.0032051 k( 275) = ( -0.5000000 0.1791086 0.1089020), wk = 0.0032051 k( 276) = ( -0.5000000 0.1791086 0.0907516), wk = 0.0032051 k( 277) = ( -0.5000000 0.1791086 0.0726013), wk = 0.0032051 k( 278) = ( -0.5000000 0.1791086 0.0544510), wk = 0.0032051 k( 279) = ( -0.5000000 0.1791086 0.0363007), wk = 0.0032051 k( 280) = ( -0.5000000 0.1791086 0.0181503), wk = 0.0032051 k( 281) = ( -0.5000000 0.1791086 0.0000000), wk = 0.0032051 k( 282) = ( 0.0000000 0.0000000 0.1996536), wk = 0.0032051 k( 283) = ( -0.0166667 0.0059703 0.1996536), wk = 0.0032051 k( 284) = ( -0.0333333 0.0119406 0.1996536), wk = 0.0032051 k( 285) = ( -0.0500000 0.0179109 0.1996536), wk = 0.0032051 k( 286) = ( -0.0666667 0.0238812 0.1996536), wk = 0.0032051 k( 287) = ( -0.0833333 0.0298514 0.1996536), wk = 0.0032051 k( 288) = ( -0.1000000 0.0358217 0.1996536), wk = 0.0032051 k( 289) = ( -0.1166667 0.0417920 0.1996536), wk = 0.0032051 k( 290) = ( -0.1333333 0.0477623 0.1996536), wk = 0.0032051 k( 291) = ( -0.1500000 0.0537326 0.1996536), wk = 0.0032051 k( 292) = ( -0.1666667 0.0597029 0.1996536), wk = 0.0032051 k( 293) = ( -0.1833333 0.0656732 0.1996536), wk = 0.0032051 k( 294) = ( -0.2000000 0.0716435 0.1996536), wk = 0.0032051 k( 295) = ( -0.2166667 0.0776137 0.1996536), wk = 0.0032051 k( 296) = ( -0.2333333 0.0835840 0.1996536), wk = 0.0032051 k( 297) = ( -0.2500000 0.0895543 0.1996536), wk = 0.0032051 k( 298) = ( -0.2666667 0.0955246 0.1996536), wk = 0.0032051 k( 299) = ( -0.2833333 0.1014949 0.1996536), wk = 0.0032051 k( 300) = ( -0.3000000 0.1074652 0.1996536), wk = 0.0032051 k( 301) = ( -0.3166667 0.1134355 0.1996536), wk = 0.0032051 k( 302) = ( -0.3333333 0.1194058 0.1996536), wk = 0.0032051 k( 303) = ( -0.3500000 0.1253760 0.1996536), wk = 0.0032051 k( 304) = ( -0.3666667 0.1313463 0.1996536), wk = 0.0032051 k( 305) = ( -0.3833333 0.1373166 0.1996536), wk = 0.0032051 k( 306) = ( -0.4000000 0.1432869 0.1996536), wk = 0.0032051 k( 307) = ( -0.4166667 0.1492572 0.1996536), wk = 0.0032051 k( 308) = ( -0.4333333 0.1552275 0.1996536), wk = 0.0032051 k( 309) = ( -0.4500000 0.1611978 0.1996536), wk = 0.0032051 k( 310) = ( -0.4666667 0.1671681 0.1996536), wk = 0.0032051 k( 311) = ( -0.4833333 0.1731383 0.1996536), wk = 0.0032051 k( 312) = ( -0.5000000 0.1791086 0.1996536), wk = 0.0032051 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0061322 0.0061322 -0.0000000), wk = 0.0032051 k( 3) = ( 0.0122643 0.0122643 -0.0000000), wk = 0.0032051 k( 4) = ( 0.0183965 0.0183965 0.0000000), wk = 0.0032051 k( 5) = ( 0.0245287 0.0245287 0.0000000), wk = 0.0032051 k( 6) = ( 0.0306609 0.0306609 0.0000000), wk = 0.0032051 k( 7) = ( 0.0367930 0.0367930 0.0000000), wk = 0.0032051 k( 8) = ( 0.0429252 0.0429252 0.0000000), wk = 0.0032051 k( 9) = ( 0.0490574 0.0490574 0.0000000), wk = 0.0032051 k( 10) = ( 0.0551895 0.0551895 0.0000000), wk = 0.0032051 k( 11) = ( 0.0613217 0.0613217 0.0000000), wk = 0.0032051 k( 12) = ( 0.0674539 0.0674539 0.0000000), wk = 0.0032051 k( 13) = ( 0.0735861 0.0735861 0.0000000), wk = 0.0032051 k( 14) = ( 0.0797182 0.0797182 0.0000000), wk = 0.0032051 k( 15) = ( 0.0858504 0.0858504 0.0000000), wk = 0.0032051 k( 16) = ( 0.0919826 0.0919826 -0.0000000), wk = 0.0032051 k( 17) = ( 0.0981148 0.0981147 0.0000000), wk = 0.0032051 k( 18) = ( 0.1042469 0.1042469 0.0000000), wk = 0.0032051 k( 19) = ( 0.1103791 0.1103791 0.0000000), wk = 0.0032051 k( 20) = ( 0.1165113 0.1165113 0.0000000), wk = 0.0032051 k( 21) = ( 0.1226434 0.1226434 0.0000000), wk = 0.0032051 k( 22) = ( 0.1287756 0.1287756 0.0000000), wk = 0.0032051 k( 23) = ( 0.1349078 0.1349078 0.0000000), wk = 0.0032051 k( 24) = ( 0.1410399 0.1410399 -0.0000000), wk = 0.0032051 k( 25) = ( 0.1471721 0.1471721 0.0000000), wk = 0.0032051 k( 26) = ( 0.1533043 0.1533043 0.0000000), wk = 0.0032051 k( 27) = ( 0.1594365 0.1594365 0.0000000), wk = 0.0032051 k( 28) = ( 0.1655686 0.1655686 -0.0000000), wk = 0.0032051 k( 29) = ( 0.1717008 0.1717008 -0.0000000), wk = 0.0032051 k( 30) = ( 0.1778330 0.1778330 0.0000000), wk = 0.0032051 k( 31) = ( 0.1839651 0.1839651 0.0000000), wk = 0.0032051 k( 32) = ( 0.1900973 0.1900973 0.0000000), wk = 0.0032051 k( 33) = ( 0.1962295 0.1962295 0.0000000), wk = 0.0032051 k( 34) = ( 0.2023617 0.2023617 0.0000000), wk = 0.0032051 k( 35) = ( 0.2084938 0.2084938 0.0000000), wk = 0.0032051 k( 36) = ( 0.2146260 0.2146260 0.0000000), wk = 0.0032051 k( 37) = ( 0.2207582 0.2207582 0.0000000), wk = 0.0032051 k( 38) = ( 0.2268904 0.2268904 -0.0000000), wk = 0.0032051 k( 39) = ( 0.2330225 0.2330225 0.0000000), wk = 0.0032051 k( 40) = ( 0.2391547 0.2391547 0.0000000), wk = 0.0032051 k( 41) = ( 0.2452869 0.2452869 0.0000000), wk = 0.0032051 k( 42) = ( 0.2514190 0.2514190 0.0000000), wk = 0.0032051 k( 43) = ( 0.2575512 0.2575512 0.0000000), wk = 0.0032051 k( 44) = ( 0.2636834 0.2636834 -0.0000000), wk = 0.0032051 k( 45) = ( 0.2698156 0.2698156 0.0000000), wk = 0.0032051 k( 46) = ( 0.2759477 0.2759477 0.0000000), wk = 0.0032051 k( 47) = ( 0.2820799 0.2820799 -0.0000000), wk = 0.0032051 k( 48) = ( 0.2820799 0.2820799 -0.0000000), wk = 0.0032051 k( 49) = ( 0.2644499 0.2956999 0.0000000), wk = 0.0032051 k( 50) = ( 0.2468199 0.3093199 0.0000000), wk = 0.0032051 k( 51) = ( 0.2291899 0.3229399 -0.0000000), wk = 0.0032051 k( 52) = ( 0.2115599 0.3365599 0.0000000), wk = 0.0032051 k( 53) = ( 0.1939299 0.3501799 0.0000000), wk = 0.0032051 k( 54) = ( 0.1762999 0.3637999 0.0000000), wk = 0.0032051 k( 55) = ( 0.1586700 0.3774200 0.0000000), wk = 0.0032051 k( 56) = ( 0.1410399 0.3910400 0.0000000), wk = 0.0032051 k( 57) = ( 0.1234100 0.4046600 0.0000000), wk = 0.0032051 k( 58) = ( 0.1057800 0.4182800 0.0000000), wk = 0.0032051 k( 59) = ( 0.0881500 0.4319000 0.0000000), wk = 0.0032051 k( 60) = ( 0.0705200 0.4455200 0.0000000), wk = 0.0032051 k( 61) = ( 0.0528900 0.4591400 0.0000000), wk = 0.0032051 k( 62) = ( 0.0352600 0.4727600 0.0000000), wk = 0.0032051 k( 63) = ( 0.0176300 0.4863800 0.0000000), wk = 0.0032051 k( 64) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032051 k( 65) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032051 k( 66) = ( 0.0000000 0.5000000 0.0454545), wk = 0.0032051 k( 67) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0032051 k( 68) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0032051 k( 69) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0032051 k( 70) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0032051 k( 71) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0032051 k( 72) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0032051 k( 73) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0032051 k( 74) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0032051 k( 75) = ( 0.0000000 0.5000000 0.4545454), wk = 0.0032051 k( 76) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032051 k( 77) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032051 k( 78) = ( 0.0176300 0.4863800 0.5000000), wk = 0.0032051 k( 79) = ( 0.0352600 0.4727600 0.5000000), wk = 0.0032051 k( 80) = ( 0.0528900 0.4591400 0.5000000), wk = 0.0032051 k( 81) = ( 0.0705200 0.4455200 0.5000000), wk = 0.0032051 k( 82) = ( 0.0881500 0.4319000 0.5000000), wk = 0.0032051 k( 83) = ( 0.1057800 0.4182800 0.5000000), wk = 0.0032051 k( 84) = ( 0.1234100 0.4046600 0.5000000), wk = 0.0032051 k( 85) = ( 0.1410399 0.3910400 0.5000000), wk = 0.0032051 k( 86) = ( 0.1586700 0.3774200 0.5000000), wk = 0.0032051 k( 87) = ( 0.1762999 0.3637999 0.5000000), wk = 0.0032051 k( 88) = ( 0.1939299 0.3501799 0.5000000), wk = 0.0032051 k( 89) = ( 0.2115599 0.3365599 0.5000000), wk = 0.0032051 k( 90) = ( 0.2291899 0.3229399 0.5000000), wk = 0.0032051 k( 91) = ( 0.2468199 0.3093199 0.5000000), wk = 0.0032051 k( 92) = ( 0.2644499 0.2956999 0.5000000), wk = 0.0032051 k( 93) = ( 0.2820799 0.2820799 0.5000000), wk = 0.0032051 k( 94) = ( 0.2820799 0.2820799 0.5000000), wk = 0.0032051 k( 95) = ( 0.2759477 0.2759477 0.5000000), wk = 0.0032051 k( 96) = ( 0.2698156 0.2698156 0.5000000), wk = 0.0032051 k( 97) = ( 0.2636834 0.2636834 0.5000000), wk = 0.0032051 k( 98) = ( 0.2575512 0.2575512 0.5000000), wk = 0.0032051 k( 99) = ( 0.2514190 0.2514190 0.5000000), wk = 0.0032051 k( 100) = ( 0.2452869 0.2452869 0.5000000), wk = 0.0032051 k( 101) = ( 0.2391547 0.2391547 0.5000000), wk = 0.0032051 k( 102) = ( 0.2330225 0.2330225 0.5000000), wk = 0.0032051 k( 103) = ( 0.2268904 0.2268904 0.5000000), wk = 0.0032051 k( 104) = ( 0.2207582 0.2207582 0.5000000), wk = 0.0032051 k( 105) = ( 0.2146260 0.2146260 0.5000000), wk = 0.0032051 k( 106) = ( 0.2084938 0.2084938 0.5000000), wk = 0.0032051 k( 107) = ( 0.2023617 0.2023617 0.5000000), wk = 0.0032051 k( 108) = ( 0.1962295 0.1962295 0.5000000), wk = 0.0032051 k( 109) = ( 0.1900973 0.1900973 0.5000000), wk = 0.0032051 k( 110) = ( 0.1839651 0.1839651 0.5000000), wk = 0.0032051 k( 111) = ( 0.1778330 0.1778330 0.5000000), wk = 0.0032051 k( 112) = ( 0.1717008 0.1717008 0.5000000), wk = 0.0032051 k( 113) = ( 0.1655686 0.1655686 0.5000000), wk = 0.0032051 k( 114) = ( 0.1594365 0.1594365 0.5000000), wk = 0.0032051 k( 115) = ( 0.1533043 0.1533043 0.5000000), wk = 0.0032051 k( 116) = ( 0.1471721 0.1471721 0.5000000), wk = 0.0032051 k( 117) = ( 0.1410399 0.1410399 0.5000000), wk = 0.0032051 k( 118) = ( 0.1349078 0.1349078 0.5000000), wk = 0.0032051 k( 119) = ( 0.1287756 0.1287756 0.5000000), wk = 0.0032051 k( 120) = ( 0.1226434 0.1226434 0.5000000), wk = 0.0032051 k( 121) = ( 0.1165113 0.1165113 0.5000000), wk = 0.0032051 k( 122) = ( 0.1103791 0.1103791 0.5000000), wk = 0.0032051 k( 123) = ( 0.1042469 0.1042469 0.5000000), wk = 0.0032051 k( 124) = ( 0.0981148 0.0981147 0.5000000), wk = 0.0032051 k( 125) = ( 0.0919826 0.0919826 0.5000000), wk = 0.0032051 k( 126) = ( 0.0858504 0.0858504 0.5000000), wk = 0.0032051 k( 127) = ( 0.0797182 0.0797182 0.5000000), wk = 0.0032051 k( 128) = ( 0.0735861 0.0735861 0.5000000), wk = 0.0032051 k( 129) = ( 0.0674539 0.0674539 0.5000000), wk = 0.0032051 k( 130) = ( 0.0613217 0.0613217 0.5000000), wk = 0.0032051 k( 131) = ( 0.0551895 0.0551895 0.5000000), wk = 0.0032051 k( 132) = ( 0.0490574 0.0490574 0.5000000), wk = 0.0032051 k( 133) = ( 0.0429252 0.0429252 0.5000000), wk = 0.0032051 k( 134) = ( 0.0367930 0.0367930 0.5000000), wk = 0.0032051 k( 135) = ( 0.0306609 0.0306609 0.5000000), wk = 0.0032051 k( 136) = ( 0.0245287 0.0245287 0.5000000), wk = 0.0032051 k( 137) = ( 0.0183965 0.0183965 0.5000000), wk = 0.0032051 k( 138) = ( 0.0122643 0.0122643 0.5000000), wk = 0.0032051 k( 139) = ( 0.0061322 0.0061322 0.5000000), wk = 0.0032051 k( 140) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 141) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 142) = ( 0.0000000 0.0000000 0.4545454), wk = 0.0032051 k( 143) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0032051 k( 144) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0032051 k( 145) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0032051 k( 147) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0032051 k( 148) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0032051 k( 149) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0032051 k( 150) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0032051 k( 151) = ( 0.0000000 0.0000000 0.0454545), wk = 0.0032051 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 154) = ( -0.0166667 0.0166667 -0.0000000), wk = 0.0032051 k( 155) = ( -0.0333333 0.0333333 0.0000000), wk = 0.0032051 k( 156) = ( -0.0500000 0.0500000 -0.0000000), wk = 0.0032051 k( 157) = ( -0.0666667 0.0666667 -0.0000000), wk = 0.0032051 k( 158) = ( -0.0833333 0.0833333 0.0000000), wk = 0.0032051 k( 159) = ( -0.1000000 0.1000000 -0.0000000), wk = 0.0032051 k( 160) = ( -0.1166667 0.1166667 0.0000000), wk = 0.0032051 k( 161) = ( -0.1333333 0.1333333 0.0000000), wk = 0.0032051 k( 162) = ( -0.1500000 0.1500000 0.0000000), wk = 0.0032051 k( 163) = ( -0.1666667 0.1666667 -0.0000000), wk = 0.0032051 k( 164) = ( -0.1833333 0.1833333 -0.0000000), wk = 0.0032051 k( 165) = ( -0.2000000 0.2000000 -0.0000000), wk = 0.0032051 k( 166) = ( -0.2166667 0.2166667 -0.0000000), wk = 0.0032051 k( 167) = ( -0.2333333 0.2333333 -0.0000000), wk = 0.0032051 k( 168) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0032051 k( 169) = ( -0.2666667 0.2666667 0.0000000), wk = 0.0032051 k( 170) = ( -0.2833333 0.2833333 0.0000000), wk = 0.0032051 k( 171) = ( -0.3000000 0.3000000 0.0000000), wk = 0.0032051 k( 172) = ( -0.3166667 0.3166667 -0.0000000), wk = 0.0032051 k( 173) = ( -0.3333333 0.3333333 -0.0000000), wk = 0.0032051 k( 174) = ( -0.3500000 0.3500000 0.0000000), wk = 0.0032051 k( 175) = ( -0.3666667 0.3666667 0.0000000), wk = 0.0032051 k( 176) = ( -0.3833333 0.3833333 0.0000000), wk = 0.0032051 k( 177) = ( -0.4000000 0.4000000 -0.0000000), wk = 0.0032051 k( 178) = ( -0.4166667 0.4166667 0.0000000), wk = 0.0032051 k( 179) = ( -0.4333333 0.4333333 0.0000000), wk = 0.0032051 k( 180) = ( -0.4500000 0.4500000 0.0000000), wk = 0.0032051 k( 181) = ( -0.4666667 0.4666667 -0.0000000), wk = 0.0032051 k( 182) = ( -0.4833333 0.4833333 -0.0000000), wk = 0.0032051 k( 183) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 184) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 185) = ( -0.4939467 0.5060533 0.0000000), wk = 0.0032051 k( 186) = ( -0.4878933 0.5121067 -0.0000000), wk = 0.0032051 k( 187) = ( -0.4818400 0.5181600 -0.0000000), wk = 0.0032051 k( 188) = ( -0.4757867 0.5242133 0.0000000), wk = 0.0032051 k( 189) = ( -0.4697333 0.5302667 -0.0000000), wk = 0.0032051 k( 190) = ( -0.4636800 0.5363200 -0.0000000), wk = 0.0032051 k( 191) = ( -0.4576267 0.5423733 0.0000000), wk = 0.0032051 k( 192) = ( -0.4515733 0.5484267 -0.0000000), wk = 0.0032051 k( 193) = ( -0.4455200 0.5544800 0.0000000), wk = 0.0032051 k( 194) = ( -0.4394666 0.5605334 0.0000000), wk = 0.0032051 k( 195) = ( -0.4334133 0.5665867 -0.0000000), wk = 0.0032051 k( 196) = ( -0.4273600 0.5726400 -0.0000000), wk = 0.0032051 k( 197) = ( -0.4213066 0.5786934 0.0000000), wk = 0.0032051 k( 198) = ( -0.4152533 0.5847467 -0.0000000), wk = 0.0032051 k( 199) = ( -0.4092000 0.5908000 -0.0000000), wk = 0.0032051 k( 200) = ( -0.4031466 0.5968534 0.0000000), wk = 0.0032051 k( 201) = ( -0.3970933 0.6029067 0.0000000), wk = 0.0032051 k( 202) = ( -0.3910400 0.6089600 -0.0000000), wk = 0.0032051 k( 203) = ( -0.3849866 0.6150134 0.0000000), wk = 0.0032051 k( 204) = ( -0.3789333 0.6210667 0.0000000), wk = 0.0032051 k( 205) = ( -0.3728799 0.6271201 -0.0000000), wk = 0.0032051 k( 206) = ( -0.3668266 0.6331734 0.0000000), wk = 0.0032051 k( 207) = ( -0.3607733 0.6392267 0.0000000), wk = 0.0032051 k( 208) = ( -0.3547199 0.6452801 -0.0000000), wk = 0.0032051 k( 209) = ( -0.3486666 0.6513334 0.0000000), wk = 0.0032051 k( 210) = ( -0.3426133 0.6573867 0.0000000), wk = 0.0032051 k( 211) = ( -0.3365599 0.6634401 -0.0000000), wk = 0.0032051 k( 212) = ( -0.3305066 0.6694934 0.0000000), wk = 0.0032051 k( 213) = ( -0.3244533 0.6755467 0.0000000), wk = 0.0032051 k( 214) = ( -0.3183999 0.6816001 0.0000000), wk = 0.0032051 k( 215) = ( -0.3123466 0.6876534 -0.0000000), wk = 0.0032051 k( 216) = ( -0.3062933 0.6937068 0.0000000), wk = 0.0032051 k( 217) = ( -0.3002399 0.6997601 0.0000000), wk = 0.0032051 k( 218) = ( -0.2941866 0.7058134 -0.0000000), wk = 0.0032051 k( 219) = ( -0.2881332 0.7118668 0.0000000), wk = 0.0032051 k( 220) = ( -0.2820799 0.7179201 0.0000000), wk = 0.0032051 k( 221) = ( -0.2820799 0.7179201 0.0000000), wk = 0.0032051 k( 222) = ( -0.2820799 0.7179201 0.0454545), wk = 0.0032051 k( 223) = ( -0.2820799 0.7179201 0.0909091), wk = 0.0032051 k( 224) = ( -0.2820799 0.7179201 0.1363636), wk = 0.0032051 k( 225) = ( -0.2820799 0.7179201 0.1818182), wk = 0.0032051 k( 226) = ( -0.2820799 0.7179201 0.2272727), wk = 0.0032051 k( 227) = ( -0.2820799 0.7179201 0.2727273), wk = 0.0032051 k( 228) = ( -0.2820799 0.7179201 0.3181818), wk = 0.0032051 k( 229) = ( -0.2820799 0.7179201 0.3636364), wk = 0.0032051 k( 230) = ( -0.2820799 0.7179201 0.4090909), wk = 0.0032051 k( 231) = ( -0.2820799 0.7179201 0.4545454), wk = 0.0032051 k( 232) = ( -0.2820799 0.7179201 0.5000000), wk = 0.0032051 k( 233) = ( -0.2820799 0.7179201 0.5000000), wk = 0.0032051 k( 234) = ( -0.2881332 0.7118668 0.5000000), wk = 0.0032051 k( 235) = ( -0.2941866 0.7058134 0.5000000), wk = 0.0032051 k( 236) = ( -0.3002399 0.6997601 0.5000000), wk = 0.0032051 k( 237) = ( -0.3062933 0.6937068 0.5000000), wk = 0.0032051 k( 238) = ( -0.3123466 0.6876534 0.5000000), wk = 0.0032051 k( 239) = ( -0.3183999 0.6816001 0.5000000), wk = 0.0032051 k( 240) = ( -0.3244533 0.6755467 0.5000000), wk = 0.0032051 k( 241) = ( -0.3305066 0.6694934 0.5000000), wk = 0.0032051 k( 242) = ( -0.3365599 0.6634401 0.5000000), wk = 0.0032051 k( 243) = ( -0.3426133 0.6573867 0.5000000), wk = 0.0032051 k( 244) = ( -0.3486666 0.6513334 0.5000000), wk = 0.0032051 k( 245) = ( -0.3547199 0.6452801 0.5000000), wk = 0.0032051 k( 246) = ( -0.3607733 0.6392267 0.5000000), wk = 0.0032051 k( 247) = ( -0.3668266 0.6331734 0.5000000), wk = 0.0032051 k( 248) = ( -0.3728799 0.6271201 0.5000000), wk = 0.0032051 k( 249) = ( -0.3789333 0.6210667 0.5000000), wk = 0.0032051 k( 250) = ( -0.3849866 0.6150134 0.5000000), wk = 0.0032051 k( 251) = ( -0.3910400 0.6089600 0.5000000), wk = 0.0032051 k( 252) = ( -0.3970933 0.6029067 0.5000000), wk = 0.0032051 k( 253) = ( -0.4031466 0.5968534 0.5000000), wk = 0.0032051 k( 254) = ( -0.4092000 0.5908000 0.5000000), wk = 0.0032051 k( 255) = ( -0.4152533 0.5847467 0.5000000), wk = 0.0032051 k( 256) = ( -0.4213066 0.5786934 0.5000000), wk = 0.0032051 k( 257) = ( -0.4273600 0.5726400 0.5000000), wk = 0.0032051 k( 258) = ( -0.4334133 0.5665867 0.5000000), wk = 0.0032051 k( 259) = ( -0.4394666 0.5605334 0.5000000), wk = 0.0032051 k( 260) = ( -0.4455200 0.5544800 0.5000000), wk = 0.0032051 k( 261) = ( -0.4515733 0.5484267 0.5000000), wk = 0.0032051 k( 262) = ( -0.4576267 0.5423733 0.5000000), wk = 0.0032051 k( 263) = ( -0.4636800 0.5363200 0.5000000), wk = 0.0032051 k( 264) = ( -0.4697333 0.5302667 0.5000000), wk = 0.0032051 k( 265) = ( -0.4757867 0.5242133 0.5000000), wk = 0.0032051 k( 266) = ( -0.4818400 0.5181600 0.5000000), wk = 0.0032051 k( 267) = ( -0.4878933 0.5121067 0.5000000), wk = 0.0032051 k( 268) = ( -0.4939467 0.5060533 0.5000000), wk = 0.0032051 k( 269) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 270) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 271) = ( -0.5000000 0.5000000 0.4545454), wk = 0.0032051 k( 272) = ( -0.5000000 0.5000000 0.4090909), wk = 0.0032051 k( 273) = ( -0.5000000 0.5000000 0.3636364), wk = 0.0032051 k( 274) = ( -0.5000000 0.5000000 0.3181818), wk = 0.0032051 k( 275) = ( -0.5000000 0.5000000 0.2727273), wk = 0.0032051 k( 276) = ( -0.5000000 0.5000000 0.2272727), wk = 0.0032051 k( 277) = ( -0.5000000 0.5000000 0.1818182), wk = 0.0032051 k( 278) = ( -0.5000000 0.5000000 0.1363636), wk = 0.0032051 k( 279) = ( -0.5000000 0.5000000 0.0909091), wk = 0.0032051 k( 280) = ( -0.5000000 0.5000000 0.0454545), wk = 0.0032051 k( 281) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032051 k( 282) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 283) = ( -0.0166667 0.0166667 0.5000000), wk = 0.0032051 k( 284) = ( -0.0333333 0.0333333 0.5000000), wk = 0.0032051 k( 285) = ( -0.0500000 0.0500000 0.5000000), wk = 0.0032051 k( 286) = ( -0.0666667 0.0666667 0.5000000), wk = 0.0032051 k( 287) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0032051 k( 288) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0032051 k( 289) = ( -0.1166667 0.1166667 0.5000000), wk = 0.0032051 k( 290) = ( -0.1333333 0.1333333 0.5000000), wk = 0.0032051 k( 291) = ( -0.1500000 0.1500000 0.5000000), wk = 0.0032051 k( 292) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0032051 k( 293) = ( -0.1833333 0.1833333 0.5000000), wk = 0.0032051 k( 294) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0032051 k( 295) = ( -0.2166667 0.2166667 0.5000000), wk = 0.0032051 k( 296) = ( -0.2333333 0.2333333 0.5000000), wk = 0.0032051 k( 297) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0032051 k( 298) = ( -0.2666667 0.2666667 0.5000000), wk = 0.0032051 k( 299) = ( -0.2833333 0.2833333 0.5000000), wk = 0.0032051 k( 300) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0032051 k( 301) = ( -0.3166667 0.3166667 0.5000000), wk = 0.0032051 k( 302) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0032051 k( 303) = ( -0.3500000 0.3500000 0.5000000), wk = 0.0032051 k( 304) = ( -0.3666667 0.3666667 0.5000000), wk = 0.0032051 k( 305) = ( -0.3833333 0.3833333 0.5000000), wk = 0.0032051 k( 306) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0032051 k( 307) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0032051 k( 308) = ( -0.4333333 0.4333333 0.5000000), wk = 0.0032051 k( 309) = ( -0.4500000 0.4500000 0.5000000), wk = 0.0032051 k( 310) = ( -0.4666667 0.4666667 0.5000000), wk = 0.0032051 k( 311) = ( -0.4833333 0.4833333 0.5000000), wk = 0.0032051 k( 312) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032051 Dense grid: 95893 G-vectors FFT dimensions: ( 50, 50, 125) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.37 Mb ( 376, 64) NL pseudopotentials 0.55 Mb ( 188, 192) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 1497) G-vector shells 0.01 Mb ( 758) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.47 Mb ( 376, 256) Each subspace H/S matrix 1.00 Mb ( 256, 256) Each matrix 0.38 Mb ( 192, 2, 64) The potential is recalculated from file : ./ZrBi.save/charge-density.dat Starting wfc are 156 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 7.8 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 12.8 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 17.8 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 22.9 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 27.9 secs Computing kpt #: 6 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 33.0 secs Computing kpt #: 7 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 38.1 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 43.3 secs Computing kpt #: 9 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 48.6 secs Computing kpt #: 10 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 53.9 secs Computing kpt #: 11 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 59.1 secs Computing kpt #: 12 total cpu time spent up to now is 63.8 secs Computing kpt #: 13 total cpu time spent up to now is 68.0 secs Computing kpt #: 14 total cpu time spent up to now is 72.0 secs Computing kpt #: 15 total cpu time spent up to now is 76.0 secs Computing kpt #: 16 total cpu time spent up to now is 80.3 secs Computing kpt #: 17 total cpu time spent up to now is 84.7 secs Computing kpt #: 18 total cpu time spent up to now is 89.1 secs Computing kpt #: 19 total cpu time spent up to now is 93.5 secs Computing kpt #: 20 total cpu time spent up to now is 98.0 secs Computing kpt #: 21 total cpu time spent up to now is 102.4 secs Computing kpt #: 22 total cpu time spent up to now is 106.5 secs Computing kpt #: 23 total cpu time spent up to now is 110.4 secs Computing kpt #: 24 total cpu time spent up to now is 114.1 secs Computing kpt #: 25 total cpu time spent up to now is 117.7 secs Computing kpt #: 26 total cpu time spent up to now is 121.2 secs Computing kpt #: 27 total cpu time spent up to now is 124.7 secs Computing kpt #: 28 total cpu time spent up to now is 128.1 secs Computing kpt #: 29 total cpu time spent up to now is 131.5 secs Computing kpt #: 30 total cpu time spent up to now is 134.9 secs Computing kpt #: 31 total cpu time spent up to now is 138.4 secs Computing kpt #: 32 total cpu time spent up to now is 142.2 secs Computing kpt #: 33 total cpu time spent up to now is 146.0 secs Computing kpt #: 34 total cpu time spent up to now is 150.3 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.2 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 160.1 secs Computing kpt #: 37 total cpu time spent up to now is 164.7 secs Computing kpt #: 38 total cpu time spent up to now is 168.7 secs Computing kpt #: 39 total cpu time spent up to now is 172.4 secs Computing kpt #: 40 total cpu time spent up to now is 175.9 secs Computing kpt #: 41 total cpu time spent up to now is 179.2 secs Computing kpt #: 42 total cpu time spent up to now is 182.6 secs Computing kpt #: 43 total cpu time spent up to now is 190.1 secs Computing kpt #: 44 total cpu time spent up to now is 193.4 secs Computing kpt #: 45 total cpu time spent up to now is 196.7 secs Computing kpt #: 46 total cpu time spent up to now is 200.1 secs Computing kpt #: 47 total cpu time spent up to now is 203.4 secs Computing kpt #: 48 total cpu time spent up to now is 206.7 secs Computing kpt #: 49 total cpu time spent up to now is 210.1 secs Computing kpt #: 50 total cpu time spent up to now is 213.4 secs Computing kpt #: 51 total cpu time spent up to now is 216.7 secs Computing kpt #: 52 total cpu time spent up to now is 220.1 secs Computing kpt #: 53 total cpu time spent up to now is 223.5 secs Computing kpt #: 54 total cpu time spent up to now is 226.9 secs Computing kpt #: 55 total cpu time spent up to now is 230.6 secs Computing kpt #: 56 total cpu time spent up to now is 234.5 secs Computing kpt #: 57 total cpu time spent up to now is 238.4 secs Computing kpt #: 58 total cpu time spent up to now is 242.6 secs Computing kpt #: 59 total cpu time spent up to now is 246.9 secs Computing kpt #: 60 total cpu time spent up to now is 251.6 secs Computing kpt #: 61 total cpu time spent up to now is 256.0 secs Computing kpt #: 62 total cpu time spent up to now is 260.4 secs Computing kpt #: 63 total cpu time spent up to now is 264.6 secs Computing kpt #: 64 total cpu time spent up to now is 268.5 secs Computing kpt #: 65 total cpu time spent up to now is 272.4 secs Computing kpt #: 66 total cpu time spent up to now is 276.3 secs Computing kpt #: 67 total cpu time spent up to now is 280.3 secs Computing kpt #: 68 total cpu time spent up to now is 284.6 secs Computing kpt #: 69 total cpu time spent up to now is 289.0 secs Computing kpt #: 70 total cpu time spent up to now is 293.3 secs Computing kpt #: 71 total cpu time spent up to now is 297.7 secs Computing kpt #: 72 total cpu time spent up to now is 301.8 secs Computing kpt #: 73 total cpu time spent up to now is 305.9 secs Computing kpt #: 74 total cpu time spent up to now is 310.0 secs Computing kpt #: 75 total cpu time spent up to now is 314.2 secs Computing kpt #: 76 total cpu time spent up to now is 318.3 secs Computing kpt #: 77 total cpu time spent up to now is 322.4 secs Computing kpt #: 78 total cpu time spent up to now is 326.6 secs Computing kpt #: 79 total cpu time spent up to now is 331.0 secs Computing kpt #: 80 total cpu time spent up to now is 335.3 secs Computing kpt #: 81 total cpu time spent up to now is 339.7 secs Computing kpt #: 82 total cpu time spent up to now is 344.0 secs Computing kpt #: 83 total cpu time spent up to now is 348.3 secs Computing kpt #: 84 total cpu time spent up to now is 352.6 secs Computing kpt #: 85 total cpu time spent up to now is 356.7 secs Computing kpt #: 86 total cpu time spent up to now is 360.8 secs Computing kpt #: 87 total cpu time spent up to now is 365.0 secs Computing kpt #: 88 total cpu time spent up to now is 369.0 secs Computing kpt #: 89 total cpu time spent up to now is 372.9 secs Computing kpt #: 90 total cpu time spent up to now is 376.8 secs Computing kpt #: 91 total cpu time spent up to now is 380.7 secs Computing kpt #: 92 total cpu time spent up to now is 384.5 secs Computing kpt #: 93 total cpu time spent up to now is 388.3 secs Computing kpt #: 94 total cpu time spent up to now is 391.9 secs Computing kpt #: 95 total cpu time spent up to now is 395.8 secs Computing kpt #: 96 total cpu time spent up to now is 399.6 secs Computing kpt #: 97 total cpu time spent up to now is 403.5 secs Computing kpt #: 98 total cpu time spent up to now is 407.4 secs Computing kpt #: 99 total cpu time spent up to now is 411.2 secs Computing kpt #: 100 total cpu time spent up to now is 414.9 secs Computing kpt #: 101 total cpu time spent up to now is 418.5 secs Computing kpt #: 102 total cpu time spent up to now is 422.0 secs Computing kpt #: 103 total cpu time spent up to now is 425.4 secs Computing kpt #: 104 total cpu time spent up to now is 428.8 secs Computing kpt #: 105 total cpu time spent up to now is 432.2 secs Computing kpt #: 106 total cpu time spent up to now is 435.6 secs Computing kpt #: 107 total cpu time spent up to now is 438.9 secs Computing kpt #: 108 total cpu time spent up to now is 442.3 secs Computing kpt #: 109 total cpu time spent up to now is 445.6 secs Computing kpt #: 110 total cpu time spent up to now is 449.0 secs Computing kpt #: 111 total cpu time spent up to now is 452.3 secs Computing kpt #: 112 total cpu time spent up to now is 455.8 secs Computing kpt #: 113 total cpu time spent up to now is 459.2 secs Computing kpt #: 114 total cpu time spent up to now is 462.7 secs Computing kpt #: 115 total cpu time spent up to now is 466.4 secs Computing kpt #: 116 total cpu time spent up to now is 470.2 secs Computing kpt #: 117 total cpu time spent up to now is 474.1 secs Computing kpt #: 118 total cpu time spent up to now is 478.1 secs Computing kpt #: 119 total cpu time spent up to now is 482.4 secs Computing kpt #: 120 total cpu time spent up to now is 491.0 secs Computing kpt #: 121 total cpu time spent up to now is 495.8 secs Computing kpt #: 122 total cpu time spent up to now is 500.8 secs Computing kpt #: 123 total cpu time spent up to now is 506.0 secs Computing kpt #: 124 total cpu time spent up to now is 511.1 secs Computing kpt #: 125 total cpu time spent up to now is 515.9 secs Computing kpt #: 126 total cpu time spent up to now is 520.6 secs Computing kpt #: 127 total cpu time spent up to now is 525.1 secs Computing kpt #: 128 total cpu time spent up to now is 529.6 secs Computing kpt #: 129 total cpu time spent up to now is 533.9 secs Computing kpt #: 130 total cpu time spent up to now is 537.9 secs Computing kpt #: 131 total cpu time spent up to now is 541.8 secs Computing kpt #: 132 total cpu time spent up to now is 545.7 secs Computing kpt #: 133 total cpu time spent up to now is 549.5 secs Computing kpt #: 134 total cpu time spent up to now is 553.1 secs Computing kpt #: 135 total cpu time spent up to now is 556.6 secs Computing kpt #: 136 total cpu time spent up to now is 560.1 secs Computing kpt #: 137 total cpu time spent up to now is 563.5 secs Computing kpt #: 138 total cpu time spent up to now is 566.9 secs Computing kpt #: 139 total cpu time spent up to now is 570.3 secs Computing kpt #: 140 total cpu time spent up to now is 573.7 secs Computing kpt #: 141 total cpu time spent up to now is 577.1 secs Computing kpt #: 142 total cpu time spent up to now is 580.5 secs Computing kpt #: 143 total cpu time spent up to now is 584.0 secs Computing kpt #: 144 total cpu time spent up to now is 587.4 secs Computing kpt #: 145 total cpu time spent up to now is 591.2 secs Computing kpt #: 146 total cpu time spent up to now is 595.0 secs Computing kpt #: 147 total cpu time spent up to now is 599.0 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 604.0 secs Computing kpt #: 149 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 608.9 secs Computing kpt #: 150 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 613.9 secs Computing kpt #: 151 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 618.9 secs Computing kpt #: 152 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 623.9 secs Computing kpt #: 153 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 628.8 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 633.8 secs Computing kpt #: 155 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 638.7 secs Computing kpt #: 156 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 643.7 secs Computing kpt #: 157 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 648.8 secs Computing kpt #: 158 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 653.8 secs Computing kpt #: 159 total cpu time spent up to now is 658.5 secs Computing kpt #: 160 total cpu time spent up to now is 663.0 secs Computing kpt #: 161 total cpu time spent up to now is 667.4 secs Computing kpt #: 162 total cpu time spent up to now is 671.4 secs Computing kpt #: 163 total cpu time spent up to now is 675.3 secs Computing kpt #: 164 total cpu time spent up to now is 679.2 secs Computing kpt #: 165 total cpu time spent up to now is 683.0 secs Computing kpt #: 166 total cpu time spent up to now is 686.7 secs Computing kpt #: 167 total cpu time spent up to now is 690.4 secs Computing kpt #: 168 total cpu time spent up to now is 694.1 secs Computing kpt #: 169 total cpu time spent up to now is 697.7 secs Computing kpt #: 170 total cpu time spent up to now is 701.5 secs Computing kpt #: 171 total cpu time spent up to now is 705.4 secs Computing kpt #: 172 total cpu time spent up to now is 709.5 secs Computing kpt #: 173 total cpu time spent up to now is 713.6 secs Computing kpt #: 174 total cpu time spent up to now is 718.0 secs Computing kpt #: 175 total cpu time spent up to now is 722.6 secs Computing kpt #: 176 total cpu time spent up to now is 727.5 secs Computing kpt #: 177 total cpu time spent up to now is 732.6 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 738.0 secs Computing kpt #: 179 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 743.3 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 748.7 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 754.2 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 759.5 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 764.8 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 770.2 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 775.4 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 781.0 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 787.4 secs Computing kpt #: 188 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 796.1 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 801.7 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 807.2 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 812.8 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 818.3 secs Computing kpt #: 193 total cpu time spent up to now is 823.6 secs Computing kpt #: 194 total cpu time spent up to now is 828.4 secs Computing kpt #: 195 total cpu time spent up to now is 833.3 secs Computing kpt #: 196 total cpu time spent up to now is 837.6 secs Computing kpt #: 197 total cpu time spent up to now is 842.0 secs Computing kpt #: 198 total cpu time spent up to now is 846.7 secs Computing kpt #: 199 total cpu time spent up to now is 851.4 secs Computing kpt #: 200 total cpu time spent up to now is 856.3 secs Computing kpt #: 201 total cpu time spent up to now is 861.0 secs Computing kpt #: 202 total cpu time spent up to now is 866.0 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 871.3 secs Computing kpt #: 204 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 876.4 secs Computing kpt #: 205 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 881.4 secs Computing kpt #: 206 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 886.4 secs Computing kpt #: 207 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 891.4 secs Computing kpt #: 208 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 896.3 secs Computing kpt #: 209 total cpu time spent up to now is 901.0 secs Computing kpt #: 210 total cpu time spent up to now is 905.0 secs Computing kpt #: 211 total cpu time spent up to now is 909.0 secs Computing kpt #: 212 total cpu time spent up to now is 912.9 secs Computing kpt #: 213 total cpu time spent up to now is 916.7 secs Computing kpt #: 214 total cpu time spent up to now is 920.5 secs Computing kpt #: 215 total cpu time spent up to now is 924.0 secs Computing kpt #: 216 total cpu time spent up to now is 927.4 secs Computing kpt #: 217 total cpu time spent up to now is 930.9 secs Computing kpt #: 218 total cpu time spent up to now is 934.2 secs Computing kpt #: 219 total cpu time spent up to now is 937.5 secs Computing kpt #: 220 total cpu time spent up to now is 940.9 secs Computing kpt #: 221 total cpu time spent up to now is 944.2 secs Computing kpt #: 222 total cpu time spent up to now is 947.5 secs Computing kpt #: 223 total cpu time spent up to now is 950.9 secs Computing kpt #: 224 total cpu time spent up to now is 954.4 secs Computing kpt #: 225 total cpu time spent up to now is 957.9 secs Computing kpt #: 226 total cpu time spent up to now is 961.6 secs Computing kpt #: 227 total cpu time spent up to now is 965.5 secs Computing kpt #: 228 total cpu time spent up to now is 969.4 secs Computing kpt #: 229 total cpu time spent up to now is 973.2 secs Computing kpt #: 230 total cpu time spent up to now is 977.2 secs Computing kpt #: 231 total cpu time spent up to now is 981.0 secs Computing kpt #: 232 total cpu time spent up to now is 984.8 secs Computing kpt #: 233 total cpu time spent up to now is 988.5 secs Computing kpt #: 234 total cpu time spent up to now is 992.0 secs Computing kpt #: 235 total cpu time spent up to now is 995.5 secs Computing kpt #: 236 total cpu time spent up to now is 999.1 secs Computing kpt #: 237 total cpu time spent up to now is 1002.7 secs Computing kpt #: 238 total cpu time spent up to now is 1006.4 secs Computing kpt #: 239 total cpu time spent up to now is 1010.2 secs Computing kpt #: 240 total cpu time spent up to now is 1013.8 secs Computing kpt #: 241 total cpu time spent up to now is 1017.6 secs Computing kpt #: 242 total cpu time spent up to now is 1021.4 secs Computing kpt #: 243 total cpu time spent up to now is 1025.2 secs Computing kpt #: 244 total cpu time spent up to now is 1029.1 secs Computing kpt #: 245 total cpu time spent up to now is 1033.0 secs Computing kpt #: 246 total cpu time spent up to now is 1036.9 secs Computing kpt #: 247 total cpu time spent up to now is 1040.9 secs Computing kpt #: 248 total cpu time spent up to now is 1044.9 secs Computing kpt #: 249 total cpu time spent up to now is 1048.9 secs Computing kpt #: 250 total cpu time spent up to now is 1053.0 secs Computing kpt #: 251 total cpu time spent up to now is 1057.0 secs Computing kpt #: 252 total cpu time spent up to now is 1061.2 secs Computing kpt #: 253 total cpu time spent up to now is 1065.4 secs Computing kpt #: 254 total cpu time spent up to now is 1069.7 secs Computing kpt #: 255 total cpu time spent up to now is 1074.2 secs Computing kpt #: 256 total cpu time spent up to now is 1078.9 secs Computing kpt #: 257 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1084.2 secs Computing kpt #: 258 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1093.7 secs Computing kpt #: 259 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1099.2 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1104.7 secs Computing kpt #: 261 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1110.3 secs Computing kpt #: 262 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1115.9 secs Computing kpt #: 263 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1121.5 secs Computing kpt #: 264 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1127.1 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1132.5 secs Computing kpt #: 266 total cpu time spent up to now is 1137.7 secs Computing kpt #: 267 total cpu time spent up to now is 1142.9 secs Computing kpt #: 268 total cpu time spent up to now is 1147.9 secs Computing kpt #: 269 total cpu time spent up to now is 1152.8 secs Computing kpt #: 270 total cpu time spent up to now is 1157.6 secs Computing kpt #: 271 total cpu time spent up to now is 1162.4 secs Computing kpt #: 272 total cpu time spent up to now is 1167.5 secs Computing kpt #: 273 total cpu time spent up to now is 1172.8 secs Computing kpt #: 274 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1178.2 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1183.6 secs Computing kpt #: 276 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1189.0 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1194.4 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1199.9 secs Computing kpt #: 279 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1205.4 secs Computing kpt #: 280 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1210.8 secs Computing kpt #: 281 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1216.2 secs Computing kpt #: 282 total cpu time spent up to now is 1219.7 secs Computing kpt #: 283 total cpu time spent up to now is 1223.1 secs Computing kpt #: 284 total cpu time spent up to now is 1226.5 secs Computing kpt #: 285 total cpu time spent up to now is 1229.9 secs Computing kpt #: 286 total cpu time spent up to now is 1233.3 secs Computing kpt #: 287 total cpu time spent up to now is 1236.8 secs Computing kpt #: 288 total cpu time spent up to now is 1240.2 secs Computing kpt #: 289 total cpu time spent up to now is 1243.7 secs Computing kpt #: 290 total cpu time spent up to now is 1247.3 secs Computing kpt #: 291 total cpu time spent up to now is 1251.1 secs Computing kpt #: 292 total cpu time spent up to now is 1255.0 secs Computing kpt #: 293 total cpu time spent up to now is 1258.9 secs Computing kpt #: 294 total cpu time spent up to now is 1262.9 secs Computing kpt #: 295 total cpu time spent up to now is 1266.9 secs Computing kpt #: 296 total cpu time spent up to now is 1271.0 secs Computing kpt #: 297 total cpu time spent up to now is 1275.1 secs Computing kpt #: 298 total cpu time spent up to now is 1279.2 secs Computing kpt #: 299 total cpu time spent up to now is 1283.8 secs Computing kpt #: 300 total cpu time spent up to now is 1288.5 secs Computing kpt #: 301 total cpu time spent up to now is 1293.2 secs Computing kpt #: 302 total cpu time spent up to now is 1298.0 secs Computing kpt #: 303 total cpu time spent up to now is 1303.1 secs Computing kpt #: 304 total cpu time spent up to now is 1308.2 secs Computing kpt #: 305 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1313.6 secs Computing kpt #: 306 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1319.0 secs Computing kpt #: 307 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1324.9 secs Computing kpt #: 308 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1330.3 secs Computing kpt #: 309 total cpu time spent up to now is 1335.6 secs Computing kpt #: 310 total cpu time spent up to now is 1340.7 secs Computing kpt #: 311 total cpu time spent up to now is 1345.8 secs Computing kpt #: 312 total cpu time spent up to now is 1350.8 secs ethr = 1.85E-11, avg # of iterations = 82.4 total cpu time spent up to now is 1350.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 11971 PWs) bands (ev): -4.0967 -4.0967 -3.7912 -3.7912 -3.0819 -3.0819 -2.6125 -2.6125 -1.4356 -1.4356 -1.4159 -1.4159 3.7111 3.7111 3.8239 3.8239 3.8824 3.8824 4.8656 4.8656 4.9841 4.9841 5.3944 5.3944 5.4182 5.4182 5.9960 5.9960 6.6452 6.6452 6.7902 6.7902 6.7906 6.7906 7.1098 7.1098 7.2136 7.2136 7.2633 7.2633 7.3376 7.3376 7.3830 7.3830 7.5748 7.5748 7.7004 7.7004 7.7161 7.7161 7.8446 7.8446 8.2227 8.2227 8.7653 8.7653 9.0609 9.0609 9.5065 9.5065 9.6550 9.6550 9.9278 9.9278 k = 0.0061 0.0171-0.0000 ( 11981 PWs) bands (ev): -4.0954 -4.0954 -3.7900 -3.7900 -3.0808 -3.0808 -2.6119 -2.6119 -1.4352 -1.4352 -1.4154 -1.4154 3.7118 3.7118 3.8243 3.8243 3.8838 3.8838 4.8664 4.8664 4.9841 4.9841 5.3934 5.3934 5.4186 5.4186 5.9950 5.9950 6.6428 6.6428 6.7808 6.7808 6.7968 6.7968 7.0964 7.0964 7.2101 7.2101 7.2694 7.2694 7.3321 7.3321 7.3831 7.3831 7.5709 7.5709 7.6984 7.6984 7.7177 7.7177 7.8475 7.8475 8.2260 8.2260 8.7651 8.7651 9.0575 9.0575 9.5115 9.5115 9.6511 9.6511 9.9222 9.9222 k = 0.0123 0.0342-0.0000 ( 11975 PWs) bands (ev): -4.0914 -4.0914 -3.7865 -3.7865 -3.0778 -3.0778 -2.6101 -2.6101 -1.4341 -1.4341 -1.4138 -1.4138 3.7139 3.7139 3.8253 3.8253 3.8878 3.8878 4.8688 4.8688 4.9841 4.9841 5.3908 5.3908 5.4197 5.4197 5.9923 5.9923 6.6353 6.6353 6.7679 6.7679 6.7999 6.7999 7.0623 7.0623 7.1993 7.1993 7.2817 7.2817 7.3168 7.3168 7.3830 7.3830 7.5610 7.5610 7.6932 7.6932 7.7203 7.7203 7.8561 7.8561 8.2356 8.2356 8.7644 8.7644 9.0479 9.0479 9.5260 9.5260 9.6388 9.6388 9.9048 9.9048 k = 0.0184 0.0514-0.0000 ( 11987 PWs) bands (ev): -4.0848 -4.0848 -3.7806 -3.7806 -3.0727 -3.0727 -2.6071 -2.6071 -1.4324 -1.4324 -1.4113 -1.4113 3.7174 3.7174 3.8271 3.8271 3.8944 3.8944 4.8728 4.8728 4.9839 4.9839 5.3868 5.3868 5.4212 5.4212 5.9877 5.9877 6.6223 6.6223 6.7512 6.7512 6.7995 6.7995 7.0166 7.0166 7.1801 7.1801 7.2918 7.2918 7.2946 7.2946 7.3828 7.3828 7.5479 7.5479 7.6843 7.6843 7.7228 7.7228 7.8696 7.8696 8.2502 8.2502 8.7635 8.7635 9.0330 9.0330 9.5480 9.5480 9.6166 9.6166 9.8771 9.8771 k = 0.0245 0.0685-0.0000 ( 11973 PWs) bands (ev): -4.0755 -4.0755 -3.7724 -3.7724 -3.0655 -3.0655 -2.6029 -2.6029 -1.4299 -1.4299 -1.4077 -1.4077 3.7222 3.7222 3.8295 3.8295 3.9036 3.9036 4.8783 4.8783 4.9835 4.9835 5.3816 5.3816 5.4228 5.4228 5.9812 5.9812 6.6033 6.6033 6.7294 6.7294 6.7957 6.7957 6.9662 6.9662 7.1512 7.1512 7.2650 7.2650 7.2978 7.2978 7.3832 7.3832 7.5337 7.5337 7.6714 7.6714 7.7262 7.7262 7.8856 7.8856 8.2686 8.2686 8.7627 8.7627 9.0141 9.0141 9.5636 9.5636 9.5949 9.5949 9.8472 9.8472 k = 0.0307 0.0856-0.0000 ( 11971 PWs) bands (ev): -4.0637 -4.0637 -3.7619 -3.7619 -3.0564 -3.0564 -2.5975 -2.5975 -1.4268 -1.4268 -1.4033 -1.4033 3.7283 3.7283 3.8325 3.8325 3.9153 3.9153 4.8850 4.8850 4.9826 4.9826 5.3752 5.3752 5.4244 5.4244 5.9727 5.9727 6.5777 6.5777 6.7000 6.7000 6.7882 6.7882 6.9165 6.9165 7.1129 7.1129 7.2304 7.2304 7.2967 7.2967 7.3856 7.3856 7.5189 7.5189 7.6559 7.6559 7.7314 7.7314 7.9014 7.9014 8.2894 8.2894 8.7624 8.7624 8.9924 8.9924 9.5236 9.5236 9.6206 9.6206 9.8235 9.8235 k = 0.0368 0.1027-0.0000 ( 11959 PWs) bands (ev): -4.0492 -4.0492 -3.7490 -3.7490 -3.0452 -3.0452 -2.5909 -2.5909 -1.4231 -1.4231 -1.3979 -1.3979 3.7355 3.7355 3.8359 3.8359 3.9294 3.9294 4.8929 4.8929 4.9809 4.9809 5.3677 5.3677 5.4261 5.4261 5.9622 5.9622 6.5451 6.5451 6.6605 6.6605 6.7764 6.7764 6.8725 6.8725 7.0674 7.0674 7.1898 7.1898 7.2892 7.2892 7.3904 7.3904 7.5034 7.5034 7.6402 7.6402 7.7382 7.7382 7.9148 7.9148 8.3110 8.3110 8.7629 8.7629 8.9686 8.9686 9.4641 9.4641 9.6583 9.6583 9.8090 9.8090 k = 0.0429 0.1198-0.0000 ( 11969 PWs) bands (ev): -4.0321 -4.0321 -3.7339 -3.7339 -3.0322 -3.0322 -2.5833 -2.5833 -1.4188 -1.4188 -1.3917 -1.3917 3.7438 3.7438 3.8397 3.8397 3.9457 3.9457 4.9016 4.9016 4.9780 4.9780 5.3589 5.3589 5.4277 5.4277 5.9496 5.9496 6.5050 6.5050 6.6102 6.6102 6.7589 6.7589 6.8372 6.8372 7.0177 7.0177 7.1434 7.1434 7.2754 7.2754 7.3975 7.3975 7.4870 7.4870 7.6269 7.6269 7.7458 7.7458 7.9249 7.9249 8.3325 8.3325 8.7645 8.7645 8.9432 8.9432 9.3967 9.3967 9.6954 9.6954 9.8065 9.8065 k = 0.0491 0.1369-0.0000 ( 11975 PWs) bands (ev): -4.0126 -4.0126 -3.7165 -3.7165 -3.0172 -3.0172 -2.5745 -2.5745 -1.4141 -1.4141 -1.3846 -1.3846 3.7529 3.7529 3.8435 3.8435 3.9641 3.9641 4.9108 4.9108 4.9735 4.9735 5.3488 5.3488 5.4294 5.4294 5.9344 5.9344 6.4567 6.4567 6.5523 6.5523 6.7336 6.7336 6.8099 6.8099 6.9674 6.9674 7.0918 7.0918 7.2560 7.2560 7.4058 7.4058 7.4703 7.4703 7.6175 7.6175 7.7532 7.7532 7.9313 7.9313 8.3528 8.3528 8.7675 8.7675 8.9167 8.9167 9.3252 9.3252 9.7224 9.7224 9.8222 9.8222 k = 0.0552 0.1541-0.0000 ( 11975 PWs) bands (ev): -3.9905 -3.9905 -3.6970 -3.6970 -3.0003 -3.0003 -2.5647 -2.5647 -1.4089 -1.4089 -1.3769 -1.3769 3.7628 3.7628 3.8473 3.8473 3.9844 3.9844 4.9202 4.9202 4.9670 4.9670 5.3371 5.3371 5.4313 5.4313 5.9165 5.9165 6.3999 6.3999 6.4913 6.4913 6.6999 6.6999 6.7859 6.7859 6.9206 6.9206 7.0368 7.0368 7.2313 7.2313 7.4111 7.4111 7.4573 7.4573 7.6130 7.6130 7.7596 7.7596 7.9342 7.9342 8.3711 8.3711 8.7719 8.7719 8.8891 8.8891 9.2521 9.2521 9.7348 9.7348 9.8415 9.8421 k = 0.0613 0.1712-0.0000 ( 11967 PWs) bands (ev): -3.9659 -3.9659 -3.6752 -3.6752 -2.9816 -2.9816 -2.5539 -2.5539 -1.4034 -1.4034 -1.3685 -1.3685 3.7732 3.7732 3.8507 3.8507 4.0066 4.0066 4.9293 4.9293 4.9581 4.9581 5.3235 5.3235 5.4336 5.4336 5.8952 5.8952 6.3356 6.3356 6.4303 6.4303 6.6584 6.6584 6.7588 6.7588 6.8810 6.8810 6.9810 6.9810 7.2020 7.2020 7.4050 7.4050 7.4564 7.4564 7.6133 7.6133 7.7642 7.7642 7.9342 7.9342 8.3868 8.3868 8.7778 8.7778 8.8607 8.8607 9.1791 9.1791 9.7398 9.7398 9.8258 9.8258 k = 0.0675 0.1883-0.0000 ( 11967 PWs) bands (ev): -3.9388 -3.9388 -3.6513 -3.6513 -2.9611 -2.9611 -2.5421 -2.5421 -1.3977 -1.3977 -1.3595 -1.3595 3.7839 3.7839 3.8535 3.8535 4.0302 4.0302 4.9373 4.9373 4.9463 4.9463 5.3076 5.3076 5.4363 5.4363 5.8696 5.8696 6.2668 6.2668 6.3700 6.3700 6.6101 6.6101 6.7252 6.7252 6.8482 6.8482 6.9291 6.9291 7.1690 7.1690 7.3884 7.3884 7.4669 7.4669 7.6181 7.6181 7.7667 7.7667 7.9319 7.9319 8.3994 8.3994 8.7848 8.7848 8.8319 8.8319 9.1076 9.1076 9.7439 9.7439 9.8115 9.8115 k = 0.0736 0.2054-0.0000 ( 11971 PWs) bands (ev): -3.9094 -3.9094 -3.6253 -3.6253 -2.9389 -2.9389 -2.5293 -2.5293 -1.3919 -1.3919 -1.3501 -1.3501 3.7947 3.7947 3.8556 3.8556 4.0552 4.0552 4.9307 4.9307 4.9441 4.9441 5.2888 5.2888 5.4397 5.4397 5.8385 5.8385 6.1976 6.1976 6.3103 6.3103 6.5563 6.5563 6.6857 6.6857 6.8130 6.8130 6.8899 6.8899 7.1331 7.1331 7.3682 7.3682 7.4815 7.4815 7.6267 7.6267 7.7668 7.7668 7.9281 7.9281 8.4086 8.4086 8.7876 8.7876 8.8076 8.8076 9.0389 9.0389 9.7492 9.7492 9.7991 9.7991 k = 0.0797 0.2225-0.0000 ( 11983 PWs) bands (ev): -3.8777 -3.8777 -3.5973 -3.5973 -2.9151 -2.9151 -2.5157 -2.5157 -1.3860 -1.3860 -1.3404 -1.3404 3.8054 3.8054 3.8565 3.8565 4.0811 4.0811 4.9117 4.9117 4.9481 4.9481 5.2668 5.2668 5.4437 5.4437 5.8001 5.8001 6.1325 6.1325 6.2510 6.2510 6.4991 6.4991 6.6428 6.6428 6.7683 6.7683 6.8686 6.8686 7.0951 7.0951 7.3468 7.3468 7.4970 7.4970 7.6386 7.6386 7.7648 7.7648 7.9238 7.9238 8.4140 8.4140 8.7648 8.7648 8.8081 8.8081 8.9757 8.9757 9.7562 9.7562 9.7891 9.7891 k = 0.0859 0.2397-0.0000 ( 11963 PWs) bands (ev): -3.8437 -3.8437 -3.5672 -3.5672 -2.8897 -2.8897 -2.5013 -2.5013 -1.3802 -1.3802 -1.3304 -1.3304 3.8156 3.8156 3.8560 3.8560 4.1076 4.1076 4.8887 4.8887 4.9489 4.9489 5.2409 5.2409 5.4483 5.4483 5.7526 5.7526 6.0751 6.0751 6.1927 6.1927 6.4408 6.4408 6.5980 6.5980 6.7196 6.7196 6.8585 6.8585 7.0560 7.0560 7.3249 7.3249 7.5112 7.5112 7.6534 7.6534 7.7615 7.7615 7.9197 7.9197 8.4154 8.4154 8.7335 8.7335 8.8104 8.8104 8.9247 8.9247 9.7626 9.7626 9.7837 9.7837 k = 0.0920 0.2568-0.0000 ( 11949 PWs) bands (ev): -3.8075 -3.8075 -3.5353 -3.5353 -2.8629 -2.8629 -2.4861 -2.4861 -1.3746 -1.3746 -1.3204 -1.3204 3.8251 3.8251 3.8540 3.8540 4.1343 4.1343 4.8616 4.8616 4.9454 4.9454 5.2107 5.2107 5.4533 5.4533 5.6951 5.6951 6.0284 6.0284 6.1361 6.1361 6.3831 6.3831 6.5523 6.5523 6.6721 6.6721 6.8535 6.8535 7.0165 7.0165 7.3026 7.3026 7.5223 7.5223 7.6705 7.6705 7.7582 7.7582 7.9164 7.9164 8.4127 8.4127 8.7007 8.7007 8.7915 8.7915 8.9032 8.9032 9.7622 9.7622 9.7882 9.7882 k = 0.0981 0.2739-0.0000 ( 11953 PWs) bands (ev): -3.7691 -3.7691 -3.5015 -3.5015 -2.8346 -2.8346 -2.4702 -2.4702 -1.3695 -1.3695 -1.3105 -1.3105 3.8331 3.8331 3.8506 3.8506 4.1606 4.1606 4.8303 4.8303 4.9367 4.9367 5.1758 5.1758 5.4582 5.4582 5.6285 5.6285 5.9933 5.9933 6.0821 6.0821 6.3277 6.3277 6.5070 6.5070 6.6282 6.6282 6.8507 6.8507 6.9775 6.9775 7.2797 7.2797 7.5279 7.5279 7.6894 7.6894 7.7570 7.7570 7.9147 7.9147 8.4061 8.4061 8.6671 8.6671 8.7488 8.7488 8.9135 8.9135 9.7570 9.7570 9.7983 9.7983 k = 0.1042 0.2910-0.0000 ( 11946 PWs) bands (ev): -3.7288 -3.7288 -3.4659 -3.4659 -2.8050 -2.8050 -2.4537 -2.4537 -1.3648 -1.3648 -1.3008 -1.3008 3.8368 3.8368 3.8481 3.8481 4.1858 4.1858 4.7949 4.7949 4.9221 4.9221 5.1359 5.1359 5.4625 5.4625 5.5557 5.5557 5.9690 5.9690 6.0319 6.0319 6.2759 6.2759 6.4630 6.4630 6.5884 6.5884 6.8483 6.8483 6.9403 6.9403 7.2562 7.2562 7.5256 7.5256 7.7095 7.7095 7.7601 7.7601 7.9149 7.9149 8.3957 8.3957 8.6332 8.6332 8.6993 8.6993 8.9390 8.9390 9.7510 9.7510 9.8063 9.8063 k = 0.1104 0.3081-0.0000 ( 11938 PWs) bands (ev): -3.6864 -3.6864 -3.4286 -3.4286 -2.7743 -2.7743 -2.4367 -2.4367 -1.3608 -1.3608 -1.2916 -1.2916 3.8313 3.8313 3.8512 3.8512 4.2090 4.2090 4.7554 4.7554 4.9010 4.9010 5.0909 5.0909 5.4607 5.4607 5.4850 5.4850 5.9538 5.9538 5.9869 5.9869 6.2286 6.2286 6.4214 6.4214 6.5529 6.5529 6.8435 6.8435 6.9074 6.9074 7.2320 7.2320 7.5143 7.5143 7.7303 7.7303 7.7688 7.7688 7.9174 7.9174 8.3823 8.3823 8.5989 8.5989 8.6503 8.6503 8.9724 8.9724 9.7442 9.7442 9.8064 9.8064 k = 0.1165 0.3253-0.0000 ( 11946 PWs) bands (ev): -3.6422 -3.6422 -3.3898 -3.3898 -2.7425 -2.7425 -2.4193 -2.4193 -1.3576 -1.3576 -1.2829 -1.2829 3.8206 3.8206 3.8555 3.8555 4.2292 4.2292 4.7120 4.7120 4.8733 4.8733 5.0407 5.0407 5.3991 5.3991 5.4730 5.4730 5.9371 5.9371 5.9568 5.9568 6.1866 6.1866 6.3831 6.3831 6.5216 6.5216 6.8307 6.8307 6.8842 6.8842 7.2069 7.2069 7.4942 7.4942 7.7510 7.7510 7.7829 7.7829 7.9224 7.9224 8.3663 8.3663 8.5646 8.5646 8.6042 8.6042 9.0113 9.0113 9.7356 9.7356 9.7964 9.7964 k = 0.1226 0.3424-0.0000 ( 11952 PWs) bands (ev): -3.5963 -3.5963 -3.3494 -3.3494 -2.7097 -2.7097 -2.4015 -2.4015 -1.3555 -1.3555 -1.2750 -1.2750 3.8069 3.8069 3.8587 3.8587 4.2450 4.2450 4.6650 4.6650 4.8389 4.8389 4.9857 4.9857 5.3269 5.3269 5.4739 5.4739 5.9041 5.9041 5.9554 5.9554 6.1502 6.1502 6.3486 6.3486 6.4945 6.4945 6.8066 6.8066 6.8742 6.8742 7.1812 7.1812 7.4667 7.4667 7.7709 7.7709 7.8014 7.8014 7.9301 7.9301 8.3486 8.3486 8.5303 8.5303 8.5615 8.5615 9.0546 9.0546 9.7230 9.7230 9.7810 9.7810 k = 0.1288 0.3595-0.0000 ( 11954 PWs) bands (ev): -3.5487 -3.5487 -3.3077 -3.3077 -2.6762 -2.6762 -2.3834 -2.3834 -1.3545 -1.3545 -1.2681 -1.2681 3.7904 3.7904 3.8604 3.8604 4.2549 4.2549 4.6147 4.6147 4.7978 4.7978 4.9266 4.9266 5.2609 5.2609 5.4739 5.4739 5.8724 5.8724 5.9639 5.9639 6.1196 6.1196 6.3190 6.3190 6.4714 6.4714 6.7774 6.7774 6.8710 6.8710 7.1549 7.1549 7.4335 7.4335 7.7891 7.7891 7.8228 7.8228 7.9404 7.9404 8.3299 8.3299 8.4962 8.4962 8.5226 8.5226 9.1017 9.1017 9.7042 9.7042 9.7665 9.7665 k = 0.1349 0.3766-0.0000 ( 11950 PWs) bands (ev): -3.4996 -3.4996 -3.2646 -3.2646 -2.6419 -2.6419 -2.3652 -2.3652 -1.3549 -1.3549 -1.2623 -1.2623 3.7714 3.7714 3.8606 3.8606 4.2571 4.2571 4.5616 4.5616 4.7492 4.7492 4.8656 4.8656 5.2047 5.2047 5.4724 5.4724 5.8440 5.8440 5.9785 5.9785 6.0942 6.0942 6.2951 6.2951 6.4522 6.4522 6.7477 6.7477 6.8696 6.8696 7.1284 7.1284 7.3961 7.3961 7.8047 7.8047 7.8459 7.8459 7.9532 7.9532 8.3110 8.3110 8.4629 8.4629 8.4872 8.4872 9.1519 9.1519 9.6802 9.6802 9.7547 9.7547 k = 0.1410 0.3937-0.0000 ( 11946 PWs) bands (ev): -3.4491 -3.4491 -3.2204 -3.2204 -2.6072 -2.6072 -2.3469 -2.3469 -1.3568 -1.3568 -1.2579 -1.2579 3.7500 3.7500 3.8593 3.8593 4.2498 4.2498 4.5063 4.5063 4.6923 4.6923 4.8058 4.8058 5.1605 5.1605 5.4697 5.4697 5.8185 5.8185 5.9976 5.9976 6.0736 6.0736 6.2779 6.2779 6.4364 6.4364 6.7192 6.7192 6.8680 6.8680 7.1020 7.1020 7.3557 7.3557 7.8169 7.8169 7.8698 7.8698 7.9683 7.9683 8.2928 8.2928 8.4310 8.4310 8.4546 8.4546 9.2047 9.2047 9.6538 9.6538 9.7438 9.7438 k = 0.1472 0.4108-0.0000 ( 11956 PWs) bands (ev): -3.3974 -3.3974 -3.1752 -3.1752 -2.5721 -2.5721 -2.3287 -2.3287 -1.3603 -1.3603 -1.2551 -1.2551 3.7266 3.7266 3.8568 3.8568 4.2314 4.2314 4.4497 4.4497 4.6273 4.6273 4.7496 4.7496 5.1296 5.1296 5.4659 5.4659 5.7949 5.7949 6.0186 6.0186 6.0582 6.0582 6.2683 6.2683 6.4239 6.4239 6.6924 6.6924 6.8649 6.8649 7.0763 7.0763 7.3136 7.3136 7.8249 7.8249 7.8939 7.8939 7.9856 7.9856 8.2758 8.2758 8.4011 8.4011 8.4245 8.4245 9.2597 9.2597 9.6272 9.6272 9.7321 9.7321 k = 0.1533 0.4280-0.0000 ( 11968 PWs) bands (ev): -3.3446 -3.3446 -3.1291 -3.1291 -2.5369 -2.5369 -2.3106 -2.3106 -1.3657 -1.3657 -1.2541 -1.2541 3.7013 3.7013 3.8531 3.8531 4.2006 4.2006 4.3931 4.3931 4.5572 4.5572 4.6971 4.6971 5.1121 5.1121 5.4614 5.4614 5.7725 5.7725 6.0287 6.0287 6.0595 6.0595 6.2665 6.2665 6.4143 6.4143 6.6674 6.6674 6.8594 6.8594 7.0520 7.0520 7.2706 7.2706 7.8282 7.8282 7.9174 7.9174 8.0050 8.0050 8.2603 8.2603 8.3735 8.3735 8.3966 8.3966 9.3163 9.3163 9.6021 9.6021 9.7181 9.7181 k = 0.1594 0.4451-0.0000 ( 11990 PWs) bands (ev): -3.2910 -3.2910 -3.0822 -3.0822 -2.5017 -2.5017 -2.2928 -2.2928 -1.3731 -1.3731 -1.2550 -1.2550 3.6746 3.6746 3.8486 3.8486 4.1568 4.1568 4.3380 4.3380 4.4860 4.4860 4.6473 4.6473 5.1071 5.1071 5.4564 5.4564 5.7507 5.7507 6.0200 6.0200 6.0840 6.0840 6.2718 6.2718 6.4074 6.4074 6.6445 6.6445 6.8504 6.8504 7.0298 7.0298 7.2278 7.2278 7.8265 7.8265 7.9400 7.9400 8.0264 8.0264 8.2460 8.2460 8.3485 8.3485 8.3710 8.3710 9.3743 9.3743 9.5792 9.5792 9.7010 9.7010 k = 0.1656 0.4622-0.0000 ( 12000 PWs) bands (ev): -3.2366 -3.2366 -3.0348 -3.0348 -2.4668 -2.4668 -2.2754 -2.2754 -1.3825 -1.3825 -1.2580 -1.2580 3.6467 3.6467 3.8435 3.8435 4.1007 4.1007 4.2849 4.2849 4.4176 4.4176 4.5996 4.5996 5.1129 5.1129 5.4511 5.4511 5.7291 5.7291 6.0091 6.0091 6.1143 6.1143 6.2831 6.2831 6.4028 6.4028 6.6235 6.6235 6.8372 6.8372 7.0098 7.0098 7.1861 7.1861 7.8201 7.8201 7.9612 7.9612 8.0493 8.0493 8.2321 8.2321 8.3267 8.3267 8.3479 8.3479 9.4331 9.4331 9.5594 9.5594 9.6803 9.6803 k = 0.1717 0.4793-0.0000 ( 11992 PWs) bands (ev): -3.1818 -3.1818 -2.9870 -2.9870 -2.4322 -2.4322 -2.2585 -2.2585 -1.3941 -1.3941 -1.2634 -1.2634 3.6180 3.6180 3.8382 3.8382 4.0345 4.0345 4.2336 4.2336 4.3546 4.3546 4.5541 4.5541 5.1275 5.1275 5.4455 5.4455 5.7077 5.7077 5.9993 5.9993 6.1465 6.1465 6.2988 6.2988 6.4004 6.4004 6.6047 6.6047 6.8197 6.8197 6.9918 6.9918 7.1467 7.1467 7.8098 7.8098 7.9806 7.9806 8.0733 8.0733 8.2177 8.2177 8.3086 8.3086 8.3274 8.3274 9.4918 9.4918 9.5436 9.5436 9.6558 9.6558 k = 0.1778 0.4964-0.0000 ( 11982 PWs) bands (ev): -3.1266 -3.1266 -2.9390 -2.9390 -2.3984 -2.3984 -2.2422 -2.2422 -1.4080 -1.4080 -1.2712 -1.2712 3.5889 3.5889 3.8329 3.8329 3.9613 3.9613 4.1833 4.1833 4.2986 4.2986 4.5111 4.5111 5.1489 5.1489 5.4395 5.4395 5.6866 5.6866 5.9909 5.9909 6.1796 6.1796 6.3171 6.3171 6.3998 6.3998 6.5879 6.5879 6.7986 6.7986 6.9746 6.9746 7.1109 7.1109 7.7965 7.7965 7.9979 7.9979 8.0972 8.0972 8.2016 8.2016 8.2956 8.2956 8.3097 8.3097 9.5250 9.5250 9.5571 9.5571 9.6276 9.6276 k = 0.1840 0.5136-0.0000 ( 11990 PWs) bands (ev): -3.0715 -3.0715 -2.8909 -2.8909 -2.3654 -2.3654 -2.2266 -2.2266 -1.4242 -1.4242 -1.2817 -1.2817 3.5597 3.5597 3.8272 3.8272 3.8845 3.8845 4.1338 4.1338 4.2502 4.2502 4.4714 4.4714 5.1754 5.1754 5.4329 5.4329 5.6662 5.6662 5.9836 5.9836 6.2129 6.2129 6.3362 6.3362 6.4009 6.4009 6.5735 6.5735 6.7750 6.7750 6.9565 6.9565 7.0797 7.0797 7.7813 7.7813 8.0129 8.0129 8.1189 8.1189 8.1833 8.1833 8.2890 8.2890 8.2956 8.2956 9.5172 9.5172 9.5960 9.5960 9.6153 9.6153 k = 0.1901 0.5307-0.0000 ( 11986 PWs) bands (ev): -3.0165 -3.0165 -2.8430 -2.8430 -2.3336 -2.3336 -2.2119 -2.2119 -1.4428 -1.4428 -1.2948 -1.2948 3.5308 3.5308 3.8016 3.8016 3.8263 3.8263 4.0861 4.0861 4.2090 4.2090 4.4354 4.4354 5.2055 5.2055 5.4252 5.4252 5.6470 5.6470 5.9771 5.9771 6.2458 6.2458 6.3542 6.3542 6.4033 6.4033 6.5617 6.5617 6.7503 6.7503 6.9369 6.9369 7.0537 7.0537 7.7654 7.7654 8.0251 8.0251 8.1349 8.1349 8.1632 8.1632 8.2812 8.2812 8.2955 8.2955 9.5105 9.5105 9.5619 9.5619 9.6751 9.6751 k = 0.1962 0.5478-0.0000 ( 11998 PWs) bands (ev): -2.9620 -2.9620 -2.7955 -2.7955 -2.3032 -2.3032 -2.1981 -2.1981 -1.4638 -1.4638 -1.3108 -1.3108 3.5025 3.5025 3.7255 3.7255 3.8189 3.8189 4.0417 4.0417 4.1742 4.1742 4.4039 4.4039 5.2378 5.2378 5.4163 5.4163 5.6294 5.6294 5.9708 5.9708 6.2774 6.2774 6.3693 6.3693 6.4068 6.4068 6.5529 6.5529 6.7256 6.7256 6.9166 6.9166 7.0322 7.0322 7.7496 7.7496 8.0341 8.0341 8.1344 8.1344 8.1498 8.1498 8.2717 8.2717 8.3122 8.3122 9.5039 9.5039 9.5281 9.5281 9.7351 9.7351 k = 0.2024 0.5649-0.0000 ( 11986 PWs) bands (ev): -2.9082 -2.9082 -2.7486 -2.7486 -2.2745 -2.2745 -2.1853 -2.1853 -1.4870 -1.4870 -1.3296 -1.3296 3.4748 3.4748 3.6498 3.6498 3.8119 3.8119 4.0030 4.0030 4.1452 4.1452 4.3775 4.3775 5.2709 5.2709 5.4058 5.4058 5.6140 5.6140 5.9645 5.9645 6.3069 6.3069 6.3789 6.3789 6.4124 6.4124 6.5471 6.5471 6.7022 6.7022 6.8976 6.8976 7.0135 7.0135 7.7350 7.7350 8.0391 8.0391 8.1118 8.1118 8.1501 8.1501 8.2646 8.2646 8.3410 8.3410 9.4800 9.4800 9.5127 9.5127 9.7948 9.7948 k = 0.2085 0.5820-0.0000 ( 11968 PWs) bands (ev): -2.8555 -2.8555 -2.7025 -2.7025 -2.2477 -2.2477 -2.1737 -2.1737 -1.5124 -1.5124 -1.3512 -1.3512 3.4477 3.4477 3.5781 3.5781 3.8023 3.8023 3.9722 3.9722 4.1216 4.1216 4.3564 4.3564 5.3025 5.3025 5.3948 5.3948 5.6009 5.6009 5.9575 5.9575 6.3331 6.3331 6.3802 6.3802 6.4223 6.4223 6.5435 6.5435 6.6809 6.6809 6.8826 6.8826 6.9958 6.9958 7.7222 7.7222 8.0381 8.0381 8.0874 8.0874 8.1483 8.1483 8.2604 8.2604 8.3792 8.3792 9.4418 9.4418 9.5125 9.5125 9.8540 9.8540 k = 0.2146 0.5992-0.0000 ( 11970 PWs) bands (ev): -2.8041 -2.8041 -2.6574 -2.6574 -2.2232 -2.2232 -2.1633 -2.1633 -1.5399 -1.5399 -1.3757 -1.3757 3.4203 3.4203 3.5127 3.5127 3.7884 3.7884 3.9513 3.9513 4.1032 4.1032 4.3413 4.3413 5.3259 5.3259 5.3889 5.3889 5.5901 5.5901 5.9497 5.9497 6.3550 6.3550 6.3745 6.3745 6.4359 6.4359 6.5410 6.5410 6.6625 6.6625 6.8736 6.8736 6.9778 6.9778 7.7119 7.7119 8.0257 8.0257 8.0686 8.0686 8.1450 8.1450 8.2596 8.2596 8.4242 8.4242 9.4017 9.4017 9.5157 9.5157 9.9052 9.9053 k = 0.2208 0.6163-0.0000 ( 11994 PWs) bands (ev): -2.7543 -2.7543 -2.6137 -2.6137 -2.2012 -2.2012 -2.1543 -2.1543 -1.5693 -1.5693 -1.4029 -1.4029 3.3890 3.3890 3.4584 3.4584 3.7703 3.7703 3.9403 3.9403 4.0905 4.0905 4.3323 4.3323 5.3269 5.3269 5.4015 5.4015 5.5813 5.5813 5.9408 5.9408 6.3610 6.3610 6.3763 6.3763 6.4486 6.4486 6.5397 6.5397 6.6477 6.6477 6.8716 6.8716 6.9591 6.9591 7.7045 7.7045 7.9996 7.9996 8.0580 8.0580 8.1411 8.1411 8.2625 8.2625 8.4746 8.4746 9.3613 9.3613 9.5206 9.5206 9.8735 9.8735 k = 0.2269 0.6334-0.0000 ( 11986 PWs) bands (ev): -2.7065 -2.7065 -2.5714 -2.5714 -2.1822 -2.1822 -2.1466 -2.1466 -1.6002 -1.6002 -1.4329 -1.4329 3.3490 3.3490 3.4211 3.4211 3.7498 3.7498 3.9368 3.9368 4.0840 4.0840 4.3295 4.3295 5.3091 5.3091 5.4278 5.4278 5.5743 5.5743 5.9312 5.9312 6.3488 6.3488 6.3912 6.3912 6.4543 6.4543 6.5428 6.5428 6.6367 6.6367 6.8763 6.8763 6.9400 6.9400 7.7003 7.7003 7.9665 7.9665 8.0495 8.0495 8.1375 8.1375 8.2693 8.2693 8.5292 8.5292 9.3213 9.3213 9.5267 9.5267 9.8399 9.8399 k = 0.2330 0.6505-0.0000 ( 11984 PWs) bands (ev): -2.6608 -2.6608 -2.5308 -2.5308 -2.1664 -2.1664 -2.1404 -2.1404 -1.6324 -1.6324 -1.4655 -1.4655 3.3036 3.3036 3.3986 3.3986 3.7294 3.7294 3.9379 3.9379 4.0845 4.0845 4.3327 4.3327 5.2832 5.2832 5.4556 5.4556 5.5694 5.5694 5.9213 5.9213 6.3352 6.3352 6.4044 6.4044 6.4491 6.4491 6.5516 6.5516 6.6307 6.6307 6.8847 6.8847 6.9230 6.9230 7.6996 7.6996 7.9305 7.9305 8.0398 8.0398 8.1346 8.1346 8.2802 8.2802 8.5876 8.5876 9.2823 9.2823 9.5336 9.5336 9.8070 9.8070 k = 0.2392 0.6676-0.0000 ( 11984 PWs) bands (ev): -2.6177 -2.6177 -2.4921 -2.4921 -2.1543 -2.1543 -2.1357 -2.1357 -1.6654 -1.6654 -1.5006 -1.5006 3.2597 3.2597 3.3848 3.3848 3.7108 3.7108 3.9415 3.9415 4.0924 4.0924 4.3418 4.3418 5.2522 5.2522 5.4783 5.4783 5.5688 5.5688 5.9119 5.9119 6.3216 6.3216 6.4148 6.4148 6.4373 6.4373 6.5595 6.5595 6.6335 6.6335 6.8846 6.8846 6.9196 6.9196 7.7021 7.7021 7.8935 7.8935 8.0280 8.0280 8.1325 8.1325 8.2950 8.2950 8.6493 8.6493 9.2445 9.2445 9.5410 9.5410 9.7748 9.7748 k = 0.2453 0.6847-0.0000 ( 12000 PWs) bands (ev): -2.5775 -2.5775 -2.4556 -2.4556 -2.1463 -2.1463 -2.1325 -2.1325 -1.6989 -1.6989 -1.5379 -1.5379 3.2209 3.2209 3.3771 3.3771 3.6950 3.6950 3.9464 3.9464 4.1079 4.1079 4.3563 4.3563 5.2170 5.2170 5.4891 5.4891 5.5774 5.5774 5.9040 5.9040 6.3080 6.3080 6.4138 6.4138 6.4314 6.4314 6.5598 6.5598 6.6483 6.6483 6.8704 6.8704 6.9354 6.9354 7.7075 7.7075 7.8567 7.8567 8.0140 8.0140 8.1314 8.1314 8.3136 8.3136 8.7136 8.7136 9.2084 9.2084 9.5487 9.5487 9.7434 9.7434 k = 0.2514 0.7019-0.0000 ( 11980 PWs) bands (ev): -2.5403 -2.5403 -2.4214 -2.4214 -2.1429 -2.1429 -2.1309 -2.1309 -1.7321 -1.7321 -1.5774 -1.5774 3.1885 3.1885 3.3748 3.3748 3.6826 3.6826 3.9526 3.9526 4.1302 4.1302 4.3757 4.3757 5.1778 5.1778 5.4856 5.4856 5.5967 5.5967 5.8985 5.8985 6.2937 6.2937 6.4011 6.4011 6.4333 6.4333 6.5556 6.5556 6.6719 6.6719 6.8543 6.8543 6.9580 6.9580 7.7141 7.7141 7.8222 7.8222 7.9982 7.9982 8.1314 8.1314 8.3355 8.3355 8.7802 8.7802 9.1740 9.1740 9.5565 9.5565 9.7127 9.7127 k = 0.2576 0.7190-0.0000 ( 11994 PWs) bands (ev): -2.5064 -2.5064 -2.3897 -2.3897 -2.1445 -2.1445 -2.1311 -2.1311 -1.7646 -1.7646 -1.6189 -1.6189 3.1634 3.1634 3.3776 3.3776 3.6738 3.6738 3.9608 3.9608 4.1582 4.1582 4.3992 4.3992 5.1347 5.1347 5.4721 5.4721 5.6219 5.6219 5.8964 5.8964 6.2777 6.2777 6.3897 6.3897 6.4289 6.4289 6.5535 6.5535 6.7001 6.7001 6.8405 6.8405 6.9837 6.9837 7.7176 7.7176 7.7950 7.7950 7.9809 7.9809 8.1325 8.1325 8.3606 8.3606 8.8485 8.8485 9.1416 9.1416 9.5644 9.5644 9.6826 9.6826 k = 0.2637 0.7361-0.0000 ( 11990 PWs) bands (ev): -2.4761 -2.4761 -2.3606 -2.3606 -2.1517 -2.1517 -2.1330 -2.1330 -1.7955 -1.7955 -1.6621 -1.6621 3.1458 3.1458 3.3856 3.3856 3.6686 3.6686 3.9717 3.9717 4.1906 4.1906 4.4262 4.4262 5.0878 5.0878 5.4528 5.4528 5.6493 5.6493 5.8981 5.8981 6.2598 6.2598 6.3815 6.3815 6.4151 6.4151 6.5580 6.5580 6.7306 6.7306 6.8301 6.8301 7.0113 7.0113 7.7081 7.7081 7.7849 7.7849 7.9630 7.9630 8.1345 8.1345 8.3885 8.3885 8.9174 8.9174 9.1117 9.1117 9.5722 9.5722 9.6529 9.6529 k = 0.2698 0.7532-0.0000 ( 11998 PWs) bands (ev): -2.4494 -2.4494 -2.3343 -2.3343 -2.1647 -2.1647 -2.1365 -2.1365 -1.8245 -1.8245 -1.7069 -1.7069 3.1362 3.1362 3.3989 3.3989 3.6668 3.6668 3.9859 3.9859 4.2262 4.2262 4.4557 4.4557 5.0375 5.0375 5.4303 5.4303 5.6770 5.6770 5.9039 5.9039 6.2403 6.2403 6.3712 6.3712 6.3980 6.3980 6.5694 6.5694 6.7623 6.7623 6.8239 6.8239 7.0405 7.0405 7.6847 7.6847 7.7928 7.7928 7.9452 7.9452 8.1374 8.1374 8.4188 8.4188 8.9839 8.9839 9.0868 9.0868 9.5796 9.5796 9.6237 9.6237 k = 0.2759 0.7703-0.0000 ( 12000 PWs) bands (ev): -2.4264 -2.4264 -2.3109 -2.3109 -2.1838 -2.1838 -2.1416 -2.1416 -1.8512 -1.8512 -1.7529 -1.7529 3.1347 3.1347 3.4174 3.4174 3.6679 3.6679 4.0040 4.0040 4.2639 4.2639 4.4868 4.4868 4.9839 4.9839 5.4063 5.4063 5.7041 5.7041 5.9137 5.9137 6.2205 6.2205 6.3470 6.3470 6.3919 6.3919 6.5855 6.5855 6.7944 6.7944 6.8225 6.8225 7.0710 7.0710 7.6570 7.6570 7.8088 7.8088 7.9286 7.9286 8.1412 8.1412 8.4513 8.4513 9.0252 9.0252 9.0891 9.0891 9.5831 9.5831 9.5981 9.5981 k = 0.2821 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.4073 -2.4073 -2.2904 -2.2904 -2.2086 -2.2086 -2.1484 -2.1484 -1.8755 -1.8755 -1.8001 -1.8001 3.1414 3.1414 3.4411 3.4411 3.6716 3.6716 4.0262 4.0262 4.3023 4.3023 4.5184 4.5184 4.9276 4.9276 5.3828 5.3828 5.7298 5.7298 5.9275 5.9275 6.2013 6.2013 6.3139 6.3139 6.3935 6.3935 6.6048 6.6048 6.8191 6.8191 6.8339 6.8339 7.1026 7.1026 7.6300 7.6300 7.8270 7.8270 7.9150 7.9150 8.1457 8.1457 8.4857 8.4857 9.0133 9.0133 9.1458 9.1458 9.5611 9.5611 9.5976 9.5976 k = 0.2821 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.4073 -2.4073 -2.2904 -2.2904 -2.2086 -2.2086 -2.1484 -2.1484 -1.8755 -1.8755 -1.8001 -1.8001 3.1414 3.1414 3.4411 3.4411 3.6716 3.6716 4.0262 4.0262 4.3023 4.3023 4.5184 4.5184 4.9276 4.9276 5.3828 5.3828 5.7298 5.7298 5.9275 5.9275 6.2013 6.2013 6.3139 6.3139 6.3935 6.3935 6.6048 6.6048 6.8191 6.8191 6.8339 6.8339 7.1026 7.1026 7.6300 7.6300 7.8270 7.8270 7.9150 7.9150 8.1457 8.1457 8.4857 8.4857 9.0133 9.0133 9.1458 9.1458 9.5611 9.5611 9.5976 9.5976 k = 0.2644 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.4147 -2.4147 -2.2980 -2.2980 -2.1991 -2.1991 -2.1461 -2.1461 -1.8670 -1.8670 -1.7832 -1.7832 3.1400 3.1400 3.4342 3.4342 3.6702 3.6702 4.0189 4.0189 4.2886 4.2886 4.5057 4.5057 4.9467 4.9467 5.3891 5.3891 5.7217 5.7217 5.9230 5.9230 6.2071 6.2071 6.3244 6.3244 6.3926 6.3926 6.5990 6.5990 6.8123 6.8123 6.8265 6.8265 7.0929 7.0929 7.6383 7.6383 7.8164 7.8164 7.9231 7.9231 8.1433 8.1433 8.4690 8.4690 9.0254 9.0254 9.1306 9.1306 9.5736 9.5736 9.5972 9.5972 k = 0.2468 0.7875-0.0000 ( 11982 PWs) bands (ev): -2.4250 -2.4250 -2.3078 -2.3078 -2.1893 -2.1893 -2.1442 -2.1442 -1.8570 -1.8570 -1.7644 -1.7644 3.1428 3.1428 3.4308 3.4308 3.6690 3.6690 4.0128 4.0128 4.2728 4.2728 4.4882 4.4882 4.9665 4.9665 5.3929 5.3929 5.7136 5.7136 5.9199 5.9199 6.2124 6.2124 6.3315 6.3315 6.3923 6.3923 6.5964 6.5964 6.8002 6.8002 6.8214 6.8214 7.0848 7.0848 7.6463 7.6463 7.7995 7.7995 7.9369 7.9369 8.1394 8.1394 8.4427 8.4427 9.0474 9.0474 9.1281 9.1281 9.5877 9.5877 9.6041 9.6041 k = 0.2292 0.7875-0.0000 ( 11987 PWs) bands (ev): -2.4368 -2.4368 -2.3191 -2.3191 -2.1800 -2.1800 -2.1427 -2.1427 -1.8458 -1.8458 -1.7446 -1.7446 3.1498 3.1498 3.4310 3.4310 3.6678 3.6678 4.0081 4.0081 4.2549 4.2549 4.4664 4.4664 4.9866 4.9866 5.3942 5.3942 5.7054 5.7054 5.9183 5.9183 6.2166 6.2166 6.3334 6.3334 6.3932 6.3932 6.5986 6.5986 6.7856 6.7856 6.8164 6.8164 7.0779 7.0779 7.6536 7.6536 7.7800 7.7800 7.9528 7.9528 8.1338 8.1338 8.4085 8.4085 9.0778 9.0778 9.1377 9.1377 9.5937 9.5937 9.6277 9.6277 k = 0.2116 0.7875-0.0000 ( 11991 PWs) bands (ev): -2.4493 -2.4493 -2.3311 -2.3311 -2.1716 -2.1716 -2.1415 -2.1415 -1.8339 -1.8339 -1.7243 -1.7243 3.1607 3.1607 3.4345 3.4345 3.6664 3.6664 4.0046 4.0046 4.2352 4.2352 4.4407 4.4407 5.0068 5.0068 5.3931 5.3931 5.6970 5.6970 5.9180 5.9180 6.2194 6.2194 6.3297 6.3297 6.3954 6.3954 6.6062 6.6062 6.7706 6.7706 6.8106 6.8106 7.0720 7.0720 7.6599 7.6599 7.7607 7.7607 7.9689 7.9689 8.1269 8.1269 8.3687 8.3687 9.1139 9.1139 9.1586 9.1586 9.5986 9.5986 9.6604 9.6604 k = 0.1939 0.7875-0.0000 ( 11989 PWs) bands (ev): -2.4620 -2.4620 -2.3433 -2.3433 -2.1643 -2.1643 -2.1406 -2.1406 -1.8216 -1.8216 -1.7044 -1.7044 3.1755 3.1755 3.4413 3.4413 3.6649 3.6649 4.0022 4.0022 4.2136 4.2136 4.4118 4.4118 5.0268 5.0268 5.3899 5.3899 5.6880 5.6880 5.9191 5.9191 6.2202 6.2202 6.3217 6.3217 6.3988 6.3988 6.6182 6.6182 6.7568 6.7568 6.8041 6.8041 7.0664 7.0664 7.6646 7.6646 7.7433 7.7433 7.9841 7.9841 8.1188 8.1188 8.3256 8.3256 9.1525 9.1525 9.1903 9.1903 9.6058 9.6058 9.6982 9.6982 k = 0.1763 0.7875-0.0000 ( 11994 PWs) bands (ev): -2.4743 -2.4743 -2.3555 -2.3555 -2.1583 -2.1583 -2.1398 -2.1398 -1.8092 -1.8092 -1.6851 -1.6851 3.1938 3.1938 3.4511 3.4511 3.6633 3.6633 4.0005 4.0005 4.1905 4.1905 4.3802 4.3802 5.0463 5.0463 5.3854 5.3854 5.6779 5.6779 5.9212 5.9212 6.2184 6.2184 6.3113 6.3113 6.4037 6.4037 6.6315 6.6315 6.7460 6.7460 6.7972 6.7972 7.0608 7.0608 7.6667 7.6667 7.7296 7.7296 7.9981 7.9981 8.1096 8.1096 8.2813 8.2813 9.1921 9.1921 9.2303 9.2303 9.6164 9.6164 9.7395 9.7395 k = 0.1587 0.7875-0.0000 ( 11996 PWs) bands (ev): -2.4861 -2.4861 -2.3671 -2.3671 -2.1534 -2.1534 -2.1391 -2.1391 -1.7971 -1.7971 -1.6668 -1.6668 3.2154 3.2154 3.4633 3.4633 3.6620 3.6620 3.9990 3.9990 4.1661 4.1661 4.3470 4.3470 5.0648 5.0648 5.3807 5.3807 5.6663 5.6663 5.9242 5.9242 6.2142 6.2142 6.2999 6.2999 6.4104 6.4104 6.6417 6.6417 6.7404 6.7404 6.7912 6.7912 7.0547 7.0547 7.6654 7.6654 7.7208 7.7208 8.0104 8.0104 8.0995 8.0995 8.2376 8.2376 9.2334 9.2334 9.2742 9.2742 9.6311 9.6311 9.7826 9.7826 k = 0.1410 0.7875-0.0000 ( 12004 PWs) bands (ev): -2.4971 -2.4971 -2.3780 -2.3780 -2.1498 -2.1498 -2.1383 -2.1383 -1.7856 -1.7856 -1.6499 -1.6499 3.2397 3.2397 3.4772 3.4772 3.6613 3.6613 3.9970 3.9970 4.1407 4.1407 4.3131 4.3131 5.0818 5.0818 5.3768 5.3768 5.6528 5.6528 5.9279 5.9279 6.2081 6.2081 6.2886 6.2886 6.4191 6.4191 6.6451 6.6451 6.7399 6.7399 6.7892 6.7892 7.0480 7.0480 7.6613 7.6613 7.7168 7.7168 8.0210 8.0210 8.0884 8.0884 8.1961 8.1961 9.2771 9.2771 9.3176 9.3176 9.6504 9.6504 9.8257 9.8257 k = 0.1234 0.7875-0.0000 ( 12004 PWs) bands (ev): -2.5071 -2.5071 -2.3879 -2.3879 -2.1473 -2.1473 -2.1374 -2.1374 -1.7750 -1.7750 -1.6346 -1.6346 3.2664 3.2664 3.4917 3.4917 3.6622 3.6622 3.9934 3.9934 4.1152 4.1152 4.2796 4.2796 5.0967 5.0967 5.3751 5.3751 5.6369 5.6369 5.9318 5.9318 6.2010 6.2010 6.2782 6.2782 6.4292 6.4292 6.6416 6.6416 6.7392 6.7392 6.7956 6.7956 7.0405 7.0405 7.6561 7.6561 7.7156 7.7156 8.0296 8.0296 8.0760 8.0760 8.1589 8.1589 9.3227 9.3227 9.3577 9.3577 9.6743 9.6743 9.8668 9.8668 k = 0.1058 0.7875-0.0000 ( 12000 PWs) bands (ev): -2.5159 -2.5159 -2.3968 -2.3968 -2.1457 -2.1457 -2.1363 -2.1363 -1.7654 -1.7654 -1.6210 -1.6210 3.2947 3.2947 3.5049 3.5049 3.6659 3.6659 3.9862 3.9862 4.0910 4.0910 4.2480 4.2480 5.1088 5.1088 5.3768 5.3768 5.6186 5.6186 5.9359 5.9359 6.1939 6.1939 6.2689 6.2689 6.4400 6.4400 6.6344 6.6344 6.7344 6.7344 6.8109 6.8109 7.0322 7.0322 7.6515 7.6515 7.7157 7.7157 8.0354 8.0354 8.0620 8.0620 8.1283 8.1283 9.3681 9.3681 9.3946 9.3946 9.7014 9.7014 9.9036 9.9036 k = 0.0881 0.7875-0.0000 ( 12003 PWs) bands (ev): -2.5235 -2.5235 -2.4045 -2.4045 -2.1448 -2.1448 -2.1351 -2.1351 -1.7570 -1.7570 -1.6093 -1.6093 3.3240 3.3240 3.5148 3.5148 3.6743 3.6743 3.9730 3.9730 4.0705 4.0705 4.2194 4.2194 5.1179 5.1179 5.3828 5.3828 5.5980 5.5980 5.9397 5.9397 6.1876 6.1876 6.2611 6.2611 6.4508 6.4508 6.6261 6.6261 6.7272 6.7272 6.8305 6.8305 7.0233 7.0233 7.6483 7.6483 7.7160 7.7160 8.0330 8.0330 8.0507 8.0507 8.1062 8.1062 9.4063 9.4063 9.4335 9.4335 9.7297 9.7297 9.9327 9.9327 k = 0.0705 0.7875-0.0000 ( 12007 PWs) bands (ev): -2.5299 -2.5299 -2.4109 -2.4109 -2.1444 -2.1444 -2.1341 -2.1341 -1.7500 -1.7500 -1.5996 -1.5996 3.3535 3.3535 3.5194 3.5194 3.6885 3.6885 3.9521 3.9521 4.0555 4.0555 4.1951 4.1951 5.1240 5.1240 5.3936 5.3936 5.5753 5.5753 5.9430 5.9430 6.1825 6.1825 6.2546 6.2546 6.4607 6.4607 6.6185 6.6185 6.7194 6.7194 6.8509 6.8509 7.0139 7.0139 7.6467 7.6467 7.7161 7.7161 8.0165 8.0165 8.0498 8.0498 8.0924 8.0924 9.4322 9.4322 9.4786 9.4786 9.7565 9.7565 9.9490 9.9490 k = 0.0529 0.7875-0.0000 ( 12007 PWs) bands (ev): -2.5349 -2.5349 -2.4159 -2.4159 -2.1442 -2.1442 -2.1333 -2.1333 -1.7444 -1.7444 -1.5919 -1.5919 3.3819 3.3819 3.5179 3.5179 3.7088 3.7088 3.9246 3.9246 4.0457 4.0457 4.1761 4.1761 5.1276 5.1276 5.4089 5.4089 5.5509 5.5509 5.9458 5.9458 6.1788 6.1788 6.2496 6.2496 6.4690 6.4690 6.6123 6.6123 6.7122 6.7122 6.8699 6.8699 7.0045 7.0045 7.6463 7.6463 7.7160 7.7160 7.9979 7.9979 8.0506 8.0506 8.0846 8.0846 9.4499 9.4499 9.5241 9.5241 9.7792 9.7792 9.9468 9.9468 k = 0.0353 0.7875-0.0000 ( 12001 PWs) bands (ev): -2.5385 -2.5385 -2.4195 -2.4195 -2.1441 -2.1441 -2.1327 -2.1327 -1.7404 -1.7404 -1.5864 -1.5864 3.4078 3.4078 3.5112 3.5112 3.7334 3.7334 3.8940 3.8940 4.0394 4.0394 4.1626 4.1626 5.1294 5.1294 5.4280 5.4280 5.5256 5.5256 5.9478 5.9478 6.1763 6.1763 6.2461 6.2461 6.4750 6.4750 6.6080 6.6080 6.7065 6.7065 6.8858 6.8858 6.9959 6.9959 7.6467 7.6467 7.7156 7.7156 7.9827 7.9827 8.0506 8.0506 8.0805 8.0805 9.4619 9.4619 9.5646 9.5646 9.7957 9.7957 9.9302 9.9302 k = 0.0176 0.7875-0.0000 ( 12005 PWs) bands (ev): -2.5407 -2.5407 -2.4217 -2.4217 -2.1441 -2.1441 -2.1323 -2.1323 -1.7380 -1.7380 -1.5831 -1.5831 3.4284 3.4284 3.5022 3.5022 3.7581 3.7581 3.8654 3.8654 4.0358 4.0358 4.1547 4.1547 5.1301 5.1301 5.4501 5.4501 5.4998 5.4998 5.9491 5.9491 6.1750 6.1750 6.2440 6.2440 6.4787 6.4787 6.6056 6.6056 6.7027 6.7027 6.8968 6.8968 6.9894 6.9894 7.6472 7.6472 7.7153 7.7153 7.9730 7.9730 8.0501 8.0501 8.0787 8.0787 9.4690 9.4690 9.5941 9.5941 9.8049 9.8049 9.9127 9.9127 k = 0.0000 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.5414 -2.5414 -2.4225 -2.4225 -2.1441 -2.1441 -2.1322 -2.1322 -1.7372 -1.7372 -1.5820 -1.5820 3.4372 3.4372 3.4972 3.4972 3.7708 3.7708 3.8513 3.8513 4.0346 4.0346 4.1521 4.1521 5.1303 5.1303 5.4722 5.4722 5.4766 5.4766 5.9495 5.9495 6.1745 6.1745 6.2434 6.2434 6.4799 6.4799 6.6049 6.6049 6.7014 6.7014 6.9009 6.9009 6.9868 6.9868 7.6474 7.6474 7.7152 7.7152 7.9697 7.9697 8.0499 8.0499 8.0782 8.0782 9.4713 9.4713 9.6053 9.6053 9.8075 9.8075 9.9055 9.9055 k = 0.0000 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.5414 -2.5414 -2.4225 -2.4225 -2.1441 -2.1441 -2.1322 -2.1322 -1.7372 -1.7372 -1.5820 -1.5820 3.4372 3.4372 3.4972 3.4972 3.7708 3.7708 3.8513 3.8513 4.0346 4.0346 4.1521 4.1521 5.1303 5.1303 5.4722 5.4722 5.4766 5.4766 5.9495 5.9495 6.1745 6.1745 6.2434 6.2434 6.4799 6.4799 6.6049 6.6049 6.7014 6.7014 6.9009 6.9009 6.9868 6.9868 7.6474 7.6474 7.7152 7.7152 7.9697 7.9697 8.0499 8.0499 8.0782 8.0782 9.4713 9.4713 9.6053 9.6053 9.8075 9.8075 9.9055 9.9055 k = 0.0000 0.7875 0.0182 ( 11996 PWs) bands (ev): -2.5409 -2.5409 -2.4232 -2.4232 -2.1440 -2.1440 -2.1322 -2.1322 -1.7363 -1.7363 -1.5827 -1.5827 3.4375 3.4375 3.4980 3.4980 3.7660 3.7660 3.8553 3.8553 4.0325 4.0325 4.1533 4.1533 5.1326 5.1326 5.4673 5.4673 5.4819 5.4819 5.9468 5.9468 6.1762 6.1762 6.2440 6.2440 6.4753 6.4753 6.5998 6.5998 6.7080 6.7080 6.8984 6.8984 6.9928 6.9928 7.6438 7.6438 7.7165 7.7165 7.9626 7.9626 8.0537 8.0537 8.0811 8.0811 9.4717 9.4717 9.6078 9.6078 9.8066 9.8066 9.9069 9.9069 k = 0.0000 0.7875 0.0363 ( 12002 PWs) bands (ev): -2.5394 -2.5394 -2.4254 -2.4254 -2.1438 -2.1438 -2.1324 -2.1324 -1.7335 -1.7335 -1.5848 -1.5848 3.4382 3.4382 3.5000 3.5000 3.7546 3.7546 3.8641 3.8641 4.0276 4.0276 4.1565 4.1565 5.1392 5.1392 5.4599 5.4599 5.4908 5.4908 5.9393 5.9393 6.1796 6.1796 6.2469 6.2469 6.4621 6.4621 6.5889 6.5889 6.7235 6.7235 6.8928 6.8928 7.0090 7.0090 7.6334 7.6334 7.7197 7.7197 7.9454 7.9454 8.0611 8.0611 8.0893 8.0893 9.4730 9.4730 9.6151 9.6151 9.8037 9.8037 9.9108 9.9108 k = 0.0000 0.7875 0.0545 ( 12010 PWs) bands (ev): -2.5368 -2.5368 -2.4290 -2.4290 -2.1435 -2.1435 -2.1327 -2.1327 -1.7291 -1.7291 -1.5882 -1.5882 3.4396 3.4396 3.5029 3.5029 3.7409 3.7409 3.8718 3.8718 4.0229 4.0229 4.1603 4.1603 5.1497 5.1497 5.4507 5.4507 5.5028 5.5028 5.9284 5.9284 6.1808 6.1808 6.2531 6.2531 6.4423 6.4423 6.5776 6.5776 6.7418 6.7418 6.8864 6.8864 7.0324 7.0324 7.6173 7.6173 7.7240 7.7240 7.9237 7.9237 8.0687 8.0687 8.1010 8.1010 9.4758 9.4758 9.6269 9.6269 9.7983 9.7983 9.9160 9.9160 k = 0.0000 0.7875 0.0726 ( 12010 PWs) bands (ev): -2.5334 -2.5334 -2.4338 -2.4338 -2.1430 -2.1430 -2.1331 -2.1331 -1.7231 -1.7231 -1.5930 -1.5930 3.4418 3.4418 3.5061 3.5061 3.7280 3.7280 3.8739 3.8739 4.0221 4.0221 4.1634 4.1634 5.1634 5.1634 5.4391 5.4391 5.5188 5.5188 5.9155 5.9155 6.1776 6.1776 6.2612 6.2612 6.4206 6.4206 6.5676 6.5676 6.7597 6.7597 6.8808 6.8808 7.0611 7.0611 7.5959 7.5959 7.7286 7.7286 7.9007 7.9007 8.0764 8.0764 8.1132 8.1132 9.4809 9.4809 9.6426 9.6426 9.7901 9.7901 9.9212 9.9212 k = 0.0000 0.7875 0.0908 ( 12020 PWs) bands (ev): -2.5290 -2.5290 -2.4398 -2.4398 -2.1425 -2.1425 -2.1336 -2.1336 -1.7156 -1.7156 -1.5989 -1.5989 3.4450 3.4450 3.5087 3.5087 3.7177 3.7177 3.8680 3.8680 4.0277 4.0277 4.1648 4.1648 5.1797 5.1797 5.4250 5.4250 5.5395 5.5395 5.9010 5.9010 6.1710 6.1710 6.2650 6.2650 6.4044 6.4044 6.5583 6.5583 6.7763 6.7763 6.8762 6.8762 7.0939 7.0939 7.5698 7.5698 7.7334 7.7334 7.8779 7.8779 8.0848 8.0848 8.1238 8.1238 9.4890 9.4890 9.6606 9.6606 9.7796 9.7796 9.9245 9.9245 k = 0.0000 0.7875 0.1089 ( 12028 PWs) bands (ev): -2.5237 -2.5237 -2.4466 -2.4466 -2.1419 -2.1419 -2.1342 -2.1342 -1.7070 -1.7070 -1.6060 -1.6060 3.4491 3.4491 3.5097 3.5097 3.7115 3.7115 3.8548 3.8548 4.0391 4.0391 4.1639 4.1639 5.1978 5.1978 5.4084 5.4084 5.5649 5.5649 5.8844 5.8844 6.1629 6.1629 6.2579 6.2579 6.4006 6.4006 6.5487 6.5487 6.7912 6.7912 6.8723 6.8723 7.1301 7.1301 7.5392 7.5392 7.7384 7.7384 7.8562 7.8562 8.0936 8.0936 8.1321 8.1321 9.5004 9.5004 9.6774 9.6774 9.7696 9.7696 9.9245 9.9245 k = 0.0000 0.7875 0.1271 ( 12018 PWs) bands (ev): -2.5177 -2.5177 -2.4541 -2.4541 -2.1412 -2.1412 -2.1348 -2.1348 -1.6974 -1.6974 -1.6142 -1.6142 3.4544 3.4544 3.5085 3.5085 3.7103 3.7103 3.8367 3.8367 4.0543 4.0543 4.1605 4.1605 5.2172 5.2172 5.3897 5.3897 5.5951 5.5951 5.8649 5.8649 6.1554 6.1554 6.2404 6.2404 6.4094 6.4094 6.5382 6.5382 6.8047 6.8047 6.8686 6.8686 7.1689 7.1689 7.5046 7.5046 7.7439 7.7439 7.8363 7.8363 8.1028 8.1028 8.1377 8.1377 9.5156 9.5156 9.6852 9.6852 9.7673 9.7673 9.9201 9.9201 k = 0.0000 0.7875 0.1452 ( 12018 PWs) bands (ev): -2.5109 -2.5109 -2.4622 -2.4622 -2.1404 -2.1404 -2.1355 -2.1355 -1.6871 -1.6871 -1.6232 -1.6232 3.4606 3.4606 3.5049 3.5049 3.7144 3.7144 3.8161 3.8161 4.0713 4.0713 4.1544 4.1544 5.2377 5.2377 5.3693 5.3693 5.6291 5.6291 5.8412 5.8412 6.1506 6.1506 6.2183 6.2183 6.4253 6.4253 6.5263 6.5263 6.8169 6.8169 6.8646 6.8646 7.2099 7.2099 7.4667 7.4667 7.7502 7.7502 7.8183 7.8183 8.1119 8.1119 8.1406 8.1406 9.5342 9.5342 9.6768 9.6768 9.7799 9.7799 9.9107 9.9107 k = 0.0000 0.7875 0.1634 ( 12002 PWs) bands (ev): -2.5036 -2.5036 -2.4706 -2.4706 -2.1396 -2.1396 -2.1363 -2.1363 -1.6763 -1.6763 -1.6330 -1.6330 3.4678 3.4678 3.4992 3.4992 3.7236 3.7236 3.7947 3.7947 4.0886 4.0886 4.1456 4.1456 5.2589 5.2589 5.3477 5.3477 5.6662 5.6662 5.8127 5.8127 6.1498 6.1498 6.1966 6.1966 6.4440 6.4440 6.5129 6.5129 6.8279 6.8279 6.8598 6.8598 7.2525 7.2525 7.4261 7.4261 7.7574 7.7574 7.8023 7.8023 8.1205 8.1205 8.1408 8.1408 9.5560 9.5560 9.6570 9.6570 9.8025 9.8025 9.8961 9.8961 k = 0.0000 0.7875 0.1815 ( 12008 PWs) bands (ev): -2.4957 -2.4957 -2.4791 -2.4791 -2.1388 -2.1388 -2.1371 -2.1371 -1.6653 -1.6653 -1.6434 -1.6434 3.4756 3.4756 3.4919 3.4919 3.7372 3.7372 3.7737 3.7737 4.1053 4.1053 4.1343 4.1343 5.2807 5.2807 5.3255 5.3255 5.7047 5.7047 5.7797 5.7797 6.1541 6.1541 6.1780 6.1780 6.4629 6.4629 6.4978 6.4978 6.8378 6.8378 6.8538 6.8538 7.2960 7.2960 7.3836 7.3836 7.7661 7.7661 7.7883 7.7883 8.1280 8.1280 8.1385 8.1385 9.5803 9.5803 9.6323 9.6323 9.8283 9.8283 9.8767 9.8767 k = 0.0000 0.7875 0.1997 ( 12000 PWs) bands (ev): -2.4875 -2.4875 -2.4875 -2.4875 -2.1379 -2.1379 -2.1379 -2.1379 -1.6543 -1.6543 -1.6542 -1.6542 3.4838 3.4838 3.4838 3.4838 3.7542 3.7542 3.7542 3.7542 4.1207 4.1207 4.1207 4.1207 5.3030 5.3030 5.3030 5.3030 5.7431 5.7431 5.7431 5.7431 6.1635 6.1635 6.1635 6.1635 6.4810 6.4810 6.4810 6.4810 6.8464 6.8464 6.8464 6.8464 7.3400 7.3400 7.3400 7.3400 7.7763 7.7763 7.7763 7.7763 8.1342 8.1342 8.1342 8.1342 9.6061 9.6061 9.6061 9.6061 9.8537 9.8537 9.8537 9.8537 k = 0.0000 0.7875 0.1997 ( 12000 PWs) bands (ev): -2.4875 -2.4875 -2.4875 -2.4875 -2.1379 -2.1379 -2.1379 -2.1379 -1.6543 -1.6543 -1.6542 -1.6542 3.4838 3.4838 3.4838 3.4838 3.7542 3.7542 3.7542 3.7542 4.1207 4.1207 4.1207 4.1207 5.3030 5.3030 5.3030 5.3030 5.7431 5.7431 5.7431 5.7431 6.1635 6.1635 6.1635 6.1635 6.4810 6.4810 6.4810 6.4810 6.8464 6.8464 6.8464 6.8464 7.3400 7.3400 7.3400 7.3400 7.7763 7.7763 7.7763 7.7763 8.1342 8.1342 8.1342 8.1342 9.6061 9.6061 9.6061 9.6061 9.8537 9.8537 9.8537 9.8537 k = 0.0176 0.7875 0.1997 ( 12004 PWs) bands (ev): -2.4868 -2.4868 -2.4867 -2.4867 -2.1383 -2.1383 -2.1377 -2.1377 -1.6553 -1.6553 -1.6551 -1.6551 3.4734 3.4734 3.4871 3.4871 3.7486 3.7486 3.7618 3.7618 4.1046 4.1046 4.1440 4.1440 5.2826 5.2826 5.3228 5.3228 5.7302 5.7302 5.7562 5.7562 6.1603 6.1603 6.1676 6.1676 6.4766 6.4766 6.4870 6.4870 6.8424 6.8424 6.8494 6.8494 7.3364 7.3364 7.3429 7.3429 7.7757 7.7757 7.7781 7.7781 8.1350 8.1350 8.1356 8.1356 9.5982 9.5982 9.6067 9.6067 9.8400 9.8400 9.8635 9.8635 k = 0.0353 0.7875 0.1997 ( 12006 PWs) bands (ev): -2.4847 -2.4847 -2.4846 -2.4846 -2.1387 -2.1387 -2.1376 -2.1376 -1.6582 -1.6582 -1.6579 -1.6579 3.4575 3.4575 3.4823 3.4823 3.7477 3.7477 3.7680 3.7680 4.0973 4.0973 4.1726 4.1726 5.2617 5.2617 5.3418 5.3418 5.7177 5.7177 5.7689 5.7689 6.1585 6.1585 6.1719 6.1719 6.4736 6.4736 6.4949 6.4949 6.8372 6.8372 6.8514 6.8514 7.3323 7.3323 7.3456 7.3456 7.7763 7.7763 7.7811 7.7811 8.1379 8.1379 8.1391 8.1391 9.5832 9.5832 9.5998 9.5998 9.8233 9.8233 9.8690 9.8690 k = 0.0529 0.7875 0.1997 ( 12014 PWs) bands (ev): -2.4812 -2.4812 -2.4810 -2.4810 -2.1392 -2.1392 -2.1376 -2.1376 -1.6630 -1.6630 -1.6626 -1.6626 3.4379 3.4379 3.4698 3.4698 3.7523 3.7523 3.7703 3.7703 4.1000 4.1000 4.2046 4.2046 5.2406 5.2406 5.3597 5.3597 5.7059 5.7059 5.7809 5.7809 6.1586 6.1586 6.1758 6.1758 6.4716 6.4716 6.5048 6.5048 6.8309 6.8309 6.8527 6.8527 7.3277 7.3277 7.3482 7.3482 7.7778 7.7778 7.7849 7.7849 8.1431 8.1431 8.1449 8.1449 9.5618 9.5618 9.5856 9.5856 9.8045 9.8045 9.8702 9.8702 k = 0.0705 0.7875 0.1997 ( 12012 PWs) bands (ev): -2.4763 -2.4763 -2.4760 -2.4760 -2.1399 -2.1399 -2.1378 -2.1378 -1.6697 -1.6697 -1.6691 -1.6691 3.4161 3.4161 3.4515 3.4515 3.7618 3.7618 3.7677 3.7677 4.1121 4.1121 4.2388 4.2388 5.2197 5.2197 5.3765 5.3765 5.6949 5.6949 5.7917 5.7917 6.1610 6.1610 6.1788 6.1788 6.4705 6.4705 6.5169 6.5169 6.8236 6.8236 6.8535 6.8535 7.3228 7.3228 7.3511 7.3511 7.7796 7.7796 7.7891 7.7891 8.1504 8.1504 8.1528 8.1528 9.5349 9.5349 9.5647 9.5647 9.7845 9.7845 9.8675 9.8675 k = 0.0881 0.7875 0.1997 ( 12010 PWs) bands (ev): -2.4701 -2.4701 -2.4697 -2.4697 -2.1408 -2.1408 -2.1381 -2.1381 -1.6782 -1.6782 -1.6774 -1.6774 3.3933 3.3933 3.4296 3.4296 3.7608 3.7608 3.7749 3.7749 4.1321 4.1321 4.2739 4.2739 5.1991 5.1991 5.3920 5.3920 5.6849 5.6849 5.8009 5.8009 6.1659 6.1659 6.1805 6.1805 6.4699 6.4699 6.5313 6.5313 6.8154 6.8154 6.8539 6.8539 7.3178 7.3178 7.3546 7.3546 7.7814 7.7814 7.7931 7.7931 8.1599 8.1599 8.1627 8.1627 9.5037 9.5037 9.5382 9.5382 9.7641 9.7641 9.8611 9.8611 k = 0.1058 0.7875 0.1997 ( 12006 PWs) bands (ev): -2.4626 -2.4626 -2.4621 -2.4621 -2.1419 -2.1419 -2.1387 -2.1387 -1.6883 -1.6883 -1.6874 -1.6874 3.3703 3.3703 3.4060 3.4060 3.7511 3.7511 3.7902 3.7902 4.1575 4.1575 4.3088 4.3088 5.1792 5.1792 5.4062 5.4062 5.6759 5.6759 5.8082 5.8082 6.1732 6.1732 6.1807 6.1807 6.4697 6.4697 6.5479 6.5479 6.8068 6.8068 6.8543 6.8543 7.3131 7.3131 7.3592 7.3592 7.7827 7.7827 7.7964 7.7964 8.1713 8.1713 8.1746 8.1746 9.4694 9.4694 9.5074 9.5074 9.7438 9.7438 9.8517 9.8517 k = 0.1234 0.7875 0.1997 ( 11996 PWs) bands (ev): -2.4539 -2.4539 -2.4533 -2.4533 -2.1432 -2.1432 -2.1396 -2.1396 -1.7000 -1.7000 -1.6989 -1.6989 3.3480 3.3480 3.3824 3.3824 3.7399 3.7399 3.8068 3.8068 4.1864 4.1864 4.3426 4.3426 5.1602 5.1602 5.4190 5.4190 5.6679 5.6679 5.8132 5.8132 6.1793 6.1793 6.1829 6.1829 6.4696 6.4696 6.5662 6.5662 6.7982 6.7982 6.8547 6.8547 7.3090 7.3090 7.3650 7.3650 7.7830 7.7830 7.7987 7.7987 8.1845 8.1845 8.1881 8.1881 9.4333 9.4333 9.4738 9.4738 9.7238 9.7238 9.8396 9.8396 k = 0.1410 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.4441 -2.4441 -2.4434 -2.4434 -2.1449 -2.1449 -2.1409 -2.1409 -1.7131 -1.7131 -1.7119 -1.7119 3.3271 3.3271 3.3599 3.3599 3.7283 3.7283 3.8239 3.8239 4.2170 4.2170 4.3747 4.3747 5.1423 5.1423 5.4304 5.4304 5.6608 5.6608 5.8159 5.8159 6.1765 6.1765 6.1943 6.1943 6.4694 6.4694 6.5859 6.5859 6.7900 6.7900 6.8554 6.8554 7.3058 7.3058 7.3721 7.3721 7.7821 7.7821 7.7995 7.7995 8.1991 8.1991 8.2030 8.2030 9.3966 9.3966 9.4389 9.4389 9.7044 9.7044 9.8255 9.8255 k = 0.1587 0.7875 0.1997 ( 11982 PWs) bands (ev): -2.4335 -2.4335 -2.4326 -2.4326 -2.1470 -2.1470 -2.1426 -2.1426 -1.7275 -1.7275 -1.7260 -1.7260 3.3081 3.3081 3.3393 3.3393 3.7171 3.7171 3.8410 3.8410 4.2479 4.2479 4.4043 4.4043 5.1258 5.1258 5.4405 5.4405 5.6546 5.6546 5.8161 5.8161 6.1724 6.1724 6.2068 6.2068 6.4692 6.4692 6.6064 6.6064 6.7827 6.7827 6.8565 6.8565 7.3038 7.3038 7.3805 7.3805 7.7801 7.7801 7.7988 7.7988 8.2145 8.2145 8.2186 8.2186 9.3606 9.3606 9.4041 9.4041 9.6859 9.6859 9.8099 9.8099 k = 0.1763 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.4221 -2.4221 -2.4211 -2.4211 -2.1496 -2.1496 -2.1449 -2.1449 -1.7429 -1.7429 -1.7411 -1.7411 3.2914 3.2914 3.3213 3.3213 3.7068 3.7068 3.8576 3.8576 4.2781 4.2781 4.4312 4.4312 5.1105 5.1105 5.4494 5.4494 5.6492 5.6492 5.8141 5.8141 6.1675 6.1675 6.2195 6.2195 6.4690 6.4690 6.6270 6.6270 6.7766 6.7766 6.8579 6.8579 7.3032 7.3032 7.3902 7.3902 7.7770 7.7770 7.7967 7.7967 8.2303 8.2303 8.2346 8.2346 9.3264 9.3264 9.3709 9.3709 9.6686 9.6686 9.7933 9.7933 k = 0.1939 0.7875 0.1997 ( 11982 PWs) bands (ev): -2.4102 -2.4102 -2.4091 -2.4091 -2.1528 -2.1528 -2.1478 -2.1478 -1.7589 -1.7589 -1.7569 -1.7569 3.2775 3.2775 3.3063 3.3063 3.6978 3.6978 3.8735 3.8735 4.3070 4.3070 4.4550 4.4550 5.0966 5.0966 5.4572 5.4572 5.6444 5.6444 5.8098 5.8098 6.1622 6.1622 6.2312 6.2312 6.4693 6.4693 6.6469 6.6469 6.7720 6.7720 6.8596 6.8596 7.3042 7.3042 7.4007 7.4007 7.7732 7.7732 7.7933 7.7933 8.2457 8.2457 8.2501 8.2501 9.2953 9.2953 9.3404 9.3404 9.6529 9.6529 9.7767 9.7767 k = 0.2116 0.7875 0.1997 ( 11978 PWs) bands (ev): -2.3982 -2.3982 -2.3968 -2.3968 -2.1566 -2.1566 -2.1513 -2.1513 -1.7753 -1.7753 -1.7730 -1.7730 3.2667 3.2667 3.2947 3.2947 3.6903 3.6903 3.8883 3.8883 4.3338 4.3338 4.4757 4.4757 5.0839 5.0839 5.4641 5.4641 5.6401 5.6401 5.8035 5.8035 6.1570 6.1570 6.2408 6.2408 6.4706 6.4706 6.6654 6.6654 6.7689 6.7689 6.8614 6.8614 7.3070 7.3070 7.4118 7.4118 7.7692 7.7692 7.7892 7.7892 8.2600 8.2600 8.2646 8.2646 9.2681 9.2681 9.3140 9.3140 9.6393 9.6393 9.7608 9.7608 k = 0.2292 0.7875 0.1997 ( 11970 PWs) bands (ev): -2.3864 -2.3864 -2.3848 -2.3848 -2.1611 -2.1611 -2.1555 -2.1555 -1.7915 -1.7915 -1.7890 -1.7890 3.2592 3.2592 3.2867 3.2867 3.6844 3.6844 3.9019 3.9019 4.3581 4.3581 4.4932 4.4932 5.0722 5.0722 5.4702 5.4702 5.6363 5.6363 5.7954 5.7954 6.1523 6.1523 6.2472 6.2472 6.4732 6.4732 6.6819 6.6819 6.7672 6.7672 6.8630 6.8630 7.3117 7.3117 7.4230 7.4230 7.7656 7.7656 7.7846 7.7846 8.2724 8.2724 8.2773 8.2773 9.2459 9.2459 9.2925 9.2925 9.6282 9.6282 9.7465 9.7465 k = 0.2468 0.7875 0.1997 ( 11982 PWs) bands (ev): -2.3756 -2.3756 -2.3737 -2.3737 -2.1661 -2.1661 -2.1602 -2.1602 -1.8072 -1.8072 -1.8045 -1.8045 3.2552 3.2552 3.2824 3.2824 3.6804 3.6804 3.9140 3.9140 4.3795 4.3795 4.5077 4.5077 5.0615 5.0615 5.4756 5.4756 5.6327 5.6327 5.7859 5.7859 6.1485 6.1485 6.2498 6.2498 6.4775 6.4775 6.6959 6.6959 6.7668 6.7668 6.8644 6.8644 7.3181 7.3181 7.4337 7.4337 7.7629 7.7629 7.7803 7.7803 8.2824 8.2824 8.2877 8.2877 9.2294 9.2294 9.2769 9.2769 9.6200 9.6200 9.7347 9.7347 k = 0.2644 0.7875 0.1997 ( 11974 PWs) bands (ev): -2.3663 -2.3663 -2.3641 -2.3641 -2.1714 -2.1714 -2.1653 -2.1653 -1.8218 -1.8218 -1.8187 -1.8187 3.2547 3.2547 3.2820 3.2820 3.6784 3.6784 3.9246 3.9246 4.3978 4.3978 4.5193 4.5193 5.0516 5.0516 5.4804 5.4804 5.6295 5.6295 5.7753 5.7753 6.1458 6.1458 6.2487 6.2487 6.4832 6.4832 6.7069 6.7069 6.7675 6.7675 6.8653 6.8653 7.3261 7.3261 7.4434 7.4434 7.7617 7.7617 7.7766 7.7766 8.2894 8.2894 8.2951 8.2951 9.2194 9.2194 9.2679 9.2679 9.6152 9.6152 9.7259 9.7259 k = 0.2821 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.3597 -2.3597 -2.3571 -2.3571 -2.1766 -2.1766 -2.1702 -2.1702 -1.8346 -1.8346 -1.8313 -1.8313 3.2579 3.2579 3.2856 3.2856 3.6783 3.6783 3.9336 3.9336 4.4126 4.4126 4.5281 4.5281 5.0426 5.0426 5.4847 5.4847 5.6265 5.6265 5.7641 5.7641 6.1445 6.1445 6.2441 6.2441 6.4896 6.4896 6.7145 6.7145 6.7692 6.7692 6.8659 6.8659 7.3353 7.3353 7.4517 7.4517 7.7625 7.7625 7.7740 7.7740 8.2931 8.2931 8.2994 8.2994 9.2164 9.2164 9.2660 9.2660 9.6140 9.6140 9.7208 9.7208 k = 0.2821 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.3597 -2.3597 -2.3571 -2.3571 -2.1766 -2.1766 -2.1702 -2.1702 -1.8346 -1.8346 -1.8313 -1.8313 3.2579 3.2579 3.2856 3.2856 3.6783 3.6783 3.9336 3.9336 4.4126 4.4126 4.5281 4.5281 5.0426 5.0426 5.4847 5.4847 5.6265 5.6265 5.7641 5.7641 6.1445 6.1445 6.2441 6.2441 6.4896 6.4896 6.7145 6.7145 6.7692 6.7692 6.8659 6.8659 7.3353 7.3353 7.4517 7.4517 7.7625 7.7625 7.7740 7.7740 8.2931 8.2931 8.2994 8.2994 9.2164 9.2164 9.2660 9.2660 9.6140 9.6140 9.7208 9.7208 k = 0.2759 0.7703 0.1997 ( 11976 PWs) bands (ev): -2.3771 -2.3771 -2.3754 -2.3754 -2.1628 -2.1628 -2.1571 -2.1571 -1.7983 -1.7983 -1.7956 -1.7956 3.2461 3.2461 3.2721 3.2721 3.6764 3.6764 3.9092 3.9092 4.3725 4.3725 4.5058 4.5058 5.0704 5.0704 5.4723 5.4723 5.6326 5.6326 5.8001 5.8001 6.1482 6.1482 6.2633 6.2633 6.4699 6.4699 6.6966 6.6966 6.7639 6.7639 6.8669 6.8669 7.3053 7.3053 7.4267 7.4267 7.7610 7.7610 7.7824 7.7824 8.2868 8.2868 8.2914 8.2914 9.2150 9.2150 9.2611 9.2611 9.6092 9.6092 9.7263 9.7263 k = 0.2698 0.7532 0.1997 ( 11964 PWs) bands (ev): -2.3987 -2.3987 -2.3978 -2.3978 -2.1519 -2.1519 -2.1468 -2.1468 -1.7612 -1.7612 -1.7591 -1.7591 3.2413 3.2413 3.2654 3.2654 3.6765 3.6765 3.8865 3.8865 4.3327 4.3327 4.4849 4.4849 5.1005 5.1005 5.4599 5.4599 5.6332 5.6332 5.8369 5.8369 6.1555 6.1555 6.2835 6.2835 6.4510 6.4510 6.6797 6.6797 6.7605 6.7605 6.8708 6.8708 7.2753 7.2753 7.3988 7.3988 7.7667 7.7667 7.7952 7.7952 8.2806 8.2806 8.2837 8.2837 9.2147 9.2147 9.2565 9.2565 9.5992 9.5992 9.7224 9.7224 k = 0.2637 0.7361 0.1997 ( 11968 PWs) bands (ev): -2.4243 -2.4243 -2.4240 -2.4240 -2.1443 -2.1443 -2.1397 -2.1397 -1.7239 -1.7239 -1.7223 -1.7223 3.2437 3.2437 3.2652 3.2652 3.6789 3.6789 3.8664 3.8664 4.2940 4.2940 4.4661 4.4661 5.1322 5.1322 5.4482 5.4482 5.6279 5.6279 5.8731 5.8731 6.1658 6.1658 6.3034 6.3034 6.4334 6.4334 6.6650 6.6650 6.7584 6.7584 6.8752 6.8752 7.2471 7.2471 7.3696 7.3696 7.7781 7.7781 7.8113 7.8113 8.2746 8.2746 8.2763 8.2763 9.2156 9.2156 9.2519 9.2519 9.5850 9.5850 9.7092 9.7092 k = 0.2576 0.7190 0.1997 ( 11972 PWs) bands (ev): -2.4537 -2.4537 -2.4536 -2.4536 -2.1399 -2.1399 -2.1358 -2.1358 -1.6866 -1.6866 -1.6854 -1.6854 3.2531 3.2531 3.2712 3.2712 3.6837 3.6837 3.8496 3.8496 4.2573 4.2573 4.4502 4.4502 5.1650 5.1650 5.4377 5.4377 5.6169 5.6169 5.9076 5.9076 6.1783 6.1783 6.3217 6.3217 6.4184 6.4184 6.6534 6.6534 6.7566 6.7566 6.8775 6.8775 7.2229 7.2229 7.3410 7.3410 7.7937 7.7937 7.8299 7.8299 8.2689 8.2689 8.2693 8.2693 9.2178 9.2178 9.2473 9.2473 9.5683 9.5683 9.6885 9.6885 k = 0.2514 0.7019 0.1997 ( 11964 PWs) bands (ev): -2.4866 -2.4866 -2.4861 -2.4861 -2.1386 -2.1386 -2.1349 -2.1349 -1.6498 -1.6498 -1.6490 -1.6490 3.2695 3.2695 3.2831 3.2831 3.6910 3.6910 3.8369 3.8369 4.2232 4.2232 4.4377 4.4377 5.1983 5.1983 5.4285 5.4285 5.6008 5.6008 5.9396 5.9396 6.1917 6.1917 6.3357 6.3357 6.4085 6.4085 6.6455 6.6455 6.7544 6.7544 6.8755 6.8755 7.2050 7.2050 7.3148 7.3148 7.8121 7.8121 7.8500 7.8500 8.2628 8.2628 8.2636 8.2636 9.2214 9.2214 9.2423 9.2423 9.5507 9.5507 9.6629 9.6629 k = 0.2453 0.6847 0.1997 ( 11968 PWs) bands (ev): -2.5226 -2.5226 -2.5218 -2.5218 -2.1402 -2.1402 -2.1369 -2.1369 -1.6138 -1.6138 -1.6133 -1.6133 3.2926 3.2926 3.3003 3.3003 3.7010 3.7010 3.8289 3.8289 4.1925 4.1925 4.4292 4.4292 5.2318 5.2318 5.4209 5.4209 5.5802 5.5802 5.9684 5.9684 6.2046 6.2046 6.3409 6.3409 6.4079 6.4079 6.6421 6.6421 6.7508 6.7508 6.8671 6.8671 7.1950 7.1950 7.2924 7.2924 7.8322 7.8322 7.8707 7.8707 8.2570 8.2570 8.2589 8.2589 9.2263 9.2263 9.2365 9.2365 9.5340 9.5340 9.6348 9.6348 k = 0.2392 0.6676 0.1997 ( 11986 PWs) bands (ev): -2.5614 -2.5614 -2.5604 -2.5604 -2.1447 -2.1447 -2.1418 -2.1418 -1.5790 -1.5790 -1.5788 -1.5788 3.3218 3.3218 3.3221 3.3221 3.7137 3.7137 3.8264 3.8264 4.1655 4.1655 4.4250 4.4250 5.2651 5.2651 5.4149 5.4149 5.5561 5.5561 5.9934 5.9934 6.2157 6.2157 6.3368 6.3368 6.4170 6.4170 6.6434 6.6434 6.7451 6.7451 6.8519 6.8519 7.1934 7.1934 7.2753 7.2753 7.8528 7.8528 7.8914 7.8914 8.2518 8.2518 8.2549 8.2549 9.2294 9.2294 9.2321 9.2321 9.5199 9.5199 9.6062 9.6062 k = 0.2330 0.6505 0.1997 ( 11986 PWs) bands (ev): -2.6027 -2.6027 -2.6016 -2.6016 -2.1517 -2.1517 -2.1493 -2.1493 -1.5457 -1.5457 -1.5456 -1.5456 3.3476 3.3476 3.3569 3.3569 3.7291 3.7291 3.8301 3.8301 4.1429 4.1429 4.4255 4.4255 5.2977 5.2977 5.4105 5.4105 5.5294 5.5294 6.0142 6.0142 6.2238 6.2238 6.3278 6.3278 6.4308 6.4308 6.6498 6.6498 6.7375 6.7375 6.8307 6.8307 7.1994 7.1994 7.2640 7.2640 7.8733 7.8733 7.9112 7.9112 8.2474 8.2474 8.2516 8.2516 9.2206 9.2206 9.2385 9.2385 9.5097 9.5097 9.5791 9.5791 k = 0.2269 0.6334 0.1997 ( 11986 PWs) bands (ev): -2.6464 -2.6464 -2.6451 -2.6451 -2.1613 -2.1613 -2.1592 -2.1592 -1.5141 -1.5141 -1.5140 -1.5140 3.3759 3.3759 3.3971 3.3971 3.7473 3.7473 3.8405 3.8405 4.1250 4.1250 4.4309 4.4309 5.3287 5.3287 5.4079 5.4079 5.5018 5.5018 6.0307 6.0307 6.2281 6.2281 6.3174 6.3174 6.4447 6.4447 6.6611 6.6611 6.7289 6.7289 6.8055 6.8055 7.2113 7.2113 7.2588 7.2588 7.8929 7.8929 7.9296 7.9296 8.2438 8.2438 8.2492 8.2492 9.2098 9.2098 9.2445 9.2445 9.5046 9.5046 9.5553 9.5553 k = 0.2208 0.6163 0.1997 ( 11994 PWs) bands (ev): -2.6921 -2.6921 -2.6908 -2.6908 -2.1731 -2.1731 -2.1715 -2.1715 -1.4845 -1.4845 -1.4844 -1.4844 3.4059 3.4059 3.4416 3.4416 3.7683 3.7683 3.8584 3.8584 4.1124 4.1124 4.4414 4.4414 5.3553 5.3553 5.4072 5.4072 5.4764 5.4764 6.0431 6.0431 6.2282 6.2282 6.3072 6.3072 6.4553 6.4553 6.6761 6.6761 6.7216 6.7216 6.7789 6.7789 7.2272 7.2272 7.2592 7.2592 7.9110 7.9110 7.9461 7.9461 8.2410 8.2410 8.2478 8.2478 9.1971 9.1971 9.2489 9.2489 9.5050 9.5050 9.5367 9.5367 k = 0.2146 0.5992 0.1997 ( 11994 PWs) bands (ev): -2.7395 -2.7395 -2.7381 -2.7381 -2.1870 -2.1870 -2.1858 -2.1858 -1.4571 -1.4571 -1.4568 -1.4568 3.4366 3.4366 3.4894 3.4894 3.7922 3.7922 3.8842 3.8842 4.1054 4.1054 4.4571 4.4571 5.3696 5.3696 5.4083 5.4083 5.4617 5.4617 6.0515 6.0515 6.2242 6.2242 6.2976 6.2976 6.4597 6.4597 6.6916 6.6916 6.7188 6.7188 6.7554 6.7554 7.2456 7.2456 7.2643 7.2643 7.9270 7.9270 7.9600 7.9600 8.2392 8.2392 8.2473 8.2473 9.1827 9.1827 9.2502 9.2502 9.5108 9.5108 9.5249 9.5249 k = 0.2085 0.5820 0.1997 ( 11998 PWs) bands (ev): -2.7885 -2.7885 -2.7871 -2.7871 -2.2030 -2.2030 -2.2021 -2.2021 -1.4318 -1.4318 -1.4316 -1.4316 3.4674 3.4674 3.5390 3.5390 3.8196 3.8196 3.9180 3.9180 4.1042 4.1042 4.4779 4.4779 5.3605 5.3605 5.4113 5.4113 5.4691 5.4691 6.0565 6.0565 6.2163 6.2163 6.2890 6.2890 6.4557 6.4557 6.6951 6.6951 6.7234 6.7234 6.7480 6.7480 7.2653 7.2653 7.2730 7.2730 7.9407 7.9407 7.9712 7.9712 8.2383 8.2383 8.2480 8.2480 9.1674 9.1674 9.2474 9.2474 9.5212 9.5212 9.5217 9.5217 k = 0.2024 0.5649 0.1997 ( 11990 PWs) bands (ev): -2.8386 -2.8386 -2.8372 -2.8372 -2.2206 -2.2206 -2.2202 -2.2202 -1.4089 -1.4089 -1.4087 -1.4087 3.4976 3.4976 3.5885 3.5885 3.8511 3.8511 3.9595 3.9595 4.1094 4.1094 4.5038 4.5038 5.3354 5.3354 5.4162 5.4162 5.4919 5.4919 6.0585 6.0585 6.2048 6.2048 6.2814 6.2814 6.4434 6.4434 6.6791 6.6791 6.7362 6.7362 6.7648 6.7648 7.2843 7.2843 7.2854 7.2854 7.9515 7.9515 7.9791 7.9791 8.2385 8.2385 8.2499 8.2499 9.1516 9.1516 9.2402 9.2402 9.5259 9.5259 9.5370 9.5370 k = 0.1962 0.5478 0.1997 ( 11980 PWs) bands (ev): -2.8897 -2.8897 -2.8883 -2.8883 -2.2399 -2.2399 -2.2398 -2.2398 -1.3885 -1.3885 -1.3883 -1.3883 3.5270 3.5270 3.6356 3.6356 3.8878 3.8878 4.0080 4.0080 4.1210 4.1210 4.5347 4.5347 5.3053 5.3053 5.4230 5.4230 5.5196 5.5196 6.0579 6.0579 6.1902 6.1902 6.2748 6.2748 6.4247 6.4247 6.6585 6.6585 6.7563 6.7563 6.7907 6.7907 7.2971 7.2971 7.3055 7.3055 7.9593 7.9593 7.9837 7.9837 8.2400 8.2400 8.2531 8.2531 9.1360 9.1360 9.2292 9.2292 9.5381 9.5381 9.5560 9.5560 k = 0.1901 0.5307 0.1997 ( 11984 PWs) bands (ev): -2.9416 -2.9416 -2.9402 -2.9402 -2.2608 -2.2608 -2.2606 -2.2606 -1.3705 -1.3705 -1.3704 -1.3704 3.5557 3.5557 3.6781 3.6781 3.9305 3.9305 4.0624 4.0624 4.1395 4.1395 4.5702 4.5702 5.2745 5.2745 5.4317 5.4317 5.5484 5.5484 6.0553 6.0553 6.1731 6.1731 6.2693 6.2693 6.4027 6.4027 6.6397 6.6397 6.7818 6.7818 6.8196 6.8196 7.3108 7.3108 7.3250 7.3250 7.9636 7.9636 7.9847 7.9847 8.2430 8.2430 8.2578 8.2578 9.1212 9.1212 9.2156 9.2156 9.5561 9.5561 9.5779 9.5779 k = 0.1840 0.5136 0.1997 ( 11992 PWs) bands (ev): -2.9938 -2.9938 -2.9924 -2.9924 -2.2830 -2.2830 -2.2825 -2.2825 -1.3551 -1.3551 -1.3550 -1.3550 3.5837 3.5837 3.7143 3.7143 3.9792 3.9792 4.1212 4.1212 4.1652 4.1652 4.6100 4.6100 5.2455 5.2455 5.4421 5.4421 5.5767 5.5767 6.0508 6.0508 6.1541 6.1541 6.2648 6.2648 6.3802 6.3802 6.6246 6.6246 6.8108 6.8108 6.8496 6.8496 7.3247 7.3247 7.3439 7.3439 7.9644 7.9644 7.9822 7.9822 8.2476 8.2476 8.2639 8.2639 9.1075 9.1075 9.2008 9.2008 9.5785 9.5785 9.6020 9.6020 k = 0.1778 0.4964 0.1997 ( 12008 PWs) bands (ev): -3.0463 -3.0463 -3.0450 -3.0450 -2.3063 -2.3063 -2.3056 -2.3056 -1.3421 -1.3421 -1.3420 -1.3420 3.6113 3.6113 3.7440 3.7440 4.0318 4.0318 4.1824 4.1824 4.1990 4.1990 4.6536 4.6536 5.2201 5.2201 5.4541 5.4541 5.6039 5.6039 6.0448 6.0448 6.1340 6.1340 6.2614 6.2614 6.3598 6.3598 6.6140 6.6140 6.8421 6.8421 6.8799 6.8799 7.3385 7.3385 7.3619 7.3619 7.9614 7.9614 7.9761 7.9761 8.2541 8.2541 8.2715 8.2715 9.0953 9.0953 9.1859 9.1859 9.6038 9.6038 9.6277 9.6277 k = 0.1717 0.4793 0.1997 ( 12004 PWs) bands (ev): -3.0987 -3.0987 -3.0974 -3.0974 -2.3304 -2.3304 -2.3295 -2.3295 -1.3315 -1.3315 -1.3314 -1.3314 3.6385 3.6385 3.7679 3.7679 4.0846 4.0846 4.2427 4.2427 4.2439 4.2439 4.7002 4.7002 5.2002 5.2002 5.4674 5.4674 5.6293 5.6293 6.0374 6.0374 6.1137 6.1137 6.2592 6.2592 6.3435 6.3435 6.6082 6.6082 6.8747 6.8747 6.9098 6.9098 7.3519 7.3519 7.3789 7.3789 7.9548 7.9548 7.9666 7.9666 8.2625 8.2625 8.2804 8.2804 9.0849 9.0849 9.1717 9.1717 9.6308 9.6308 9.6544 9.6544 k = 0.1656 0.4622 0.1997 ( 11992 PWs) bands (ev): -3.1509 -3.1509 -3.1497 -3.1497 -2.3552 -2.3552 -2.3541 -2.3541 -1.3232 -1.3232 -1.3230 -1.3230 3.6652 3.6652 3.7871 3.7871 4.1336 4.1336 4.2975 4.2975 4.3030 4.3030 4.7492 4.7492 5.1882 5.1882 5.4815 5.4815 5.6528 5.6528 6.0291 6.0291 6.0941 6.0941 6.2589 6.2589 6.3324 6.3324 6.6075 6.6075 6.9079 6.9079 6.9390 6.9390 7.3646 7.3646 7.3951 7.3951 7.9447 7.9447 7.9542 7.9542 8.2727 8.2727 8.2904 8.2904 9.0765 9.0765 9.1588 9.1588 9.6586 9.6586 9.6816 9.6816 k = 0.1594 0.4451 0.1997 ( 11980 PWs) bands (ev): -3.2026 -3.2026 -3.2014 -3.2014 -2.3805 -2.3805 -2.3792 -2.3792 -1.3172 -1.3172 -1.3169 -1.3169 3.6914 3.6914 3.8026 3.8026 4.1766 4.1766 4.3567 4.3567 4.3632 4.3632 4.7999 4.7999 5.1864 5.1864 5.4960 5.4960 5.6740 5.6740 6.0207 6.0207 6.0765 6.0765 6.2611 6.2611 6.3270 6.3270 6.6119 6.6119 6.9413 6.9413 6.9671 6.9671 7.3766 7.3766 7.4103 7.4103 7.9314 7.9314 7.9390 7.9390 8.2847 8.2847 8.3014 8.3014 9.0701 9.0701 9.1476 9.1476 9.6868 9.6868 9.7088 9.7088 k = 0.1533 0.4280 0.1997 ( 11976 PWs) bands (ev): -3.2537 -3.2537 -3.2526 -3.2526 -2.4061 -2.4061 -2.4048 -2.4048 -1.3131 -1.3131 -1.3128 -1.3128 3.7168 3.7168 3.8149 3.8149 4.2139 4.2139 4.4015 4.4015 4.4373 4.4373 4.8522 4.8522 5.1969 5.1969 5.5099 5.5099 5.6930 5.6930 6.0135 6.0135 6.0618 6.0618 6.2670 6.2670 6.3270 6.3270 6.6215 6.6215 6.9746 6.9746 6.9938 6.9938 7.3878 7.3878 7.4247 7.4247 7.9152 7.9152 7.9215 7.9215 8.2981 8.2981 8.3129 8.3129 9.0661 9.0661 9.1386 9.1386 9.7149 9.7149 9.7358 9.7358 k = 0.1472 0.4108 0.1997 ( 11988 PWs) bands (ev): -3.3040 -3.3040 -3.3030 -3.3030 -2.4320 -2.4320 -2.4305 -2.4305 -1.3110 -1.3110 -1.3106 -1.3106 3.7413 3.7413 3.8245 3.8245 4.2462 4.2462 4.4347 4.4347 4.5171 4.5171 4.9066 4.9066 5.2199 5.2199 5.5224 5.5224 5.7104 5.7104 6.0089 6.0089 6.0513 6.0513 6.2773 6.2773 6.3321 6.3321 6.6361 6.6361 7.0075 7.0075 7.0189 7.0189 7.3982 7.3982 7.4382 7.4382 7.8967 7.8967 7.9023 7.9023 8.3128 8.3128 8.3247 8.3247 9.0644 9.0644 9.1319 9.1319 9.7426 9.7426 9.7623 9.7623 k = 0.1410 0.3937 0.1997 ( 11980 PWs) bands (ev): -3.3533 -3.3533 -3.3523 -3.3523 -2.4579 -2.4579 -2.4564 -2.4564 -1.3106 -1.3106 -1.3101 -1.3101 3.7645 3.7645 3.8318 3.8318 4.2740 4.2740 4.4549 4.4549 4.6003 4.6003 4.9638 4.9638 5.2540 5.2540 5.5324 5.5324 5.7272 5.7272 6.0088 6.0088 6.0460 6.0460 6.2920 6.2920 6.3424 6.3424 6.6556 6.6556 7.0399 7.0399 7.0424 7.0424 7.4078 7.4078 7.4509 7.4509 7.8763 7.8763 7.8817 7.8817 8.3283 8.3283 8.3363 8.3363 9.0651 9.0651 9.1278 9.1278 9.7700 9.7700 9.7882 9.7882 k = 0.1349 0.3766 0.1997 ( 11984 PWs) bands (ev): -3.4015 -3.4015 -3.4006 -3.4006 -2.4838 -2.4838 -2.4822 -2.4822 -1.3118 -1.3118 -1.3113 -1.3113 3.7861 3.7861 3.8369 3.8369 4.2976 4.2976 4.4625 4.4625 4.6853 4.6853 5.0239 5.0239 5.2955 5.2955 5.5390 5.5390 5.7450 5.7450 6.0145 6.0145 6.0470 6.0470 6.3103 6.3103 6.3585 6.3585 6.6796 6.6796 7.0641 7.0641 7.0717 7.0717 7.4165 7.4165 7.4628 7.4628 7.8547 7.8547 7.8605 7.8605 8.3444 8.3444 8.3474 8.3474 9.0682 9.0682 9.1264 9.1264 9.7969 9.7969 9.8133 9.8133 k = 0.1288 0.3595 0.1997 ( 12000 PWs) bands (ev): -3.4484 -3.4484 -3.4475 -3.4475 -2.5094 -2.5094 -2.5077 -2.5077 -1.3144 -1.3144 -1.3138 -1.3138 3.8057 3.8057 3.8401 3.8401 4.3168 4.3168 4.4597 4.4597 4.7709 4.7709 5.0855 5.0855 5.3404 5.3404 5.5417 5.5417 5.7659 5.7659 6.0271 6.0271 6.0552 6.0552 6.3308 6.3308 6.3815 6.3815 6.7078 6.7078 7.0840 7.0840 7.1030 7.1030 7.4244 7.4244 7.4738 7.4738 7.8322 7.8322 7.8391 7.8391 8.3575 8.3575 8.3608 8.3608 9.0736 9.0736 9.1279 9.1279 9.8235 9.8235 9.8376 9.8376 k = 0.1226 0.3424 0.1997 ( 11996 PWs) bands (ev): -3.4938 -3.4938 -3.4930 -3.4930 -2.5346 -2.5346 -2.5329 -2.5329 -1.3182 -1.3182 -1.3176 -1.3176 3.8231 3.8231 3.8414 3.8414 4.3318 4.3318 4.4491 4.4491 4.8560 4.8560 5.1456 5.1456 5.3857 5.3857 5.5407 5.5407 5.7917 5.7917 6.0466 6.0466 6.0718 6.0718 6.3526 6.3526 6.4120 6.4120 6.7398 6.7398 7.1020 7.1020 7.1338 7.1338 7.4314 7.4314 7.4839 7.4839 7.8095 7.8095 7.8183 7.8183 8.3663 8.3663 8.3771 8.3771 9.0811 9.0811 9.1322 9.1322 9.8496 9.8496 9.8609 9.8609 k = 0.1165 0.3253 0.1997 ( 11996 PWs) bands (ev): -3.5377 -3.5377 -3.5370 -3.5370 -2.5593 -2.5593 -2.5577 -2.5577 -1.3231 -1.3231 -1.3224 -1.3224 3.8381 3.8381 3.8409 3.8409 4.3424 4.3424 4.4334 4.4334 4.9395 4.9395 5.2003 5.2003 5.4302 5.4302 5.5365 5.5365 5.8235 5.8235 6.0725 6.0725 6.0980 6.0980 6.3760 6.3760 6.4494 6.4494 6.7753 6.7753 7.1183 7.1183 7.1643 7.1643 7.4376 7.4376 7.4929 7.4929 7.7872 7.7872 7.7987 7.7987 8.3734 8.3734 8.3929 8.3929 9.0907 9.0907 9.1394 9.1394 9.8747 9.8747 9.8827 9.8827 k = 0.1104 0.3081 0.1997 ( 11984 PWs) bands (ev): -3.5800 -3.5800 -3.5793 -3.5793 -2.5835 -2.5835 -2.5818 -2.5818 -1.3287 -1.3287 -1.3281 -1.3281 3.8389 3.8389 3.8502 3.8502 4.3490 4.3490 4.4145 4.4145 5.0201 5.0201 5.2452 5.2452 5.4746 5.4746 5.5304 5.5304 5.8615 5.8615 6.1038 6.1038 6.1344 6.1344 6.4017 6.4017 6.4923 6.4923 6.8137 6.8137 7.1331 7.1331 7.1946 7.1946 7.4431 7.4431 7.5007 7.5007 7.7658 7.7658 7.7811 7.7811 8.3784 8.3784 8.4080 8.4080 9.1021 9.1021 9.1493 9.1493 9.8975 9.8975 9.9019 9.9019 k = 0.1042 0.2910 0.1997 ( 11992 PWs) bands (ev): -3.6205 -3.6205 -3.6199 -3.6199 -2.6069 -2.6069 -2.6053 -2.6053 -1.3351 -1.3351 -1.3345 -1.3345 3.8355 3.8355 3.8594 3.8594 4.3518 4.3518 4.3941 4.3941 5.0964 5.0964 5.2776 5.2776 5.5199 5.5199 5.5240 5.5240 5.9052 5.9052 6.1392 6.1392 6.1808 6.1808 6.4303 6.4303 6.5391 6.5391 6.8547 6.8547 7.1465 7.1465 7.2250 7.2250 7.4476 7.4476 7.5069 7.5069 7.7461 7.7461 7.7664 7.7664 8.3811 8.3811 8.4221 8.4221 9.1149 9.1149 9.1618 9.1618 9.9150 9.9150 9.9168 9.9168 k = 0.0981 0.2739 0.1997 ( 11988 PWs) bands (ev): -3.6591 -3.6591 -3.6586 -3.6586 -2.6295 -2.6295 -2.6279 -2.6279 -1.3420 -1.3420 -1.3414 -1.3414 3.8309 3.8309 3.8656 3.8656 4.3512 4.3512 4.3732 4.3732 5.1662 5.1662 5.2975 5.2975 5.5193 5.5193 5.5652 5.5652 5.9551 5.9551 6.1775 6.1775 6.2354 6.2354 6.4623 6.4623 6.5884 6.5884 6.8980 6.8980 7.1588 7.1588 7.2557 7.2557 7.4513 7.4513 7.5115 7.5115 7.7287 7.7287 7.7553 7.7553 8.3813 8.3813 8.4350 8.4350 9.1288 9.1288 9.1767 9.1767 9.9220 9.9220 9.9261 9.9261 k = 0.0920 0.2568 0.1997 ( 11996 PWs) bands (ev): -3.6958 -3.6958 -3.6953 -3.6953 -2.6511 -2.6511 -2.6497 -2.6497 -1.3493 -1.3493 -1.3487 -1.3487 3.8253 3.8253 3.8689 3.8689 4.3476 4.3476 4.3527 4.3527 5.2266 5.2266 5.3076 5.3076 5.5194 5.5194 5.6078 5.6078 6.0119 6.0119 6.2177 6.2177 6.2954 6.2954 6.4979 6.4979 6.6386 6.6386 6.9429 6.9429 7.1704 7.1704 7.2869 7.2869 7.4541 7.4541 7.5141 7.5141 7.7144 7.7144 7.7486 7.7486 8.3787 8.3787 8.4463 8.4463 9.1436 9.1436 9.1936 9.1936 9.9159 9.9159 9.9294 9.9294 k = 0.0859 0.2397 0.1997 ( 11990 PWs) bands (ev): -3.7305 -3.7305 -3.7300 -3.7300 -2.6718 -2.6718 -2.6704 -2.6704 -1.3568 -1.3568 -1.3562 -1.3562 3.8189 3.8189 3.8692 3.8692 4.3331 4.3331 4.3417 4.3417 5.2735 5.2735 5.3107 5.3107 5.5280 5.5280 5.6453 5.6453 6.0760 6.0760 6.2591 6.2591 6.3576 6.3576 6.5369 6.5369 6.6885 6.6885 6.9888 6.9888 7.1819 7.1819 7.3185 7.3185 7.4560 7.4560 7.5150 7.5150 7.7041 7.7041 7.7472 7.7472 8.3733 8.3733 8.4558 8.4558 9.1587 9.1587 9.2122 9.2122 9.9000 9.9000 9.9282 9.9282 k = 0.0797 0.2225 0.1997 ( 11982 PWs) bands (ev): -3.7631 -3.7631 -3.7627 -3.7627 -2.6914 -2.6914 -2.6901 -2.6901 -1.3644 -1.3644 -1.3638 -1.3638 3.8120 3.8120 3.8668 3.8668 4.3149 4.3149 4.3337 4.3337 5.3039 5.3039 5.3094 5.3094 5.5480 5.5480 5.6770 5.6770 6.1468 6.1468 6.3012 6.3012 6.4187 6.4187 6.5787 6.5787 6.7368 6.7368 7.0347 7.0347 7.1941 7.1941 7.3502 7.3502 7.4569 7.4569 7.5145 7.5145 7.6987 7.6987 7.7515 7.7515 8.3651 8.3651 8.4635 8.4635 9.1738 9.1738 9.2319 9.2319 9.8787 9.8787 9.9232 9.9232 k = 0.0736 0.2054 0.1997 ( 11984 PWs) bands (ev): -3.7935 -3.7935 -3.7931 -3.7931 -2.7098 -2.7098 -2.7086 -2.7086 -1.3719 -1.3719 -1.3714 -1.3714 3.8048 3.8048 3.8621 3.8621 4.2983 4.2983 4.3243 4.3243 5.3052 5.3052 5.3185 5.3185 5.5784 5.5784 5.7034 5.7034 6.2227 6.2227 6.3437 6.3437 6.4764 6.4764 6.6224 6.6224 6.7829 6.7829 7.0784 7.0784 7.2083 7.2083 7.3808 7.3808 7.4573 7.4573 7.5131 7.5131 7.6994 7.6994 7.7617 7.7617 8.3540 8.3540 8.4692 8.4692 9.1888 9.1888 9.2523 9.2523 9.8542 9.8542 9.9147 9.9147 k = 0.0675 0.1883 0.1997 ( 11988 PWs) bands (ev): -3.8217 -3.8217 -3.8213 -3.8213 -2.7270 -2.7270 -2.7258 -2.7258 -1.3793 -1.3793 -1.3788 -1.3788 3.7975 3.7975 3.8554 3.8554 4.2833 4.2833 4.3140 4.3140 5.2995 5.2995 5.3218 5.3218 5.6144 5.6144 5.7253 5.7253 6.3017 6.3017 6.3863 6.3863 6.5286 6.5286 6.6665 6.6665 6.8267 6.8267 7.1168 7.1168 7.2265 7.2265 7.4080 7.4080 7.4581 7.4581 7.5117 7.5117 7.7072 7.7072 7.7783 7.7783 8.3404 8.3404 8.4728 8.4728 9.2032 9.2032 9.2729 9.2729 9.8272 9.8272 9.9021 9.9021 k = 0.0613 0.1712 0.1997 ( 11992 PWs) bands (ev): -3.8476 -3.8476 -3.8473 -3.8473 -2.7429 -2.7429 -2.7418 -2.7418 -1.3863 -1.3863 -1.3859 -1.3859 3.7903 3.7903 3.8471 3.8471 4.2701 4.2701 4.3030 4.3030 5.2929 5.2929 5.3186 5.3186 5.6514 5.6514 5.7437 5.7437 6.3817 6.3817 6.4289 6.4289 6.5745 6.5745 6.7091 6.7091 6.8691 6.8691 7.1470 7.1470 7.2500 7.2500 7.4272 7.4272 7.4627 7.4627 7.5112 7.5112 7.7226 7.7226 7.8012 7.8012 8.3246 8.3246 8.4744 8.4744 9.2170 9.2170 9.2930 9.2930 9.7982 9.7982 9.8849 9.8849 k = 0.0552 0.1541 0.1997 ( 11976 PWs) bands (ev): -3.8712 -3.8712 -3.8709 -3.8709 -2.7574 -2.7574 -2.7564 -2.7564 -1.3930 -1.3930 -1.3926 -1.3926 3.7835 3.7835 3.8377 3.8377 4.2585 4.2585 4.2918 4.2918 5.2861 5.2861 5.3120 5.3120 5.6862 5.6862 5.7596 5.7596 6.4607 6.4607 6.4710 6.4710 6.6136 6.6136 6.7480 6.7480 6.9115 6.9115 7.1685 7.1685 7.2774 7.2774 7.4346 7.4346 7.4737 7.4737 7.5122 7.5122 7.7453 7.7453 7.8303 7.8303 8.3072 8.3072 8.4741 8.4741 9.2301 9.2301 9.3123 9.3123 9.7673 9.7673 9.8630 9.8630 k = 0.0491 0.1369 0.1997 ( 11976 PWs) bands (ev): -3.8924 -3.8924 -3.8922 -3.8922 -2.7706 -2.7706 -2.7697 -2.7697 -1.3992 -1.3992 -1.3989 -1.3989 3.7773 3.7773 3.8277 3.8277 4.2485 4.2485 4.2807 4.2807 5.2795 5.2795 5.3040 5.3040 5.7175 5.7175 5.7733 5.7733 6.5119 6.5119 6.5366 6.5366 6.6461 6.6461 6.7813 6.7813 6.9554 6.9554 7.1841 7.1841 7.3045 7.3045 7.4353 7.4353 7.4860 7.4860 7.5150 7.5150 7.7738 7.7738 7.8646 7.8646 8.2895 8.2895 8.4720 8.4720 9.2427 9.2427 9.3301 9.3301 9.7348 9.7348 9.8366 9.8366 k = 0.0429 0.1198 0.1997 ( 11976 PWs) bands (ev): -3.9112 -3.9112 -3.9110 -3.9110 -2.7823 -2.7823 -2.7815 -2.7815 -1.4049 -1.4049 -1.4046 -1.4046 3.7717 3.7717 3.8175 3.8175 4.2400 4.2400 4.2701 4.2701 5.2733 5.2733 5.2954 5.2954 5.7445 5.7445 5.7854 5.7854 6.5511 6.5511 6.6075 6.6075 6.6727 6.6727 6.8081 6.8081 7.0012 7.0012 7.1967 7.1967 7.3278 7.3278 7.4344 7.4344 7.4951 7.4951 7.5196 7.5196 7.8057 7.8057 7.9019 7.9019 8.2732 8.2732 8.4683 8.4683 9.2548 9.2548 9.3461 9.3461 9.7014 9.7014 9.8066 9.8066 k = 0.0368 0.1027 0.1997 ( 11964 PWs) bands (ev): -3.9275 -3.9275 -3.9274 -3.9274 -2.7924 -2.7924 -2.7918 -2.7918 -1.4100 -1.4100 -1.4097 -1.4097 3.7670 3.7670 3.8074 3.8074 4.2331 4.2331 4.2600 4.2600 5.2678 5.2678 5.2871 5.2871 5.7671 5.7671 5.7959 5.7959 6.5878 6.5878 6.6695 6.6695 6.6960 6.6960 6.8287 6.8287 7.0480 7.0480 7.2079 7.2079 7.3463 7.3463 7.4338 7.4338 7.5003 7.5003 7.5249 7.5249 7.8380 7.8380 7.9386 7.9386 8.2612 8.2612 8.4630 8.4630 9.2668 9.2668 9.3600 9.3600 9.6679 9.6679 9.7739 9.7739 k = 0.0307 0.0856 0.1997 ( 11972 PWs) bands (ev): -3.9414 -3.9414 -3.9413 -3.9413 -2.8011 -2.8011 -2.8006 -2.8006 -1.4143 -1.4143 -1.4141 -1.4141 3.7634 3.7634 3.7977 3.7977 4.2276 4.2276 4.2508 4.2508 5.2631 5.2631 5.2793 5.2793 5.7855 5.7855 5.8049 5.8049 6.6211 6.6211 6.7034 6.7034 6.7339 6.7339 6.8442 6.8442 7.0939 7.0939 7.2187 7.2187 7.3609 7.3609 7.4343 7.4343 7.5019 7.5019 7.5297 7.5297 7.8685 7.8685 7.9691 7.9691 8.2574 8.2574 8.4561 8.4561 9.2790 9.2790 9.3711 9.3711 9.6362 9.6362 9.7398 9.7398 k = 0.0245 0.0685 0.1997 ( 11964 PWs) bands (ev): -3.9528 -3.9528 -3.9527 -3.9527 -2.8083 -2.8083 -2.8078 -2.8078 -1.4180 -1.4180 -1.4178 -1.4178 3.7609 3.7609 3.7888 3.7888 4.2236 4.2236 4.2426 4.2426 5.2593 5.2593 5.2724 5.2724 5.7999 5.7999 5.8125 5.8125 6.6505 6.6505 6.7163 6.7163 6.7787 6.7787 6.8556 6.8556 7.1366 7.1366 7.2290 7.2290 7.3733 7.3733 7.4362 7.4362 7.5007 7.5007 7.5324 7.5324 7.8956 7.8956 7.9883 7.9883 8.2657 8.2657 8.4471 8.4471 9.2919 9.2919 9.3787 9.3787 9.6087 9.6087 9.7054 9.7054 k = 0.0184 0.0514 0.1997 ( 11982 PWs) bands (ev): -3.9617 -3.9617 -3.9616 -3.9616 -2.8138 -2.8138 -2.8135 -2.8135 -1.4209 -1.4209 -1.4207 -1.4207 3.7597 3.7597 3.7808 3.7808 4.2211 4.2211 4.2356 4.2356 5.2567 5.2567 5.2665 5.2665 5.8108 5.8108 5.8184 5.8184 6.6753 6.6753 6.7236 6.7236 6.8146 6.8146 6.8636 6.8636 7.1739 7.1739 7.2379 7.2379 7.3851 7.3851 7.4388 7.4388 7.4983 7.4983 7.5319 7.5319 7.9185 7.9185 7.9945 7.9945 8.2863 8.2863 8.4354 8.4354 9.3057 9.3057 9.3811 9.3811 9.5886 9.5886 9.6720 9.6720 k = 0.0123 0.0342 0.1997 ( 11978 PWs) bands (ev): -3.9681 -3.9681 -3.9680 -3.9680 -2.8178 -2.8178 -2.8176 -2.8176 -1.4229 -1.4229 -1.4228 -1.4228 3.7598 3.7598 3.7740 3.7740 4.2200 4.2200 4.2297 4.2297 5.2552 5.2552 5.2618 5.2618 5.8184 5.8184 5.8226 5.8226 6.6952 6.6952 6.7266 6.7266 6.8405 6.8405 6.8685 6.8685 7.2039 7.2039 7.2436 7.2436 7.3978 7.3978 7.4393 7.4393 7.4977 7.4977 7.5277 7.5277 7.9378 7.9378 7.9906 7.9906 8.3148 8.3148 8.4199 8.4199 9.3206 9.3206 9.3772 9.3772 9.5788 9.5788 9.6411 9.6411 k = 0.0061 0.0171 0.1997 ( 11964 PWs) bands (ev): -3.9719 -3.9719 -3.9718 -3.9718 -2.8201 -2.8201 -2.8200 -2.8200 -1.4242 -1.4242 -1.4241 -1.4241 3.7613 3.7613 3.7684 3.7684 4.2203 4.2203 4.2252 4.2252 5.2550 5.2550 5.2582 5.2582 5.8231 5.8231 5.8250 5.8250 6.7101 6.7101 6.7255 6.7255 6.8573 6.8573 6.8698 6.8698 7.2255 7.2255 7.2445 7.2445 7.4113 7.4113 7.4346 7.4346 7.5018 7.5018 7.5200 7.5200 7.9541 7.9541 7.9809 7.9809 8.3457 8.3457 8.3998 8.3998 9.3366 9.3366 9.3671 9.3671 9.5809 9.5809 9.6143 9.6143 k = 0.0000 0.0000 0.1997 ( 11940 PWs) bands (ev): -3.9731 -3.9731 -3.9731 -3.9731 -2.8209 -2.8209 -2.8209 -2.8209 -1.4245 -1.4245 -1.4245 -1.4245 3.7641 3.7641 3.7642 3.7642 4.2221 4.2221 4.2221 4.2221 5.2560 5.2560 5.2560 5.2560 5.8252 5.8252 5.8252 5.8252 6.7201 6.7201 6.7201 6.7201 6.8665 6.8665 6.8665 6.8665 7.2388 7.2388 7.2388 7.2388 7.4244 7.4244 7.4244 7.4244 7.5104 7.5104 7.5104 7.5104 7.9683 7.9683 7.9683 7.9683 8.3748 8.3748 8.3748 8.3748 9.3527 9.3527 9.3527 9.3527 9.5935 9.5935 9.5935 9.5935 k = 0.0000 0.0000 0.1997 ( 11940 PWs) bands (ev): -3.9731 -3.9731 -3.9731 -3.9731 -2.8209 -2.8209 -2.8209 -2.8209 -1.4245 -1.4245 -1.4245 -1.4245 3.7641 3.7641 3.7642 3.7642 4.2221 4.2221 4.2221 4.2221 5.2560 5.2560 5.2560 5.2560 5.8252 5.8252 5.8252 5.8252 6.7201 6.7201 6.7201 6.7201 6.8665 6.8665 6.8665 6.8665 7.2388 7.2388 7.2388 7.2388 7.4244 7.4244 7.4244 7.4244 7.5104 7.5104 7.5104 7.5104 7.9683 7.9683 7.9683 7.9683 8.3748 8.3748 8.3748 8.3748 9.3527 9.3527 9.3527 9.3527 9.5935 9.5935 9.5935 9.5935 k = 0.0000 0.0000 0.1815 ( 11967 PWs) bands (ev): -3.9930 -3.9930 -3.9522 -3.9522 -2.8534 -2.8534 -2.7893 -2.7893 -1.4260 -1.4260 -1.4231 -1.4231 3.7568 3.7568 3.7715 3.7715 4.1676 4.1676 4.2804 4.2804 5.2241 5.2241 5.2870 5.2870 5.7854 5.7854 5.8626 5.8626 6.6741 6.6741 6.7604 6.7604 6.8520 6.8520 6.8912 6.8912 7.2316 7.2316 7.2457 7.2457 7.4076 7.4076 7.4360 7.4360 7.4851 7.4851 7.5392 7.5392 7.9480 7.9480 7.9857 7.9857 8.3229 8.3229 8.4287 8.4287 9.3113 9.3113 9.3936 9.3936 9.5698 9.5698 9.6232 9.6232 k = 0.0000 0.0000 0.1634 ( 11963 PWs) bands (ev): -4.0116 -4.0116 -3.9306 -3.9306 -2.8862 -2.8862 -2.7592 -2.7592 -1.4275 -1.4275 -1.4218 -1.4218 3.7496 3.7496 3.7786 3.7786 4.1172 4.1172 4.3421 4.3421 5.1924 5.1924 5.3162 5.3162 5.7438 5.7438 5.8966 5.8966 6.6319 6.6319 6.7742 6.7742 6.8659 6.8659 6.9192 6.9192 7.2234 7.2234 7.2528 7.2528 7.3890 7.3890 7.4282 7.4282 7.4796 7.4796 7.5664 7.5664 7.9264 7.9264 7.9972 7.9972 8.2757 8.2757 8.4822 8.4822 9.2706 9.2706 9.4326 9.4326 9.5523 9.5523 9.6590 9.6590 k = 0.0000 0.0000 0.1452 ( 11969 PWs) bands (ev): -4.0287 -4.0287 -3.9086 -3.9086 -2.9189 -2.9189 -2.7308 -2.7308 -1.4289 -1.4289 -1.4206 -1.4206 3.7426 3.7426 3.7855 3.7855 4.0712 4.0712 4.4067 4.4067 5.1616 5.1616 5.3425 5.3425 5.7008 5.7008 5.9258 5.9258 6.5983 6.5983 6.7632 6.7632 6.9041 6.9041 6.9475 6.9475 7.2141 7.2141 7.2608 7.2608 7.3681 7.3681 7.4062 7.4062 7.4916 7.4916 7.5909 7.5909 7.9047 7.9047 7.9989 7.9989 8.2379 8.2379 8.5340 8.5340 9.2315 9.2315 9.4671 9.4671 9.5424 9.5424 9.7004 9.7004 k = 0.0000 0.0000 0.1271 ( 11975 PWs) bands (ev): -4.0442 -4.0442 -3.8867 -3.8867 -2.9507 -2.9507 -2.7048 -2.7048 -1.4303 -1.4303 -1.4195 -1.4195 3.7359 3.7359 3.7921 3.7921 4.0299 4.0299 4.4736 4.4736 5.1323 5.1323 5.3650 5.3650 5.6564 5.6564 5.9491 5.9491 6.5766 6.5766 6.7465 6.7465 6.9454 6.9454 6.9728 6.9728 7.2040 7.2040 7.2703 7.2703 7.3454 7.3454 7.3866 7.3866 7.5068 7.5068 7.6120 7.6120 7.8836 7.8836 7.9866 7.9866 8.2138 8.2138 8.5828 8.5828 9.1950 9.1950 9.4911 9.4911 9.5447 9.5447 9.7465 9.7465 k = 0.0000 0.0000 0.1089 ( 11987 PWs) bands (ev): -4.0578 -4.0578 -3.8655 -3.8655 -2.9809 -2.9809 -2.6814 -2.6814 -1.4316 -1.4316 -1.4185 -1.4185 3.7299 3.7299 3.7984 3.7984 3.9933 3.9933 4.5421 4.5421 5.1050 5.1050 5.3830 5.3830 5.6104 5.6104 5.9663 5.9663 6.5688 6.5688 6.7303 6.7303 6.9787 6.9787 6.9936 6.9936 7.1951 7.1951 7.2819 7.2819 7.3245 7.3245 7.3717 7.3717 7.5217 7.5217 7.6297 7.6297 7.8634 7.8634 7.9606 7.9606 8.2038 8.2038 8.6276 8.6276 9.1617 9.1617 9.4996 9.4996 9.5632 9.5632 9.7963 9.7963 k = 0.0000 0.0000 0.0908 ( 11977 PWs) bands (ev): -4.0695 -4.0695 -3.8455 -3.8455 -3.0087 -3.0087 -2.6610 -2.6610 -1.4327 -1.4327 -1.4177 -1.4177 3.7244 3.7244 3.8042 3.8042 3.9616 3.9616 4.6109 4.6109 5.0799 5.0799 5.3965 5.3965 5.5633 5.5633 5.9779 5.9779 6.5748 6.5748 6.7167 6.7167 6.9824 6.9824 7.0230 7.0230 7.1911 7.1911 7.2913 7.2913 7.3136 7.3136 7.3605 7.3605 7.5353 7.5353 7.6441 7.6441 7.8436 7.8436 7.9268 7.9268 8.2036 8.2036 8.6675 8.6675 9.1322 9.1322 9.5011 9.5011 9.5880 9.5880 9.8481 9.8481 k = 0.0000 0.0000 0.0726 ( 11993 PWs) bands (ev): -4.0792 -4.0792 -3.8276 -3.8276 -3.0333 -3.0333 -2.6439 -2.6439 -1.4337 -1.4337 -1.4171 -1.4171 3.7198 3.7198 3.8097 3.8097 3.9348 3.9348 4.6787 4.6787 5.0566 5.0566 5.4057 5.4057 5.5160 5.5160 5.9855 5.9855 6.5920 6.5920 6.7072 6.7072 6.9626 6.9626 7.0523 7.0523 7.1932 7.1932 7.2855 7.2855 7.3257 7.3257 7.3520 7.3520 7.5472 7.5472 7.6557 7.6557 7.8222 7.8222 7.8934 7.8934 8.2079 8.2079 8.7014 8.7014 9.1073 9.1073 9.5019 9.5019 9.6114 9.6114 9.9001 9.9001 k = 0.0000 0.0000 0.0545 ( 11977 PWs) bands (ev): -4.0868 -4.0868 -3.8124 -3.8124 -3.0537 -3.0537 -2.6303 -2.6303 -1.4345 -1.4345 -1.4165 -1.4165 3.7161 3.7161 3.8148 3.8148 3.9131 3.9131 4.7434 4.7434 5.0347 5.0347 5.4113 5.4113 5.4712 5.4712 5.9903 5.9903 6.6151 6.6151 6.7052 6.7052 6.9279 6.9279 7.0767 7.0767 7.1991 7.1991 7.2768 7.2768 7.3434 7.3434 7.3482 7.3482 7.5574 7.5574 7.6657 7.6657 7.7958 7.7958 7.8682 7.8682 8.2135 8.2135 8.7288 8.7288 9.0873 9.0873 9.5031 9.5031 9.6305 9.6305 9.9487 9.9488 k = 0.0000 0.0000 0.0363 ( 11971 PWs) bands (ev): -4.0923 -4.0923 -3.8009 -3.8009 -3.0690 -3.0690 -2.6204 -2.6204 -1.4351 -1.4351 -1.4162 -1.4162 3.7134 3.7134 3.8192 3.8192 3.8967 3.8967 4.8014 4.8014 5.0134 5.0134 5.4136 5.4136 5.4335 5.4335 5.9935 5.9935 6.6344 6.6344 6.7174 6.7174 6.8845 6.8845 7.0949 7.0949 7.2059 7.2059 7.2698 7.2698 7.3409 7.3409 7.3652 7.3652 7.5660 7.5660 7.6757 7.6757 7.7649 7.7649 7.8536 7.8536 8.2184 8.2184 8.7489 8.7489 9.0727 9.0727 9.5047 9.5047 9.6443 9.6443 9.9414 9.9415 k = 0.0000 0.0000 0.0182 ( 11989 PWs) bands (ev): -4.0956 -4.0956 -3.7937 -3.7937 -3.0786 -3.0786 -2.6145 -2.6145 -1.4354 -1.4354 -1.4160 -1.4160 3.7117 3.7117 3.8226 3.8226 3.8861 3.8861 4.8466 4.8466 4.9938 4.9938 5.4033 5.4033 5.4186 5.4186 5.9953 5.9953 6.6433 6.6433 6.7481 6.7481 6.8373 6.8373 7.1061 7.1061 7.2114 7.2114 7.2650 7.2650 7.3384 7.3384 7.3783 7.3783 7.5724 7.5724 7.6882 7.6882 7.7351 7.7351 7.8466 7.8466 8.2216 8.2216 8.7612 8.7612 9.0638 9.0638 9.5060 9.5060 9.6524 9.6524 9.9311 9.9311 k = 0.0000 0.0000 0.0000 ( 11971 PWs) bands (ev): -4.0967 -4.0967 -3.7912 -3.7912 -3.0819 -3.0819 -2.6125 -2.6125 -1.4356 -1.4356 -1.4159 -1.4159 3.7111 3.7111 3.8239 3.8239 3.8824 3.8824 4.8656 4.8656 4.9841 4.9841 5.3944 5.3944 5.4182 5.4182 5.9960 5.9960 6.6452 6.6452 6.7902 6.7902 6.7906 6.7906 7.1098 7.1098 7.2136 7.2136 7.2633 7.2633 7.3376 7.3376 7.3830 7.3830 7.5748 7.5748 7.7004 7.7004 7.7161 7.7161 7.8446 7.8446 8.2227 8.2227 8.7653 8.7653 9.0609 9.0609 9.5065 9.5065 9.6550 9.6550 9.9278 9.9278 k = 0.0000 0.0000 0.0000 ( 11971 PWs) bands (ev): -4.0967 -4.0967 -3.7912 -3.7912 -3.0819 -3.0819 -2.6125 -2.6125 -1.4356 -1.4356 -1.4159 -1.4159 3.7111 3.7111 3.8239 3.8239 3.8824 3.8824 4.8656 4.8656 4.9841 4.9841 5.3944 5.3944 5.4182 5.4182 5.9960 5.9960 6.6452 6.6452 6.7902 6.7902 6.7906 6.7906 7.1098 7.1098 7.2136 7.2136 7.2633 7.2633 7.3376 7.3376 7.3830 7.3830 7.5748 7.5748 7.7004 7.7004 7.7161 7.7161 7.8446 7.8446 8.2227 8.2227 8.7653 8.7653 9.0609 9.0609 9.5065 9.5065 9.6550 9.6550 9.9278 9.9278 k =-0.0167 0.0060 0.0000 ( 11995 PWs) bands (ev): -4.0954 -4.0954 -3.7899 -3.7899 -3.0811 -3.0811 -2.6121 -2.6121 -1.4379 -1.4379 -1.4177 -1.4177 3.7060 3.7060 3.7727 3.7727 3.9384 3.9384 4.8383 4.8383 5.0148 5.0148 5.3802 5.3802 5.4278 5.4278 5.9931 5.9931 6.6364 6.6364 6.7624 6.7624 6.8294 6.8294 7.1081 7.1081 7.2114 7.2114 7.2703 7.2703 7.3330 7.3330 7.3860 7.3860 7.5764 7.5764 7.7012 7.7012 7.7191 7.7191 7.8471 7.8471 8.2234 8.2234 8.7658 8.7658 9.0607 9.0607 9.5038 9.5038 9.6549 9.6549 9.9226 9.9226 k =-0.0333 0.0119 0.0000 ( 11999 PWs) bands (ev): -4.0915 -4.0915 -3.7861 -3.7861 -3.0789 -3.0789 -2.6110 -2.6110 -1.4449 -1.4449 -1.4229 -1.4229 3.6670 3.6670 3.7347 3.7347 4.0135 4.0135 4.7904 4.7904 5.0736 5.0736 5.3545 5.3545 5.4402 5.4402 5.9849 5.9849 6.6126 6.6126 6.7494 6.7494 6.8726 6.8726 7.1043 7.1043 7.2083 7.2083 7.2857 7.2857 7.3234 7.3234 7.3922 7.3922 7.5810 7.5810 7.7043 7.7043 7.7273 7.7273 7.8545 7.8545 8.2252 8.2252 8.7673 8.7673 9.0602 9.0602 9.4961 9.4961 9.6540 9.6540 9.9075 9.9075 k =-0.0500 0.0179 0.0000 ( 11997 PWs) bands (ev): -4.0850 -4.0850 -3.7798 -3.7798 -3.0752 -3.0752 -2.6092 -2.6092 -1.4566 -1.4566 -1.4318 -1.4318 3.5963 3.5963 3.7298 3.7298 4.0824 4.0824 4.7461 4.7461 5.1384 5.1384 5.3240 5.3240 5.4492 5.4492 5.9719 5.9719 6.5811 6.5811 6.7474 6.7474 6.9136 6.9136 7.1025 7.1025 7.2074 7.2074 7.2944 7.2944 7.3219 7.3219 7.3990 7.3990 7.5885 7.5885 7.7110 7.7110 7.7393 7.7393 7.8668 7.8668 8.2284 8.2284 8.7697 8.7697 9.0595 9.0595 9.4843 9.4843 9.6511 9.6511 9.8831 9.8831 k =-0.0667 0.0239 0.0000 ( 11999 PWs) bands (ev): -4.0760 -4.0760 -3.7710 -3.7710 -3.0701 -3.0701 -2.6067 -2.6067 -1.4728 -1.4728 -1.4441 -1.4441 3.5230 3.5230 3.7311 3.7311 4.1369 4.1369 4.7153 4.7153 5.2022 5.2022 5.2913 5.2913 5.4547 5.4547 5.9555 5.9555 6.5491 6.5491 6.7513 6.7513 6.9466 6.9466 7.1082 7.1082 7.2083 7.2083 7.2861 7.2861 7.3375 7.3375 7.4063 7.4063 7.5987 7.5987 7.7216 7.7216 7.7545 7.7545 7.8837 7.8837 8.2329 8.2329 8.7730 8.7730 9.0585 9.0585 9.4696 9.4696 9.6445 9.6445 9.8507 9.8507 k =-0.0833 0.0299 0.0000 ( 12013 PWs) bands (ev): -4.0644 -4.0644 -3.7597 -3.7597 -3.0635 -3.0635 -2.6035 -2.6035 -1.4934 -1.4934 -1.4599 -1.4599 3.4526 3.4526 3.7344 3.7344 4.1686 4.1686 4.7052 4.7052 5.2403 5.2403 5.2791 5.2791 5.4575 5.4575 5.9378 5.9378 6.5205 6.5205 6.7575 6.7575 6.9673 6.9673 7.1254 7.1254 7.2090 7.2090 7.2768 7.2768 7.3540 7.3540 7.4161 7.4161 7.6114 7.6114 7.7361 7.7361 7.7728 7.7728 7.9050 7.9050 8.2387 8.2387 8.7771 8.7771 9.0574 9.0574 9.4528 9.4528 9.6329 9.6329 9.8119 9.8119 k =-0.1000 0.0358 0.0000 ( 12005 PWs) bands (ev): -4.0502 -4.0502 -3.7460 -3.7460 -3.0556 -3.0556 -2.5997 -2.5997 -1.5184 -1.5184 -1.4791 -1.4791 3.3863 3.3863 3.7388 3.7388 4.1728 4.1728 4.7176 4.7176 5.2114 5.2114 5.3252 5.3252 5.4616 5.4616 5.9212 5.9212 6.4969 6.4969 6.7639 6.7639 6.9776 6.9776 7.1518 7.1518 7.2069 7.2069 7.2733 7.2733 7.3654 7.3654 7.4305 7.4305 7.6261 7.6261 7.7535 7.7535 7.7944 7.7944 7.9301 7.9301 8.2460 8.2460 8.7818 8.7818 9.0562 9.0562 9.4349 9.4349 9.6153 9.6153 9.7688 9.7688 k =-0.1167 0.0418 0.0000 ( 11999 PWs) bands (ev): -4.0336 -4.0336 -3.7297 -3.7297 -3.0463 -3.0463 -2.5953 -2.5953 -1.5474 -1.5474 -1.5018 -1.5018 3.3249 3.3249 3.7441 3.7441 4.1526 4.1526 4.7448 4.7448 5.1785 5.1785 5.3600 5.3600 5.4759 5.4759 5.9089 5.9089 6.4792 6.4792 6.7689 6.7689 6.9837 6.9837 7.1796 7.1796 7.2020 7.2020 7.2769 7.2769 7.3721 7.3721 7.4503 7.4503 7.6427 7.6427 7.7727 7.7727 7.8200 7.8200 7.9582 7.9582 8.2549 8.2549 8.7870 8.7870 9.0549 9.0549 9.4166 9.4166 9.5913 9.5913 9.7235 9.7235 k =-0.1333 0.0478 0.0000 ( 11997 PWs) bands (ev): -4.0144 -4.0144 -3.7111 -3.7111 -3.0359 -3.0359 -2.5905 -2.5905 -1.5805 -1.5805 -1.5278 -1.5278 3.2688 3.2688 3.7496 3.7496 4.1161 4.1161 4.7715 4.7715 5.1513 5.1513 5.3719 5.3719 5.5071 5.5071 5.9040 5.9040 6.4674 6.4674 6.7717 6.7717 6.9901 6.9901 7.1896 7.1896 7.2103 7.2103 7.2860 7.2860 7.3760 7.3760 7.4748 7.4748 7.6609 7.6609 7.7925 7.7925 7.8496 7.8496 7.9887 7.9887 8.2656 8.2656 8.7923 8.7923 9.0538 9.0538 9.3986 9.3986 9.5614 9.5614 9.6782 9.6782 k =-0.1500 0.0537 0.0000 ( 11987 PWs) bands (ev): -3.9928 -3.9928 -3.6900 -3.6900 -3.0243 -3.0243 -2.5851 -2.5851 -1.6172 -1.6172 -1.5571 -1.5571 3.2182 3.2182 3.7544 3.7544 4.0714 4.0714 4.7829 4.7829 5.1313 5.1313 5.3741 5.3741 5.5470 5.5470 5.9086 5.9086 6.4617 6.4617 6.7721 6.7721 6.9991 6.9991 7.1833 7.1833 7.2296 7.2296 7.2978 7.2978 7.3793 7.3793 7.5037 7.5037 7.6805 7.6805 7.8121 7.8121 7.8827 7.8827 8.0208 8.0208 8.2783 8.2783 8.7974 8.7974 9.0528 9.0528 9.3814 9.3814 9.5266 9.5266 9.6344 9.6344 k =-0.1667 0.0597 0.0000 ( 11977 PWs) bands (ev): -3.9688 -3.9688 -3.6666 -3.6666 -3.0116 -3.0116 -2.5795 -2.5795 -1.6574 -1.6574 -1.5897 -1.5897 3.1735 3.1735 3.7566 3.7566 4.0252 4.0252 4.7716 4.7716 5.1112 5.1112 5.3827 5.3827 5.5884 5.5884 5.9230 5.9230 6.4619 6.4619 6.7708 6.7708 7.0112 7.0112 7.1776 7.1776 7.2442 7.2442 7.3102 7.3102 7.3833 7.3833 7.5366 7.5366 7.7012 7.7012 7.8315 7.8315 7.9182 7.9182 8.0537 8.0537 8.2932 8.2932 8.8021 8.8021 9.0521 9.0521 9.3654 9.3654 9.4885 9.4885 9.5935 9.5935 k =-0.1833 0.0657 0.0000 ( 11965 PWs) bands (ev): -3.9425 -3.9425 -3.6409 -3.6409 -2.9980 -2.9980 -2.5735 -2.5735 -1.7009 -1.7009 -1.6253 -1.6253 3.1347 3.1347 3.7525 3.7525 3.9840 3.9840 4.7409 4.7409 5.0805 5.0805 5.4036 5.4036 5.6315 5.6315 5.9453 5.9453 6.4684 6.4684 6.7689 6.7689 7.0257 7.0257 7.1739 7.1739 7.2544 7.2544 7.3211 7.3211 7.3899 7.3899 7.5724 7.5724 7.7226 7.7226 7.8507 7.8507 7.9549 7.9549 8.0867 8.0867 8.3103 8.3103 8.8058 8.8058 9.0518 9.0518 9.3510 9.3510 9.4493 9.4493 9.5559 9.5559 k =-0.2000 0.0716 0.0000 ( 11983 PWs) bands (ev): -3.9139 -3.9139 -3.6129 -3.6129 -2.9835 -2.9835 -2.5673 -2.5673 -1.7473 -1.7473 -1.6639 -1.6639 3.1019 3.1019 3.7367 3.7367 3.9551 3.9551 4.6973 4.6973 5.0357 5.0357 5.4299 5.4299 5.6793 5.6793 5.9734 5.9734 6.4814 6.4814 6.7677 6.7677 7.0415 7.0415 7.1725 7.1725 7.2623 7.2623 7.3280 7.3280 7.4013 7.4013 7.6096 7.6096 7.7445 7.7445 7.8699 7.8699 7.9918 7.9918 8.1195 8.1195 8.3296 8.3296 8.8081 8.8081 9.0520 9.0520 9.3376 9.3376 9.4120 9.4120 9.5218 9.5218 k =-0.2167 0.0776 0.0000 ( 11987 PWs) bands (ev): -3.8831 -3.8831 -3.5827 -3.5827 -2.9684 -2.9684 -2.5611 -2.5611 -1.7964 -1.7964 -1.7053 -1.7053 3.0752 3.0752 3.7062 3.7062 3.9427 3.9427 4.6465 4.6465 4.9799 4.9799 5.4524 5.4524 5.7319 5.7319 6.0062 6.0062 6.5012 6.5012 6.7683 6.7683 7.0571 7.0571 7.1734 7.1734 7.2701 7.2701 7.3300 7.3300 7.4184 7.4184 7.6469 7.6469 7.7668 7.7668 7.8894 7.8894 8.0280 8.0280 8.1516 8.1516 8.3506 8.3506 8.8085 8.8085 9.0527 9.0527 9.3232 9.3232 9.3811 9.3811 9.4913 9.4913 k =-0.2333 0.0836 0.0000 ( 11997 PWs) bands (ev): -3.8501 -3.8501 -3.5505 -3.5505 -2.9526 -2.9526 -2.5549 -2.5549 -1.8478 -1.8478 -1.7493 -1.7493 3.0546 3.0546 3.6634 3.6634 3.9449 3.9449 4.5919 4.5919 4.9171 4.9171 5.4662 5.4662 5.7835 5.7835 6.0460 6.0460 6.5275 6.5275 6.7714 6.7714 7.0711 7.0711 7.1764 7.1764 7.2792 7.2792 7.3288 7.3288 7.4398 7.4398 7.6834 7.6834 7.7893 7.7893 7.9093 7.9093 8.0632 8.0632 8.1831 8.1831 8.3728 8.3728 8.8064 8.8064 9.0540 9.0540 9.3042 9.3042 9.3621 9.3621 9.4643 9.4643 k =-0.2500 0.0896 0.0000 ( 12007 PWs) bands (ev): -3.8152 -3.8152 -3.5161 -3.5161 -2.9365 -2.9365 -2.5488 -2.5488 -1.9012 -1.9012 -1.7957 -1.7957 3.0399 3.0399 3.6136 3.6136 3.9568 3.9568 4.5357 4.5357 4.8503 4.8503 5.4711 5.4711 5.8244 5.8244 6.0975 6.0975 6.5595 6.5595 6.7774 6.7774 7.0824 7.0824 7.1813 7.1813 7.2899 7.2899 7.3271 7.3271 7.4634 7.4634 7.7186 7.7186 7.8125 7.8125 7.9296 7.9296 8.0969 8.0969 8.2139 8.2139 8.3954 8.3954 8.8015 8.8015 9.0560 9.0560 9.2814 9.2814 9.3557 9.3557 9.4411 9.4411 k =-0.2667 0.0955 0.0000 ( 12013 PWs) bands (ev): -3.7783 -3.7783 -3.4797 -3.4797 -2.9201 -2.9201 -2.5429 -2.5429 -1.9562 -1.9562 -1.8443 -1.8443 3.0311 3.0311 3.5609 3.5609 3.9744 3.9744 4.4793 4.4793 4.7822 4.7822 5.4679 5.4679 5.8490 5.8490 6.1630 6.1630 6.5958 6.5958 6.7863 6.7863 7.0904 7.0904 7.1879 7.1879 7.2988 7.2988 7.3307 7.3307 7.4873 7.4873 7.7527 7.7527 7.8364 7.8364 7.9501 7.9501 8.1292 8.1292 8.2438 8.2438 8.4177 8.4177 8.7937 8.7937 9.0586 9.0586 9.2601 9.2601 9.3577 9.3577 9.4218 9.4218 k =-0.2833 0.1015 0.0000 ( 12013 PWs) bands (ev): -3.7396 -3.7396 -3.4415 -3.4415 -2.9036 -2.9036 -2.5374 -2.5374 -2.0125 -2.0125 -1.8949 -1.8949 3.0279 3.0279 3.5078 3.5078 3.9947 3.9947 4.4237 4.4237 4.7150 4.7150 5.4573 5.4573 5.8591 5.8591 6.2387 6.2387 6.6345 6.6345 6.7977 6.7977 7.0953 7.0953 7.1954 7.1954 7.3015 7.3015 7.3451 7.3451 7.5095 7.5095 7.7869 7.7869 7.8609 7.8609 7.9700 7.9700 8.1601 8.1601 8.2726 8.2726 8.4395 8.4395 8.7831 8.7831 9.0619 9.0619 9.2432 9.2432 9.3654 9.3654 9.4066 9.4066 k =-0.3000 0.1075 0.0000 ( 12009 PWs) bands (ev): -3.6993 -3.6993 -3.4016 -3.4016 -2.8872 -2.8872 -2.5324 -2.5324 -2.0696 -2.0696 -1.9471 -1.9471 3.0303 3.0303 3.4558 3.4558 4.0154 4.0154 4.3694 4.3694 4.6513 4.6513 5.4395 5.4395 5.8596 5.8596 6.3189 6.3189 6.6740 6.6740 6.8112 6.8112 7.0978 7.0978 7.2028 7.2028 7.3024 7.3024 7.3669 7.3669 7.5286 7.5286 7.8225 7.8225 7.8854 7.8854 7.9888 7.9888 8.1897 8.1897 8.3003 8.3003 8.4607 8.4607 8.7704 8.7704 9.0658 9.0658 9.2316 9.2316 9.3770 9.3770 9.3960 9.3960 k =-0.3167 0.1134 0.0000 ( 11995 PWs) bands (ev): -3.6576 -3.6576 -3.3600 -3.3600 -2.8712 -2.8712 -2.5281 -2.5281 -2.1270 -2.1270 -2.0006 -2.0006 3.0378 3.0378 3.4057 3.4057 4.0337 4.0337 4.3168 4.3168 4.5945 4.5945 5.4147 5.4147 5.8549 5.8549 6.3988 6.3988 6.7127 6.7127 6.8261 6.8261 7.0988 7.0988 7.2081 7.2081 7.3069 7.3069 7.3921 7.3921 7.5440 7.5440 7.8605 7.8605 7.9091 7.9091 8.0056 8.0056 8.2175 8.2175 8.3267 8.3267 8.4820 8.4820 8.7565 8.7565 9.0702 9.0702 9.2251 9.2251 9.3855 9.3855 9.3962 9.3962 k =-0.3333 0.1194 0.0000 ( 11993 PWs) bands (ev): -3.6147 -3.6147 -3.3171 -3.3171 -2.8557 -2.8557 -2.5246 -2.5246 -2.1840 -2.1840 -2.0551 -2.0551 3.0502 3.0502 3.3584 3.3584 4.0467 4.0467 4.2656 4.2656 4.5487 4.5487 5.3829 5.3829 5.8481 5.8481 6.4751 6.4751 6.7494 6.7494 6.8419 6.8419 7.0993 7.0993 7.2101 7.2101 7.3170 7.3170 7.4188 7.4188 7.5561 7.5561 7.9000 7.9000 7.9316 7.9316 8.0199 8.0199 8.2426 8.2426 8.3520 8.3520 8.5046 8.5046 8.7427 8.7427 9.0751 9.0751 9.2233 9.2233 9.3842 9.3842 9.4123 9.4123 k =-0.3500 0.1254 0.0000 ( 11997 PWs) bands (ev): -3.5710 -3.5710 -3.2730 -3.2730 -2.8410 -2.8410 -2.5223 -2.5223 -2.2400 -2.2400 -2.1102 -2.1102 3.0671 3.0671 3.3143 3.3143 4.0508 4.0508 4.2155 4.2155 4.5183 4.5183 5.3445 5.3445 5.8411 5.8411 6.5456 6.5456 6.7829 6.7829 6.8578 6.8578 7.1001 7.1001 7.2089 7.2089 7.3319 7.3319 7.4463 7.4463 7.5663 7.5663 7.9351 7.9351 7.9569 7.9569 8.0315 8.0315 8.2637 8.2637 8.3763 8.3763 8.5304 8.5304 8.7300 8.7300 9.0804 9.0804 9.2252 9.2252 9.3852 9.3852 9.4312 9.4312 k =-0.3667 0.1313 0.0000 ( 11991 PWs) bands (ev): -3.5267 -3.5267 -3.2281 -3.2281 -2.8275 -2.8275 -2.5218 -2.5218 -2.2938 -2.2938 -2.1654 -2.1654 3.0880 3.0880 3.2738 3.2738 4.0434 4.0434 4.1669 4.1669 4.5067 4.5067 5.3002 5.3002 5.8348 5.8348 6.6091 6.6091 6.8122 6.8122 6.8731 6.8731 7.1018 7.1018 7.2063 7.2063 7.3482 7.3482 7.4746 7.4746 7.5765 7.5765 7.9552 7.9552 7.9930 7.9930 8.0406 8.0406 8.2793 8.2793 8.3993 8.3993 8.5614 8.5614 8.7191 8.7191 9.0858 9.0858 9.2301 9.2301 9.3890 9.3890 9.4504 9.4504 k =-0.3833 0.1373 0.0000 ( 11995 PWs) bands (ev): -3.4826 -3.4826 -3.1828 -3.1828 -2.8153 -2.8153 -2.5240 -2.5240 -2.3437 -2.3437 -2.2202 -2.2202 3.1123 3.1123 3.2374 3.2374 4.0231 4.0231 4.1218 4.1218 4.5139 4.5139 5.2507 5.2507 5.8297 5.8297 6.6652 6.6652 6.8367 6.8367 6.8869 6.8869 7.1047 7.1047 7.2041 7.2041 7.3618 7.3618 7.5044 7.5044 7.5882 7.5882 7.9663 7.9663 8.0292 8.0292 8.0504 8.0504 8.2888 8.2888 8.4203 8.4203 8.5990 8.5990 8.7106 8.7106 9.0913 9.0913 9.2369 9.2369 9.3947 9.3947 9.4688 9.4688 k =-0.4000 0.1433 0.0000 ( 11993 PWs) bands (ev): -3.4392 -3.4392 -3.1376 -3.1376 -2.8049 -2.8049 -2.5304 -2.5304 -2.3871 -2.3871 -2.2738 -2.2738 3.1392 3.1392 3.2052 3.2052 3.9904 3.9904 4.0837 4.0837 4.5369 4.5369 5.1971 5.1971 5.8258 5.8258 6.7138 6.7138 6.8564 6.8564 6.8984 6.8984 7.1085 7.1085 7.2041 7.2041 7.3691 7.3691 7.5365 7.5365 7.6018 7.6018 7.9724 7.9724 8.0442 8.0442 8.0773 8.0773 8.2925 8.2925 8.4389 8.4389 8.6423 8.6423 8.7057 8.7057 9.0966 9.0966 9.2445 9.2445 9.4015 9.4015 9.4853 9.4853 k =-0.4167 0.1493 0.0000 ( 11977 PWs) bands (ev): -3.3975 -3.3975 -3.0935 -3.0935 -2.7966 -2.7966 -2.5432 -2.5432 -2.4206 -2.4206 -2.3252 -2.3252 3.1676 3.1676 3.1776 3.1776 3.9489 3.9489 4.0540 4.0540 4.5718 4.5718 5.1402 5.1402 5.8229 5.8229 6.7555 6.7555 6.8716 6.8716 6.9067 6.9067 7.1124 7.1124 7.2080 7.2080 7.3691 7.3691 7.5701 7.5701 7.6168 7.6168 7.9743 7.9743 8.0471 8.0471 8.1113 8.1113 8.2911 8.2911 8.4547 8.4547 8.6801 8.6801 8.7139 8.7139 9.1015 9.1015 9.2514 9.2514 9.4083 9.4083 9.4991 9.4991 k =-0.4333 0.1552 0.0000 ( 11985 PWs) bands (ev): -3.3589 -3.3589 -3.0516 -3.0516 -2.7909 -2.7909 -2.5630 -2.5630 -2.4423 -2.4423 -2.3733 -2.3733 3.1546 3.1546 3.1963 3.1963 3.9048 3.9048 4.0311 4.0311 4.6153 4.6153 5.0809 5.0809 5.8209 5.8209 6.7907 6.7907 6.8830 6.8830 6.9111 6.9111 7.1154 7.1154 7.2167 7.2167 7.3624 7.3624 7.6030 7.6030 7.6321 7.6321 7.9731 7.9731 8.0475 8.0475 8.1426 8.1426 8.2855 8.2855 8.4678 8.4678 8.6874 8.6874 8.7569 8.7569 9.1058 9.1058 9.2554 9.2554 9.4145 9.4145 9.5098 9.5098 k =-0.4500 0.1612 0.0000 ( 11991 PWs) bands (ev): -3.3250 -3.3250 -3.0139 -3.0139 -2.7879 -2.7879 -2.5855 -2.5855 -2.4542 -2.4542 -2.4159 -2.4159 3.1367 3.1367 3.2231 3.2231 3.8637 3.8637 4.0138 4.0138 4.6649 4.6649 5.0201 5.0201 5.8196 5.8196 6.8199 6.8199 6.8913 6.8913 6.9117 6.9117 7.1170 7.1170 7.2300 7.2300 7.3506 7.3506 7.6314 7.6314 7.6473 7.6473 7.9698 7.9698 8.0468 8.0468 8.1705 8.1705 8.2767 8.2767 8.4783 8.4783 8.6867 8.6867 8.8084 8.8084 9.1091 9.1091 9.2544 9.2544 9.4202 9.4202 9.5173 9.5173 k =-0.4667 0.1672 0.0000 ( 11994 PWs) bands (ev): -3.2981 -3.2981 -2.9829 -2.9829 -2.7874 -2.7874 -2.6051 -2.6051 -2.4603 -2.4603 -2.4504 -2.4504 3.1237 3.1237 3.2456 3.2456 3.8300 3.8300 4.0015 4.0015 4.7190 4.7190 4.9585 4.9585 5.8187 5.8187 6.8434 6.8434 6.8969 6.8969 6.9089 6.9089 7.1175 7.1175 7.2466 7.2466 7.3355 7.3355 7.6493 7.6493 7.6642 7.6642 7.9658 7.9658 8.0457 8.0457 8.1950 8.1950 8.2652 8.2652 8.4860 8.4860 8.6856 8.6856 8.8551 8.8551 9.1114 9.1114 9.2477 9.2477 9.4257 9.4257 9.5222 9.5222 k =-0.4833 0.1731 0.0000 ( 11986 PWs) bands (ev): -3.2806 -3.2806 -2.9620 -2.9620 -2.7882 -2.7882 -2.6180 -2.6180 -2.4734 -2.4734 -2.4631 -2.4631 3.1159 3.1159 3.2609 3.2609 3.8078 3.8078 3.9941 3.9941 4.7763 4.7763 4.8969 4.8969 5.8183 5.8183 6.8605 6.8605 6.9000 6.9000 6.9041 6.9041 7.1175 7.1175 7.2634 7.2634 7.3198 7.3198 7.6577 7.6577 7.6784 7.6784 7.9625 7.9625 8.0448 8.0448 8.2163 8.2163 8.2513 8.2513 8.4906 8.4906 8.6849 8.6849 8.8891 8.8891 9.1126 9.1126 9.2389 9.2389 9.4304 9.4304 9.5250 9.5250 k =-0.5000 0.1791 0.0000 ( 12010 PWs) bands (ev): -3.2745 -3.2745 -2.9546 -2.9546 -2.7887 -2.7887 -2.6224 -2.6224 -2.4816 -2.4816 -2.4639 -2.4639 3.1133 3.1133 3.2663 3.2663 3.7999 3.7999 3.9916 3.9916 4.8334 4.8334 4.8383 4.8383 5.8182 5.8182 6.8677 6.8677 6.9001 6.9001 6.9019 6.9019 7.1175 7.1175 7.2726 7.2726 7.3109 7.3109 7.6603 7.6603 7.6837 7.6837 7.9612 7.9612 8.0444 8.0444 8.2333 8.2333 8.2368 8.2368 8.4922 8.4922 8.6847 8.6847 8.9018 8.9018 9.1129 9.1129 9.2347 9.2347 9.4324 9.4324 9.5259 9.5259 k =-0.5000 0.1791 0.0000 ( 12010 PWs) bands (ev): -3.2745 -3.2745 -2.9546 -2.9546 -2.7887 -2.7887 -2.6224 -2.6224 -2.4816 -2.4816 -2.4639 -2.4639 3.1133 3.1133 3.2663 3.2663 3.7999 3.7999 3.9916 3.9916 4.8334 4.8334 4.8383 4.8383 5.8182 5.8182 6.8677 6.8677 6.9001 6.9001 6.9019 6.9019 7.1175 7.1175 7.2726 7.2726 7.3109 7.3109 7.6603 7.6603 7.6837 7.6837 7.9612 7.9612 8.0444 8.0444 8.2333 8.2333 8.2368 8.2368 8.4922 8.4922 8.6847 8.6847 8.9018 8.9018 9.1129 9.1129 9.2347 9.2347 9.4324 9.4324 9.5259 9.5259 k =-0.4939 0.1960-0.0000 ( 12002 PWs) bands (ev): -3.2734 -3.2734 -2.9535 -2.9535 -2.7878 -2.7878 -2.6218 -2.6218 -2.4810 -2.4810 -2.4632 -2.4632 3.1149 3.1149 3.2678 3.2678 3.8014 3.8014 3.9917 3.9917 4.8284 4.8284 4.8439 4.8439 5.8182 5.8182 6.8653 6.8653 6.8943 6.8943 6.8983 6.8983 7.1073 7.1073 7.2622 7.2622 7.3188 7.3188 7.6574 7.6574 7.6751 7.6751 7.9635 7.9635 8.0469 8.0469 8.2287 8.2287 8.2422 8.2422 8.4896 8.4896 8.6823 8.6823 8.9052 8.9052 9.1140 9.1140 9.2355 9.2355 9.4328 9.4328 9.5243 9.5243 k =-0.4879 0.2129-0.0000 ( 12008 PWs) bands (ev): -3.2701 -3.2701 -2.9503 -2.9503 -2.7850 -2.7850 -2.6201 -2.6201 -2.4791 -2.4791 -2.4610 -2.4610 3.1196 3.1196 3.2723 3.2723 3.8059 3.8059 3.9919 3.9919 4.8219 4.8219 4.8521 4.8521 5.8184 5.8184 6.8580 6.8580 6.8766 6.8766 6.8874 6.8874 7.0790 7.0790 7.2383 7.2383 7.3333 7.3333 7.6484 7.6484 7.6549 7.6549 7.9665 7.9665 8.0532 8.0532 8.2215 8.2215 8.2519 8.2519 8.4816 8.4816 8.6753 8.6753 8.9155 8.9155 9.1168 9.1168 9.2378 9.2378 9.4343 9.4343 9.5196 9.5196 k =-0.4818 0.2298-0.0000 ( 12016 PWs) bands (ev): -3.2647 -3.2647 -2.9449 -2.9449 -2.7805 -2.7805 -2.6173 -2.6173 -2.4761 -2.4761 -2.4573 -2.4573 3.1275 3.1275 3.2798 3.2798 3.8133 3.8133 3.9922 3.9922 4.8155 4.8155 4.8613 4.8613 5.8186 5.8186 6.8408 6.8408 6.8510 6.8510 6.8683 6.8683 7.0373 7.0373 7.2049 7.2049 7.3479 7.3479 7.6227 7.6227 7.6443 7.6443 7.9644 7.9644 8.0606 8.0606 8.2120 8.2120 8.2650 8.2650 8.4673 8.4673 8.6648 8.6648 8.9323 8.9323 9.1199 9.1199 9.2406 9.2406 9.4369 9.4369 9.5108 9.5111 k =-0.4758 0.2467-0.0000 ( 12024 PWs) bands (ev): -3.2572 -3.2572 -2.9373 -2.9373 -2.7741 -2.7741 -2.6133 -2.6133 -2.4719 -2.4719 -2.4522 -2.4522 3.1384 3.1384 3.2904 3.2904 3.8235 3.8235 3.9926 3.9926 4.8089 4.8089 4.8714 4.8714 5.8187 5.8187 6.7996 6.7996 6.8301 6.8301 6.8387 6.8387 6.9882 6.9882 7.1628 7.1628 7.3608 7.3608 7.5939 7.5939 7.6390 7.6390 7.9535 7.9535 8.0655 8.0655 8.2001 8.2001 8.2793 8.2793 8.4462 8.4462 8.6525 8.6525 8.9537 8.9537 9.1225 9.1225 9.2430 9.2430 9.4399 9.4399 9.4949 9.4957 k =-0.4697 0.2636-0.0000 ( 12022 PWs) bands (ev): -3.2475 -3.2475 -2.9275 -2.9275 -2.7660 -2.7660 -2.6083 -2.6083 -2.4665 -2.4665 -2.4457 -2.4457 3.1524 3.1524 3.3038 3.3038 3.8364 3.8364 3.9933 3.9933 4.8018 4.8018 4.8825 4.8825 5.8186 5.8186 6.7429 6.7429 6.7944 6.7944 6.8047 6.8047 6.9386 6.9386 7.1147 7.1147 7.3718 7.3718 7.5681 7.5681 7.6379 7.6379 7.9333 7.9333 8.0657 8.0657 8.1865 8.1865 8.2908 8.2908 8.4176 8.4176 8.6403 8.6403 8.9768 8.9768 9.1252 9.1252 9.2442 9.2442 9.4403 9.4403 9.4839 9.4839 k =-0.4637 0.2805-0.0000 ( 12018 PWs) bands (ev): -3.2357 -3.2357 -2.9157 -2.9157 -2.7562 -2.7562 -2.6022 -2.6022 -2.4600 -2.4600 -2.4378 -2.4378 3.1693 3.1693 3.3203 3.3203 3.8517 3.8517 3.9944 3.9944 4.7937 4.7937 4.8945 4.8945 5.8179 5.8179 6.6729 6.6729 6.7356 6.7356 6.7686 6.7686 6.8940 6.8940 7.0640 7.0640 7.3808 7.3808 7.5468 7.5468 7.6409 7.6409 7.9044 7.9044 8.0605 8.0605 8.1721 8.1721 8.2951 8.2951 8.3821 8.3821 8.6286 8.6286 8.9983 8.9983 9.1302 9.1302 9.2432 9.2432 9.4332 9.4332 9.4795 9.4795 k =-0.4576 0.2974-0.0000 ( 12012 PWs) bands (ev): -3.2218 -3.2218 -2.9017 -2.9017 -2.7447 -2.7447 -2.5950 -2.5950 -2.4525 -2.4525 -2.4284 -2.4284 3.1890 3.1890 3.3398 3.3398 3.8689 3.8689 3.9961 3.9961 4.7839 4.7839 4.9074 4.9074 5.8163 5.8163 6.5913 6.5913 6.6637 6.6637 6.7207 6.7207 6.8556 6.8556 7.0142 7.0142 7.3878 7.3878 7.5299 7.5299 7.6471 7.6471 7.8674 7.8674 8.0500 8.0500 8.1577 8.1577 8.2894 8.2894 8.3409 8.3409 8.6162 8.6162 9.0175 9.0175 9.1389 9.1389 9.2385 9.2385 9.4175 9.4175 9.4816 9.4816 k =-0.4516 0.3143-0.0000 ( 12008 PWs) bands (ev): -3.2058 -3.2058 -2.8856 -2.8856 -2.7316 -2.7316 -2.5867 -2.5867 -2.4439 -2.4439 -2.4178 -2.4178 3.2115 3.2115 3.3621 3.3621 3.8873 3.8873 3.9991 3.9991 4.7720 4.7720 4.9210 4.9210 5.8130 5.8130 6.5003 6.5003 6.5837 6.5837 6.6610 6.6610 6.8211 6.8211 6.9667 6.9667 7.3926 7.3926 7.5170 7.5170 7.6554 7.6554 7.8235 7.8235 8.0350 8.0350 8.1435 8.1435 8.2714 8.2714 8.2972 8.2972 8.6006 8.6006 9.0371 9.0371 9.1501 9.1501 9.2285 9.2285 9.3965 9.3965 9.4870 9.4870 k =-0.4455 0.3312-0.0000 ( 12024 PWs) bands (ev): -3.1877 -3.1877 -2.8674 -2.8674 -2.7170 -2.7170 -2.5775 -2.5775 -2.4344 -2.4344 -2.4059 -2.4059 3.2365 3.2365 3.3875 3.3875 3.9057 3.9057 4.0045 4.0045 4.7569 4.7569 4.9353 4.9353 5.8070 5.8070 6.4029 6.4029 6.4998 6.4998 6.5915 6.5915 6.7881 6.7881 6.9217 6.9217 7.3948 7.3948 7.5071 7.5071 7.6644 7.6644 7.7738 7.7738 8.0163 8.0163 8.1296 8.1296 8.2349 8.2349 8.2599 8.2599 8.5801 8.5801 9.0599 9.0599 9.1610 9.1610 9.2123 9.2123 9.3736 9.3736 9.4904 9.4904 k =-0.4395 0.3481-0.0000 ( 12028 PWs) bands (ev): -3.1676 -3.1676 -2.8472 -2.8472 -2.7010 -2.7010 -2.5673 -2.5673 -2.4240 -2.4240 -2.3927 -2.3927 3.2638 3.2638 3.4157 3.4157 3.9219 3.9219 4.0140 4.0140 4.7379 4.7379 4.9501 4.9501 5.7963 5.7963 6.3032 6.3032 6.4148 6.4148 6.5152 6.5152 6.7551 6.7551 6.8781 6.8781 7.3935 7.3935 7.4994 7.4994 7.6716 7.6716 7.7207 7.7207 7.9947 7.9947 8.1155 8.1155 8.1861 8.1861 8.2261 8.2261 8.5547 8.5547 9.0864 9.0864 9.1687 9.1687 9.1913 9.1913 9.3518 9.3518 9.4886 9.4886 k =-0.4334 0.3650-0.0000 ( 12020 PWs) bands (ev): -3.1455 -3.1455 -2.8249 -2.8249 -2.6837 -2.6837 -2.5561 -2.5561 -2.4128 -2.4128 -2.3784 -2.3784 3.2933 3.2933 3.4469 3.4469 3.9338 3.9338 4.0297 4.0297 4.7139 4.7139 4.9651 4.9651 5.7779 5.7779 6.2057 6.2057 6.3307 6.3307 6.4352 6.4352 6.7213 6.7213 6.8348 6.8348 7.3876 7.3876 7.4929 7.4929 7.6547 7.6547 7.6867 7.6867 7.9708 7.9708 8.0989 8.0989 8.1372 8.1372 8.1891 8.1891 8.5257 8.5257 9.1104 9.1104 9.1637 9.1637 9.1792 9.1792 9.3344 9.3344 9.4826 9.4826 k =-0.4274 0.3819-0.0000 ( 12016 PWs) bands (ev): -3.1215 -3.1215 -2.8006 -2.8006 -2.6652 -2.6652 -2.5441 -2.5441 -2.4008 -2.4008 -2.3629 -2.3629 3.3246 3.3246 3.4810 3.4810 3.9405 3.9405 4.0521 4.0521 4.6840 4.6840 4.9801 4.9801 5.7467 5.7467 6.1165 6.1165 6.2484 6.2484 6.3555 6.3555 6.6865 6.6865 6.7911 6.7911 7.3752 7.3752 7.4861 7.4861 7.5997 7.5997 7.6864 7.6864 7.9445 7.9445 8.0697 8.0697 8.1003 8.1003 8.1507 8.1507 8.4947 8.4947 9.1049 9.1049 9.1592 9.1592 9.1876 9.1876 9.3248 9.3248 9.4756 9.4756 k =-0.4213 0.3988-0.0000 ( 12020 PWs) bands (ev): -3.0955 -3.0955 -2.7744 -2.7744 -2.6456 -2.6456 -2.5312 -2.5312 -2.3883 -2.3883 -2.3464 -2.3464 3.3575 3.3575 3.5180 3.5180 3.9429 3.9429 4.0799 4.0799 4.6474 4.6474 4.9947 4.9947 5.6968 5.6968 6.0418 6.0418 6.1676 6.1676 6.2808 6.2808 6.6508 6.6508 6.7465 6.7465 7.3537 7.3537 7.4758 7.4758 7.5462 7.5462 7.6833 7.6833 7.9149 7.9149 8.0280 8.0280 8.0725 8.0725 8.1186 8.1186 8.4634 8.4634 9.0729 9.0729 9.1500 9.1500 9.2184 9.2184 9.3247 9.3247 9.4702 9.4702 k =-0.4153 0.4157-0.0000 ( 12020 PWs) bands (ev): -3.0676 -3.0676 -2.7463 -2.7463 -2.6251 -2.6251 -2.5174 -2.5174 -2.3753 -2.3753 -2.3289 -2.3289 3.3916 3.3916 3.5578 3.5578 3.9423 3.9423 4.1115 4.1115 4.6033 4.6033 5.0083 5.0083 5.6256 5.6256 5.9835 5.9835 6.0878 6.0878 6.2164 6.2164 6.6143 6.6143 6.7007 6.7007 7.3195 7.3195 7.4541 7.4541 7.5074 7.5074 7.6728 7.6728 7.8809 7.8809 7.9887 7.9887 8.0361 8.0361 8.1007 8.1007 8.4330 8.4330 9.0351 9.0351 9.1317 9.1317 9.2578 9.2578 9.3328 9.3328 9.4676 9.4676 k =-0.4092 0.4326-0.0000 ( 11992 PWs) bands (ev): -3.0379 -3.0379 -2.7163 -2.7163 -2.6039 -2.6039 -2.5028 -2.5028 -2.3620 -2.3620 -2.3104 -2.3104 3.4263 3.4263 3.6004 3.6004 3.9395 3.9395 4.1457 4.1457 4.5514 4.5514 5.0205 5.0205 5.5372 5.5372 5.9329 5.9329 6.0134 6.0134 6.1658 6.1658 6.5773 6.5773 6.6539 6.6539 7.2703 7.2703 7.4187 7.4187 7.4870 7.4870 7.6531 7.6531 7.8425 7.8425 7.9520 7.9520 7.9992 7.9992 8.0920 8.0920 8.4045 8.4045 8.9964 8.9964 9.1096 9.1096 9.2988 9.2988 9.3477 9.3477 9.4670 9.4670 k =-0.4031 0.4495-0.0000 ( 11996 PWs) bands (ev): -3.0065 -3.0065 -2.6846 -2.6846 -2.5822 -2.5822 -2.4874 -2.4874 -2.3483 -2.3483 -2.2912 -2.2912 3.4613 3.4613 3.6458 3.6458 3.9352 3.9352 4.1812 4.1812 4.4921 4.4921 5.0303 5.0303 5.4386 5.4386 5.8711 5.8711 5.9589 5.9589 6.1293 6.1293 6.5401 6.5401 6.6061 6.6061 7.2080 7.2080 7.3802 7.3802 7.4720 7.4720 7.6238 7.6238 7.8024 7.8024 7.9111 7.9111 7.9727 7.9727 8.0878 8.0878 8.3781 8.3781 8.9588 8.9588 9.0867 9.0867 9.3361 9.3361 9.3705 9.3705 9.4644 9.4644 k =-0.3971 0.4664-0.0000 ( 11976 PWs) bands (ev): -2.9734 -2.9734 -2.6510 -2.6510 -2.5603 -2.5603 -2.4712 -2.4712 -2.3346 -2.3346 -2.2712 -2.2712 3.4958 3.4958 3.6938 3.6938 3.9295 3.9295 4.2173 4.2173 4.4260 4.4260 5.0367 5.0367 5.3358 5.3358 5.7937 5.7937 5.9270 5.9270 6.1046 6.1046 6.5030 6.5030 6.5579 6.5579 7.1373 7.1373 7.3404 7.3404 7.4558 7.4558 7.5857 7.5857 7.7636 7.7636 7.8657 7.8657 7.9565 7.9565 8.0865 8.0865 8.3541 8.3541 8.9238 8.9238 9.0646 9.0646 9.3637 9.3637 9.4054 9.4054 9.4528 9.4528 k =-0.3910 0.4833-0.0000 ( 11976 PWs) bands (ev): -2.9386 -2.9386 -2.6157 -2.6157 -2.5384 -2.5384 -2.4542 -2.4542 -2.3210 -2.3210 -2.2506 -2.2506 3.5291 3.5291 3.7444 3.7444 3.9224 3.9224 4.2527 4.2527 4.3548 4.3548 5.0378 5.0378 5.2334 5.2334 5.7127 5.7127 5.9069 5.9069 6.0889 6.0889 6.4660 6.4660 6.5102 6.5102 7.0619 7.0619 7.2978 7.2978 7.4363 7.4363 7.5408 7.5408 7.7274 7.7274 7.8197 7.8197 7.9452 7.9452 8.0872 8.0872 8.3324 8.3324 8.8925 8.8925 9.0443 9.0443 9.3837 9.3837 9.4281 9.4281 9.4506 9.4506 k =-0.3850 0.5002-0.0000 ( 11992 PWs) bands (ev): -2.9023 -2.9023 -2.5789 -2.5789 -2.5169 -2.5169 -2.4364 -2.4364 -2.3076 -2.3076 -2.2295 -2.2295 3.5604 3.5604 3.7973 3.7973 3.9139 3.9139 4.2701 4.2701 4.2963 4.2963 5.0293 5.0293 5.1369 5.1369 5.6349 5.6349 5.8932 5.8932 6.0796 6.0796 6.4285 6.4285 6.4645 6.4645 6.9845 6.9845 7.2515 7.2515 7.4130 7.4130 7.4915 7.4915 7.6938 7.6938 7.7752 7.7752 7.9358 7.9358 8.0888 8.0888 8.3128 8.3128 8.8657 8.8657 9.0258 9.0258 9.3844 9.3844 9.4191 9.4191 9.4947 9.4947 k =-0.3789 0.5171-0.0000 ( 11994 PWs) bands (ev): -2.8645 -2.8645 -2.5405 -2.5405 -2.4960 -2.4960 -2.4178 -2.4178 -2.2946 -2.2946 -2.2080 -2.2080 3.5885 3.5885 3.8517 3.8517 3.9040 3.9040 4.1981 4.1981 4.3230 4.3230 4.9950 4.9950 5.0628 5.0628 5.5645 5.5645 5.8840 5.8840 6.0745 6.0745 6.3889 6.3889 6.4236 6.4236 6.9068 6.9068 7.2016 7.2016 7.3856 7.3856 7.4403 7.4403 7.6622 7.6622 7.7332 7.7332 7.9266 7.9266 8.0904 8.0904 8.2952 8.2952 8.8440 8.8440 9.0087 9.0087 9.3572 9.3572 9.4368 9.4368 9.5404 9.5404 k =-0.3729 0.5340-0.0000 ( 11990 PWs) bands (ev): -2.8254 -2.8254 -2.5006 -2.5006 -2.4760 -2.4760 -2.3984 -2.3984 -2.2821 -2.2821 -2.1862 -2.1862 3.6121 3.6121 3.8866 3.8866 3.9127 3.9127 4.1210 4.1210 4.3520 4.3520 4.9214 4.9214 5.0252 5.0252 5.5042 5.5042 5.8777 5.8777 6.0723 6.0723 6.3466 6.3466 6.3892 6.3892 6.8304 6.8304 7.1493 7.1493 7.3531 7.3531 7.3898 7.3898 7.6314 7.6314 7.6945 7.6945 7.9171 7.9171 8.0912 8.0912 8.2794 8.2794 8.8277 8.8277 8.9919 8.9919 9.3289 9.3289 9.4595 9.4595 9.5851 9.5851 k =-0.3668 0.5509-0.0000 ( 11994 PWs) bands (ev): -2.7850 -2.7850 -2.4593 -2.4593 -2.4572 -2.4572 -2.3783 -2.3783 -2.2704 -2.2704 -2.1643 -2.1643 3.6292 3.6292 3.8711 3.8711 3.9687 3.9687 4.0479 4.0479 4.3768 4.3768 4.8409 4.8409 4.9927 4.9927 5.4556 5.4556 5.8730 5.8730 6.0723 6.0723 6.3036 6.3036 6.3600 6.3600 6.7567 6.7567 7.0956 7.0956 7.3130 7.3130 7.3443 7.3443 7.6000 7.6000 7.6598 7.6598 7.9071 7.9071 8.0903 8.0903 8.2650 8.2650 8.8168 8.8168 8.9739 8.9739 9.3055 9.3055 9.4837 9.4837 9.6267 9.6267 k =-0.3608 0.5678-0.0000 ( 11990 PWs) bands (ev): -2.7435 -2.7435 -2.4397 -2.4397 -2.4167 -2.4167 -2.3576 -2.3576 -2.2596 -2.2596 -2.1422 -2.1422 3.6371 3.6371 3.8475 3.8475 3.9793 3.9793 4.0311 4.0311 4.3959 4.3959 4.7664 4.7664 4.9554 4.9554 5.4186 5.4186 5.8687 5.8687 6.0739 6.0739 6.2625 6.2625 6.3344 6.3344 6.6871 6.6871 7.0421 7.0421 7.2652 7.2652 7.3049 7.3049 7.5670 7.5670 7.6299 7.6299 7.8966 7.8966 8.0873 8.0873 8.2520 8.2520 8.8111 8.8111 8.9530 8.9530 9.2895 9.2895 9.5083 9.5083 9.6616 9.6616 k =-0.3547 0.5847-0.0000 ( 11976 PWs) bands (ev): -2.7010 -2.7010 -2.4237 -2.4237 -2.3730 -2.3730 -2.3367 -2.3367 -2.2499 -2.2499 -2.1203 -2.1203 3.6315 3.6315 3.8177 3.8177 3.9270 3.9270 4.0898 4.0898 4.4084 4.4084 4.7008 4.7008 4.9145 4.9145 5.3913 5.3913 5.8639 5.8639 6.0770 6.0770 6.2250 6.2250 6.3105 6.3105 6.6232 6.6232 6.9900 6.9900 7.2146 7.2146 7.2677 7.2677 7.5321 7.5321 7.6048 7.6048 7.8860 7.8860 8.0816 8.0816 8.2401 8.2401 8.8103 8.8103 8.9283 8.9283 9.2821 9.2821 9.5325 9.5325 9.6857 9.6857 k =-0.3487 0.6016-0.0000 ( 11980 PWs) bands (ev): -2.6576 -2.6576 -2.4094 -2.4094 -2.3287 -2.3287 -2.3153 -2.3153 -2.2415 -2.2415 -2.0985 -2.0985 3.6074 3.6074 3.7883 3.7883 3.8839 3.8839 4.1483 4.1483 4.4145 4.4145 4.6451 4.6451 4.8734 4.8734 5.3712 5.3712 5.8582 5.8582 6.0812 6.0812 6.1924 6.1924 6.2866 6.2866 6.5671 6.5671 6.9405 6.9405 7.1641 7.1641 7.2308 7.2308 7.4958 7.4958 7.5842 7.5842 7.8756 7.8756 8.0732 8.0732 8.2292 8.2292 8.8139 8.8139 8.8993 8.8993 9.2832 9.2832 9.5551 9.5551 9.6953 9.6953 k =-0.3426 0.6185-0.0000 ( 11978 PWs) bands (ev): -2.6136 -2.6136 -2.3968 -2.3968 -2.2962 -2.2962 -2.2816 -2.2816 -2.2345 -2.2345 -2.0770 -2.0770 3.5645 3.5645 3.7666 3.7666 3.8447 3.8447 4.2027 4.2027 4.4162 4.4162 4.5991 4.5991 4.8348 4.8348 5.3558 5.3558 5.8517 5.8517 6.0863 6.0863 6.1660 6.1660 6.2609 6.2609 6.5204 6.5204 6.8944 6.8944 7.1148 7.1148 7.1936 7.1936 7.4587 7.4587 7.5676 7.5676 7.8659 7.8659 8.0618 8.0618 8.2191 8.2191 8.8210 8.8210 8.8671 8.8671 9.2921 9.2921 9.5749 9.5749 9.6889 9.6889 k =-0.3366 0.6354-0.0000 ( 11978 PWs) bands (ev): -2.5692 -2.5692 -2.3861 -2.3861 -2.2758 -2.2758 -2.2383 -2.2383 -2.2263 -2.2263 -2.0559 -2.0559 3.5100 3.5100 3.7513 3.7513 3.8050 3.8050 4.2454 4.2454 4.4202 4.4202 4.5626 4.5626 4.8001 4.8001 5.3435 5.3435 5.8447 5.8447 6.0911 6.0911 6.1465 6.1465 6.2325 6.2325 6.4842 6.4842 6.8522 6.8522 7.0676 7.0676 7.1561 7.1561 7.4212 7.4212 7.5549 7.5549 7.8575 7.8575 8.0477 8.0477 8.2096 8.2096 8.8240 8.8240 8.8394 8.8394 9.3073 9.3073 9.5908 9.5908 9.6680 9.6680 k =-0.3305 0.6523-0.0000 ( 11974 PWs) bands (ev): -2.5245 -2.5245 -2.3774 -2.3774 -2.2565 -2.2565 -2.2277 -2.2277 -2.1864 -2.1864 -2.0353 -2.0353 3.4514 3.4514 3.7375 3.7375 3.7647 3.7647 4.2637 4.2637 4.4382 4.4382 4.5355 4.5355 4.7693 4.7693 5.3335 5.3335 5.8376 5.8376 6.0936 6.0936 6.1351 6.1351 6.2028 6.2028 6.4581 6.4581 6.8141 6.8141 7.0230 7.0230 7.1186 7.1186 7.3837 7.3837 7.5463 7.5463 7.8507 7.8507 8.0311 8.0311 8.2007 8.2007 8.7913 8.7913 8.8482 8.8482 9.3275 9.3275 9.5998 9.5998 9.6376 9.6376 k =-0.3245 0.6692-0.0000 ( 11982 PWs) bands (ev): -2.4800 -2.4800 -2.3709 -2.3709 -2.2384 -2.2384 -2.2262 -2.2262 -2.1388 -2.1388 -2.0151 -2.0151 3.3934 3.3934 3.7107 3.7107 3.7364 3.7364 4.2536 4.2536 4.4699 4.4699 4.5210 4.5210 4.7417 4.7417 5.3257 5.3257 5.8307 5.8307 6.0891 6.0891 6.1330 6.1330 6.1765 6.1765 6.4403 6.4403 6.7799 6.7799 6.9815 6.9815 7.0811 7.0811 7.3464 7.3464 7.5418 7.5418 7.8461 7.8461 8.0122 8.0122 8.1923 8.1923 8.7528 8.7528 8.8639 8.8639 9.3511 9.3511 9.5818 9.5818 9.6207 9.6207 k =-0.3184 0.6861-0.0000 ( 11998 PWs) bands (ev): -2.4360 -2.4360 -2.3668 -2.3668 -2.2279 -2.2279 -2.2208 -2.2208 -2.0904 -2.0904 -1.9954 -1.9954 3.3388 3.3388 3.6678 3.6678 3.7235 3.7235 4.2258 4.2258 4.4768 4.4768 4.5446 4.5446 4.7176 4.7176 5.3205 5.3205 5.8234 5.8234 6.0734 6.0734 6.1376 6.1376 6.1628 6.1628 6.4283 6.4283 6.7493 6.7493 6.9438 6.9438 7.0438 7.0438 7.3095 7.3095 7.5416 7.5416 7.8438 7.8438 7.9916 7.9916 8.1843 8.1843 8.7134 8.7134 8.8818 8.8818 9.3769 9.3769 9.5355 9.5355 9.6214 9.6214 k =-0.3123 0.7030-0.0000 ( 11998 PWs) bands (ev): -2.3931 -2.3931 -2.3650 -2.3650 -2.2313 -2.2313 -2.2052 -2.2052 -2.0417 -2.0417 -1.9760 -1.9760 3.2891 3.2891 3.6233 3.6233 3.7128 3.7128 4.1904 4.1904 4.4600 4.4600 4.5891 4.5891 4.7013 4.7013 5.3191 5.3191 5.8150 5.8150 6.0482 6.0482 6.1418 6.1418 6.1688 6.1688 6.4199 6.4199 6.7215 6.7215 6.9105 6.9105 7.0069 7.0069 7.2731 7.2731 7.5458 7.5458 7.8440 7.8440 7.9698 7.9698 8.1767 8.1767 8.6739 8.6739 8.9014 8.9014 9.4016 9.4016 9.4834 9.4834 9.6215 9.6215 k =-0.3063 0.7199-0.0000 ( 11984 PWs) bands (ev): -2.3687 -2.3687 -2.3491 -2.3491 -2.2375 -2.2375 -2.1909 -2.1909 -1.9929 -1.9929 -1.9569 -1.9569 3.2453 3.2453 3.5800 3.5800 3.7028 3.7028 4.1531 4.1531 4.4365 4.4365 4.6125 4.6125 4.7112 4.7112 5.3222 5.3222 5.8045 5.8045 6.0195 6.0195 6.1472 6.1472 6.1880 6.1880 6.4134 6.4134 6.6958 6.6958 6.8822 6.8822 6.9705 6.9705 7.2373 7.2373 7.5545 7.5545 7.8463 7.8463 7.9478 7.9478 8.1696 8.1696 8.6346 8.6346 8.9224 8.9224 9.4002 9.4002 9.4537 9.4537 9.6194 9.6194 k =-0.3002 0.7368-0.0000 ( 11984 PWs) bands (ev): -2.3726 -2.3726 -2.3099 -2.3099 -2.2463 -2.2463 -2.1780 -2.1780 -1.9441 -1.9441 -1.9377 -1.9377 3.2082 3.2082 3.5394 3.5394 3.6933 3.6933 4.1166 4.1166 4.4081 4.4081 4.6018 4.6018 4.7555 4.7555 5.3304 5.3304 5.7908 5.7908 5.9916 5.9916 6.1562 6.1562 6.2143 6.2143 6.4078 6.4078 6.6715 6.6715 6.8591 6.8591 6.9347 6.9347 7.2023 7.2023 7.5675 7.5675 7.8495 7.8495 7.9272 7.9272 8.1629 8.1629 8.5959 8.5959 8.9444 8.9444 9.3457 9.3457 9.4740 9.4740 9.6154 9.6154 k =-0.2942 0.7537-0.0000 ( 11972 PWs) bands (ev): -2.3805 -2.3805 -2.2732 -2.2732 -2.2574 -2.2574 -2.1665 -2.1665 -1.9181 -1.9181 -1.8956 -1.8956 3.1783 3.1783 3.5024 3.5024 3.6847 3.6847 4.0828 4.0828 4.3755 4.3755 4.5776 4.5776 4.8118 4.8118 5.3437 5.3437 5.7736 5.7736 5.9665 5.9665 6.1687 6.1687 6.2453 6.2453 6.4026 6.4026 6.6482 6.6482 6.8415 6.8415 6.8995 6.8995 7.1681 7.1681 7.5847 7.5847 7.8501 7.8501 7.9119 7.9119 8.1566 8.1566 8.5580 8.5580 8.9673 8.9673 9.2806 9.2806 9.5026 9.5026 9.6101 9.6101 k =-0.2881 0.7706-0.0000 ( 11982 PWs) bands (ev): -2.3921 -2.3921 -2.2731 -2.2731 -2.2381 -2.2381 -2.1567 -2.1567 -1.8975 -1.8975 -1.8475 -1.8475 3.1559 3.1559 3.4694 3.4694 3.6774 3.6774 4.0525 4.0525 4.3398 4.3398 4.5490 4.5490 4.8700 4.8700 5.3616 5.3616 5.7531 5.7531 5.9451 5.9451 6.1839 6.1839 6.2792 6.2792 6.3976 6.3976 6.6258 6.6258 6.8289 6.8289 6.8652 6.8652 7.1349 7.1349 7.6057 7.6057 7.8426 7.8426 7.9078 7.9078 8.1509 8.1509 8.5212 8.5212 8.9907 8.9907 9.2131 9.2131 9.5320 9.5320 9.6039 9.6039 k =-0.2821 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.4073 -2.4073 -2.2904 -2.2904 -2.2086 -2.2086 -2.1484 -2.1484 -1.8755 -1.8755 -1.8001 -1.8001 3.1414 3.1414 3.4411 3.4411 3.6716 3.6716 4.0262 4.0262 4.3023 4.3023 4.5184 4.5184 4.9276 4.9276 5.3828 5.3828 5.7298 5.7298 5.9275 5.9275 6.2013 6.2013 6.3139 6.3139 6.3935 6.3935 6.6048 6.6048 6.8191 6.8191 6.8339 6.8339 7.1026 7.1026 7.6300 7.6300 7.8270 7.8270 7.9150 7.9150 8.1457 8.1457 8.4857 8.4857 9.0133 9.0133 9.1458 9.1458 9.5611 9.5611 9.5976 9.5976 k =-0.2821 0.7875-0.0000 ( 11988 PWs) bands (ev): -2.4073 -2.4073 -2.2904 -2.2904 -2.2086 -2.2086 -2.1484 -2.1484 -1.8755 -1.8755 -1.8001 -1.8001 3.1414 3.1414 3.4411 3.4411 3.6716 3.6716 4.0262 4.0262 4.3023 4.3023 4.5184 4.5184 4.9276 4.9276 5.3828 5.3828 5.7298 5.7298 5.9275 5.9275 6.2013 6.2013 6.3139 6.3139 6.3935 6.3935 6.6048 6.6048 6.8191 6.8191 6.8339 6.8339 7.1026 7.1026 7.6300 7.6300 7.8270 7.8270 7.9150 7.9150 8.1457 8.1457 8.4857 8.4857 9.0133 9.0133 9.1458 9.1458 9.5611 9.5611 9.5976 9.5976 k =-0.2821 0.7875 0.0182 ( 11989 PWs) bands (ev): -2.4068 -2.4068 -2.2913 -2.2913 -2.2081 -2.2081 -2.1486 -2.1486 -1.8750 -1.8750 -1.8004 -1.8004 3.1426 3.1426 3.4390 3.4390 3.6719 3.6719 4.0239 4.0239 4.3051 4.3051 4.5182 4.5182 4.9303 4.9303 5.3844 5.3844 5.7261 5.7261 5.9258 5.9258 6.2005 6.2005 6.3097 6.3097 6.3998 6.3998 6.6051 6.6051 6.8175 6.8175 6.8348 6.8348 7.1063 7.1063 7.6299 7.6299 7.8221 7.8221 7.9138 7.9138 8.1476 8.1476 8.4826 8.4826 9.0177 9.0177 9.1495 9.1495 9.5603 9.5603 9.5992 9.5992 k =-0.2821 0.7875 0.0363 ( 11990 PWs) bands (ev): -2.4055 -2.4055 -2.2941 -2.2941 -2.2065 -2.2065 -2.1494 -2.1494 -1.8735 -1.8735 -1.8012 -1.8012 3.1462 3.1462 3.4327 3.4327 3.6726 3.6726 4.0171 4.0171 4.3129 4.3129 4.5179 4.5179 4.9383 4.9383 5.3892 5.3892 5.7155 5.7155 5.9208 5.9208 6.1980 6.1980 6.2998 6.2998 6.4154 6.4154 6.6063 6.6063 6.8124 6.8124 6.8378 6.8378 7.1168 7.1168 7.6294 7.6294 7.8084 7.8084 7.9097 7.9097 8.1529 8.1529 8.4737 8.4737 9.0306 9.0306 9.1599 9.1599 9.5584 9.5584 9.6036 9.6036 k =-0.2821 0.7875 0.0545 ( 11997 PWs) bands (ev): -2.4032 -2.4032 -2.2985 -2.2985 -2.2040 -2.2040 -2.1505 -2.1505 -1.8712 -1.8712 -1.8027 -1.8027 3.1522 3.1522 3.4226 3.4226 3.6736 3.6736 4.0070 4.0070 4.3247 4.3247 4.5177 4.5177 4.9504 4.9504 5.3974 5.3974 5.6990 5.6990 5.9127 5.9127 6.1938 6.1938 6.2878 6.2878 6.4352 6.4352 6.6095 6.6095 6.8044 6.8044 6.8429 6.8429 7.1333 7.1333 7.6276 7.6276 7.7884 7.7884 7.9023 7.9023 8.1614 8.1614 8.4600 8.4600 9.0505 9.0505 9.1757 9.1757 9.5565 9.5565 9.6109 9.6109 k =-0.2821 0.7875 0.0726 ( 11984 PWs) bands (ev): -2.4001 -2.4001 -2.3041 -2.3041 -2.2009 -2.2009 -2.1521 -2.1521 -1.8679 -1.8679 -1.8048 -1.8048 3.1604 3.1604 3.4093 3.4093 3.6746 3.6746 3.9948 3.9948 4.3390 4.3390 4.5180 4.5180 4.9653 4.9653 5.4092 5.4092 5.6784 5.6784 5.9012 5.9012 6.1878 6.1878 6.2760 6.2760 6.4548 6.4548 6.6166 6.6166 6.7948 6.7948 6.8491 6.8491 7.1545 7.1545 7.6228 7.6228 7.7658 7.7658 7.8916 7.8916 8.1725 8.1725 8.4430 8.4430 9.0752 9.0752 9.1948 9.1948 9.5558 9.5558 9.6211 9.6211 k =-0.2821 0.7875 0.0908 ( 11980 PWs) bands (ev): -2.3962 -2.3962 -2.3108 -2.3108 -2.1974 -2.1974 -2.1542 -2.1542 -1.8640 -1.8640 -1.8074 -1.8074 3.1708 3.1708 3.3934 3.3934 3.6756 3.6756 3.9817 3.9817 4.3543 4.3543 4.5190 4.5190 4.9814 4.9814 5.4244 5.4244 5.6559 5.6559 5.8862 5.8862 6.1802 6.1802 6.2658 6.2658 6.4707 6.4707 6.6290 6.6290 6.7850 6.7850 6.8554 6.8554 7.1793 7.1793 7.6121 7.6121 7.7456 7.7456 7.8779 7.8779 8.1859 8.1859 8.4238 8.4238 9.1026 9.1026 9.2149 9.2149 9.5574 9.5574 9.6346 9.6346 k =-0.2821 0.7875 0.1089 ( 11972 PWs) bands (ev): -2.3915 -2.3915 -2.3181 -2.3181 -2.1937 -2.1937 -2.1566 -2.1566 -1.8595 -1.8595 -1.8105 -1.8105 3.1832 3.1832 3.3755 3.3755 3.6765 3.6765 3.9689 3.9689 4.3695 4.3695 4.5207 4.5207 4.9974 4.9974 5.4422 5.4422 5.6343 5.6343 5.8675 5.8675 6.1716 6.1716 6.2578 6.2578 6.4812 6.4812 6.6470 6.6470 6.7760 6.7760 6.8610 6.8610 7.2068 7.2068 7.5923 7.5923 7.7326 7.7326 7.8615 7.8615 8.2011 8.2011 8.4033 8.4033 9.1307 9.1307 9.2332 9.2332 9.5625 9.5625 9.6515 9.6515 k =-0.2821 0.7875 0.1271 ( 11982 PWs) bands (ev): -2.3861 -2.3861 -2.3259 -2.3259 -2.1898 -2.1898 -2.1593 -2.1593 -1.8545 -1.8545 -1.8141 -1.8141 3.1975 3.1975 3.3561 3.3561 3.6772 3.6772 3.9572 3.9572 4.3835 4.3835 4.5228 4.5228 5.0121 5.0121 5.4603 5.4603 5.6171 5.6171 5.8450 5.8450 6.1629 6.1629 6.2520 6.2520 6.4868 6.4868 6.6681 6.6681 6.7689 6.7689 6.8650 6.8650 7.2363 7.2363 7.5636 7.5636 7.7285 7.7285 7.8433 7.8433 8.2179 8.2179 8.3821 8.3821 9.1573 9.1573 9.2480 9.2480 9.5714 9.5714 9.6709 9.6709 k =-0.2821 0.7875 0.1452 ( 11983 PWs) bands (ev): -2.3800 -2.3800 -2.3340 -2.3340 -2.1858 -2.1858 -2.1623 -2.1623 -1.8493 -1.8493 -1.8183 -1.8183 3.2134 3.2134 3.3360 3.3360 3.6777 3.6777 3.9473 3.9473 4.3955 4.3955 4.5249 4.5249 5.0247 5.0247 5.4750 5.4750 5.6086 5.6086 5.8198 5.8198 6.1552 6.1552 6.2482 6.2482 6.4891 6.4891 6.6885 6.6885 6.7648 6.7648 6.8671 6.8671 7.2669 7.2669 7.5296 7.5296 7.7318 7.7318 7.8241 7.8241 8.2361 8.2361 8.3606 8.3606 9.1808 9.1808 9.2581 9.2581 9.5838 9.5838 9.6908 9.6908 k =-0.2821 0.7875 0.1634 ( 11980 PWs) bands (ev): -2.3733 -2.3733 -2.3422 -2.3422 -2.1820 -2.1820 -2.1654 -2.1654 -1.8439 -1.8439 -1.8227 -1.8227 3.2304 3.2304 3.3158 3.3158 3.6780 3.6780 3.9398 3.9398 4.4047 4.4047 4.5267 4.5267 5.0343 5.0343 5.4828 5.4828 5.6114 5.6114 5.7942 5.7942 6.1494 6.1494 6.2458 6.2458 6.4897 6.4897 6.7039 6.7039 6.7647 6.7647 6.8673 6.8673 7.2972 7.2972 7.4946 7.4946 7.7402 7.7402 7.8048 7.8048 8.2553 8.2553 8.3390 8.3390 9.1995 9.1995 9.2636 9.2636 9.5977 9.5977 9.7074 9.7074 k =-0.2821 0.7875 0.1815 ( 11978 PWs) bands (ev): -2.3662 -2.3662 -2.3503 -2.3503 -2.1785 -2.1785 -2.1685 -2.1685 -1.8386 -1.8386 -1.8275 -1.8275 3.2475 3.2475 3.2967 3.2967 3.6782 3.6782 3.9352 3.9352 4.4106 4.4106 4.5278 4.5278 5.0405 5.0405 5.4847 5.4847 5.6210 5.6210 5.7729 5.7729 6.1457 6.1457 6.2445 6.2445 6.4897 6.4897 6.7122 6.7122 6.7675 6.7675 6.8664 6.8664 7.3234 7.3234 7.4649 7.4649 7.7520 7.7520 7.7865 7.7865 8.2753 8.2753 8.3177 8.3177 9.2120 9.2120 9.2656 9.2656 9.6093 9.6093 9.7176 9.7176 k =-0.2821 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.3597 -2.3597 -2.3571 -2.3571 -2.1766 -2.1766 -2.1702 -2.1702 -1.8346 -1.8346 -1.8313 -1.8313 3.2579 3.2579 3.2856 3.2856 3.6783 3.6783 3.9336 3.9336 4.4126 4.4126 4.5281 4.5281 5.0426 5.0426 5.4847 5.4847 5.6265 5.6265 5.7641 5.7641 6.1445 6.1445 6.2441 6.2441 6.4896 6.4896 6.7145 6.7145 6.7692 6.7692 6.8659 6.8659 7.3353 7.3353 7.4517 7.4517 7.7625 7.7625 7.7740 7.7740 8.2931 8.2931 8.2994 8.2994 9.2164 9.2164 9.2660 9.2660 9.6140 9.6140 9.7208 9.7208 k =-0.2821 0.7875 0.1997 ( 11984 PWs) bands (ev): -2.3597 -2.3597 -2.3571 -2.3571 -2.1766 -2.1766 -2.1702 -2.1702 -1.8346 -1.8346 -1.8313 -1.8313 3.2579 3.2579 3.2856 3.2856 3.6783 3.6783 3.9336 3.9336 4.4126 4.4126 4.5281 4.5281 5.0426 5.0426 5.4847 5.4847 5.6265 5.6265 5.7641 5.7641 6.1445 6.1445 6.2441 6.2441 6.4896 6.4896 6.7145 6.7145 6.7692 6.7692 6.8659 6.8659 7.3353 7.3353 7.4517 7.4517 7.7625 7.7625 7.7740 7.7740 8.2931 8.2931 8.2994 8.2994 9.2164 9.2164 9.2660 9.2660 9.6140 9.6140 9.7208 9.7208 k =-0.2881 0.7706 0.1997 ( 11992 PWs) bands (ev): -2.3474 -2.3474 -2.3435 -2.3435 -2.1929 -2.1929 -2.1855 -2.1855 -1.8695 -1.8695 -1.8656 -1.8656 3.2764 3.2764 3.3055 3.3055 3.6819 3.6819 3.9582 3.9582 4.4515 4.4515 4.5508 4.5508 5.0180 5.0180 5.4956 5.4956 5.6158 5.6158 5.7315 5.7315 6.1444 6.1444 6.2269 6.2269 6.5092 6.5092 6.7321 6.7321 6.7771 6.7771 6.8698 6.8698 7.3635 7.3635 7.4724 7.4724 7.7708 7.7708 7.7718 7.7718 8.2993 8.2993 8.3074 8.3074 9.2187 9.2187 9.2710 9.2710 9.6131 9.6131 9.7073 9.7073 k =-0.2942 0.7537 0.1997 ( 11992 PWs) bands (ev): -2.3408 -2.3408 -2.3354 -2.3354 -2.2106 -2.2106 -2.2021 -2.2021 -1.9031 -1.9031 -1.8986 -1.8986 3.3013 3.3013 3.3318 3.3318 3.6871 3.6871 3.9822 3.9822 4.4888 4.4888 4.5735 4.5735 4.9972 4.9972 5.5025 5.5025 5.6018 5.6018 5.7052 5.7052 6.1476 6.1476 6.2122 6.2122 6.5288 6.5288 6.7485 6.7485 6.7881 6.7881 6.8806 6.8806 7.3891 7.3891 7.4889 7.4889 7.7734 7.7734 7.7890 7.7890 8.3053 8.3053 8.3156 8.3156 9.2216 9.2216 9.2763 9.2763 9.6069 9.6069 9.6878 9.6878 k =-0.3002 0.7368 0.1997 ( 11996 PWs) bands (ev): -2.3414 -2.3414 -2.3343 -2.3343 -2.2280 -2.2280 -2.2182 -2.2182 -1.9355 -1.9355 -1.9304 -1.9304 3.3320 3.3320 3.3644 3.3644 3.6939 3.6939 4.0042 4.0042 4.5235 4.5235 4.5958 4.5958 4.9809 4.9809 5.5014 5.5014 5.5858 5.5858 5.6901 5.6901 6.1535 6.1535 6.2007 6.2007 6.5480 6.5480 6.7633 6.7633 6.8027 6.8027 6.8992 6.8992 7.4115 7.4115 7.5021 7.5021 7.7819 7.7819 7.8128 7.8128 8.3113 8.3113 8.3239 8.3239 9.2251 9.2251 9.2818 9.2818 9.5962 9.5962 9.6641 9.6641 k =-0.3063 0.7199 0.1997 ( 11992 PWs) bands (ev): -2.3506 -2.3506 -2.3425 -2.3425 -2.2425 -2.2425 -2.2320 -2.2320 -1.9665 -1.9665 -1.9609 -1.9609 3.3677 3.3677 3.4027 3.4027 3.7024 3.7024 4.0226 4.0226 4.5547 4.5547 4.6175 4.6175 4.9693 4.9693 5.4894 5.4894 5.5697 5.5697 5.6900 5.6900 6.1616 6.1616 6.1927 6.1927 6.5672 6.5672 6.7774 6.7774 6.8211 6.8211 6.9250 6.9250 7.4307 7.4307 7.5133 7.5133 7.7959 7.7959 7.8416 7.8416 8.3173 8.3173 8.3325 8.3325 9.2289 9.2289 9.2873 9.2873 9.5818 9.5818 9.6377 9.6377 k =-0.3123 0.7030 0.1997 ( 11988 PWs) bands (ev): -2.3688 -2.3688 -2.3608 -2.3608 -2.2525 -2.2525 -2.2424 -2.2424 -1.9965 -1.9965 -1.9904 -1.9904 3.4069 3.4069 3.4464 3.4464 3.7131 3.7131 4.0362 4.0362 4.5815 4.5815 4.6392 4.6392 4.9624 4.9624 5.4679 5.4679 5.5551 5.5551 5.7044 5.7044 6.1715 6.1715 6.1883 6.1883 6.5866 6.5866 6.7925 6.7925 6.8435 6.8435 6.9569 6.9569 7.4471 7.4471 7.5240 7.5240 7.8144 7.8144 7.8731 7.8731 8.3235 8.3235 8.3418 8.3418 9.2327 9.2327 9.2925 9.2925 9.5651 9.5651 9.6100 9.6100 k =-0.3184 0.6861 0.1997 ( 11980 PWs) bands (ev): -2.3946 -2.3946 -2.3873 -2.3873 -2.2594 -2.2594 -2.2504 -2.2504 -2.0254 -2.0254 -2.0189 -2.0189 3.4476 3.4476 3.4944 3.4944 3.7272 3.7272 4.0438 4.0438 4.6032 4.6032 4.6612 4.6612 4.9595 4.9595 5.4412 5.4412 5.5440 5.5440 5.7298 5.7298 6.1828 6.1828 6.1874 6.1874 6.6073 6.6073 6.8100 6.8100 6.8699 6.8699 6.9937 6.9937 7.4615 7.4615 7.5352 7.5352 7.8361 7.8361 7.9055 7.9055 8.3301 8.3301 8.3520 8.3520 9.2362 9.2362 9.2972 9.2972 9.5472 9.5472 9.5819 9.5819 k =-0.3245 0.6692 0.1997 ( 11994 PWs) bands (ev): -2.4258 -2.4258 -2.4194 -2.4194 -2.2652 -2.2652 -2.2574 -2.2574 -2.0537 -2.0537 -2.0469 -2.0469 3.4864 3.4864 3.5458 3.5458 3.7470 3.7470 4.0451 4.0451 4.6195 4.6195 4.6842 4.6842 4.9599 4.9599 5.4132 5.4132 5.5379 5.5379 5.7633 5.7633 6.1896 6.1896 6.1952 6.1952 6.6301 6.6301 6.8310 6.8310 6.8999 6.8999 7.0342 7.0342 7.4748 7.4748 7.5478 7.5478 7.8591 7.8591 7.9371 7.9371 8.3376 8.3376 8.3639 8.3639 9.2388 9.2388 9.3007 9.3007 9.5293 9.5293 9.5545 9.5545 k =-0.3305 0.6523 0.1997 ( 12006 PWs) bands (ev): -2.4605 -2.4605 -2.4549 -2.4549 -2.2713 -2.2713 -2.2645 -2.2645 -2.0813 -2.0813 -2.0742 -2.0742 3.5194 3.5194 3.5989 3.5989 3.7755 3.7755 4.0406 4.0406 4.6300 4.6300 4.7080 4.7080 4.9629 4.9629 5.3866 5.3866 5.5384 5.5384 5.8027 5.8027 6.1942 6.1942 6.2085 6.2085 6.6564 6.6564 6.8561 6.8561 6.9333 6.9333 7.0780 7.0780 7.4877 7.4877 7.5621 7.5621 7.8820 7.8820 7.9663 7.9663 8.3464 8.3464 8.3782 8.3782 9.2399 9.2399 9.3020 9.3020 9.5128 9.5128 9.5289 9.5289 k =-0.3366 0.6354 0.1997 ( 11994 PWs) bands (ev): -2.4974 -2.4974 -2.4925 -2.4925 -2.2783 -2.2783 -2.2725 -2.2725 -2.1085 -2.1085 -2.1012 -2.1012 3.5429 3.5429 3.6511 3.6511 3.8152 3.8152 4.0322 4.0322 4.6350 4.6350 4.7313 4.7313 4.9691 4.9691 5.3632 5.3632 5.5465 5.5465 5.8468 5.8468 6.2005 6.2005 6.2227 6.2227 6.6873 6.6873 6.8859 6.8859 6.9696 6.9696 7.1243 7.1243 7.5009 7.5009 7.5783 7.5783 7.9031 7.9031 7.9918 7.9918 8.3572 8.3572 8.3954 8.3954 9.2383 9.2383 9.3002 9.3002 9.4992 9.4992 9.5064 9.5064 k =-0.3426 0.6185 0.1997 ( 12006 PWs) bands (ev): -2.5357 -2.5357 -2.5314 -2.5314 -2.2867 -2.2867 -2.2816 -2.2816 -2.1353 -2.1353 -2.1279 -2.1279 3.5557 3.5557 3.6986 3.6986 3.8659 3.8659 4.0236 4.0236 4.6347 4.6347 4.7521 4.7521 4.9797 4.9797 5.3445 5.3445 5.5628 5.5628 5.8945 5.8945 6.2079 6.2079 6.2378 6.2378 6.7238 6.7238 6.9203 6.9203 7.0085 7.0085 7.1727 7.1727 7.5147 7.5147 7.5964 7.5964 7.9215 7.9215 8.0127 8.0127 8.3702 8.3702 8.4163 8.4163 9.2330 9.2330 9.2942 9.2942 9.4886 9.4886 9.4897 9.4897 k =-0.3487 0.6016 0.1997 ( 11994 PWs) bands (ev): -2.5746 -2.5746 -2.5708 -2.5708 -2.2963 -2.2963 -2.2920 -2.2920 -2.1618 -2.1618 -2.1543 -2.1543 3.5591 3.5591 3.7353 3.7353 3.9251 3.9251 4.0204 4.0204 4.6299 4.6299 4.7683 4.7683 4.9969 4.9969 5.3316 5.3316 5.5873 5.5873 5.9447 5.9447 6.2160 6.2160 6.2539 6.2539 6.7663 6.7663 6.9592 6.9592 7.0495 7.0495 7.2228 7.2228 7.5296 7.5296 7.6163 7.6163 7.9363 7.9363 8.0288 8.0288 8.3856 8.3856 8.4408 8.4408 9.2231 9.2231 9.2836 9.2836 9.4767 9.4767 9.4850 9.4850 k =-0.3547 0.5847 0.1997 ( 11994 PWs) bands (ev): -2.6138 -2.6138 -2.6104 -2.6104 -2.3073 -2.3073 -2.3036 -2.3036 -2.1879 -2.1879 -2.1803 -2.1803 3.5549 3.5549 3.7544 3.7544 3.9893 3.9893 4.0287 4.0287 4.6217 4.6217 4.7786 4.7786 5.0224 5.0224 5.3254 5.3254 5.6198 5.6198 5.9965 5.9965 6.2248 6.2248 6.2713 6.2713 6.8151 6.8151 7.0024 7.0024 7.0924 7.0924 7.2740 7.2740 7.5455 7.5455 7.6376 7.6376 7.9474 7.9474 8.0402 8.0402 8.4034 8.4034 8.4687 8.4687 9.2083 9.2083 9.2692 9.2692 9.4713 9.4713 9.4847 9.4847 k =-0.3608 0.5678 0.1997 ( 12004 PWs) bands (ev): -2.6528 -2.6528 -2.6497 -2.6497 -2.3196 -2.3196 -2.3164 -2.3164 -2.2135 -2.2135 -2.2059 -2.2059 3.5448 3.5448 3.7530 3.7530 4.0504 4.0504 4.0546 4.0546 4.6117 4.6117 4.7839 4.7839 5.0566 5.0566 5.3268 5.3268 5.6596 5.6596 6.0488 6.0488 6.2347 6.2347 6.2900 6.2900 6.8699 6.8699 7.0493 7.0493 7.1367 7.1367 7.3255 7.3255 7.5629 7.5629 7.6600 7.6600 7.9552 7.9552 8.0478 8.0478 8.4231 8.4231 8.4992 8.4992 9.1895 9.1895 9.2520 9.2520 9.4721 9.4721 9.4880 9.4880 k =-0.3668 0.5509 0.1997 ( 12000 PWs) bands (ev): -2.6914 -2.6914 -2.6886 -2.6886 -2.3332 -2.3332 -2.3305 -2.3305 -2.2384 -2.2384 -2.2309 -2.2309 3.5302 3.5302 3.7350 3.7350 4.0803 4.0803 4.1171 4.1171 4.6021 4.6021 4.7864 4.7864 5.0989 5.0989 5.3365 5.3365 5.7058 5.7058 6.1000 6.1000 6.2470 6.2470 6.3103 6.3103 6.9298 6.9298 7.0993 7.0993 7.1821 7.1821 7.3762 7.3762 7.5820 7.5820 7.6832 7.6832 7.9605 7.9605 8.0528 8.0528 8.4441 8.4441 8.5313 8.5313 9.1682 9.1682 9.2336 9.2336 9.4783 9.4783 9.4936 9.4936 k =-0.3729 0.5340 0.1997 ( 11992 PWs) bands (ev): -2.7293 -2.7293 -2.7268 -2.7268 -2.3479 -2.3479 -2.3456 -2.3456 -2.2626 -2.2626 -2.2550 -2.2550 3.5119 3.5119 3.7065 3.7065 4.1110 4.1110 4.1723 4.1723 4.5958 4.5958 4.7883 4.7883 5.1491 5.1491 5.3552 5.3552 5.7575 5.7575 6.1472 6.1472 6.2641 6.2641 6.3326 6.3326 6.9939 6.9939 7.1518 7.1518 7.2282 7.2282 7.4244 7.4244 7.6040 7.6040 7.7067 7.7067 7.9642 7.9642 8.0564 8.0564 8.4655 8.4655 8.5639 8.5639 9.1460 9.1460 9.2157 9.2157 9.4886 9.4886 9.5004 9.5004 k =-0.3789 0.5171 0.1997 ( 11992 PWs) bands (ev): -2.7663 -2.7663 -2.7640 -2.7640 -2.3637 -2.3637 -2.3619 -2.3619 -2.2857 -2.2857 -2.2783 -2.2783 3.4909 3.4909 3.6719 3.6719 4.1372 4.1372 4.2155 4.2155 4.5962 4.5962 4.7912 4.7912 5.2069 5.2069 5.3838 5.3838 5.8137 5.8137 6.1860 6.1860 6.2904 6.2904 6.3571 6.3571 7.0608 7.0608 7.2057 7.2057 7.2745 7.2745 7.4674 7.4674 7.6304 7.6304 7.7302 7.7302 7.9677 7.9677 8.0602 8.0602 8.4867 8.4867 8.5958 8.5958 9.1248 9.1248 9.1994 9.1994 9.5020 9.5020 9.5077 9.5077 k =-0.3850 0.5002 0.1997 ( 11992 PWs) bands (ev): -2.8022 -2.8022 -2.8001 -2.8001 -2.3806 -2.3806 -2.3791 -2.3791 -2.3077 -2.3077 -2.3004 -2.3004 3.4676 3.4676 3.6340 3.6340 4.1557 4.1557 4.2429 4.2429 4.6060 4.6060 4.7956 4.7956 5.2725 5.2725 5.4228 5.4228 5.8731 5.8731 6.2138 6.2138 6.3285 6.3285 6.3842 6.3842 7.1290 7.1290 7.2603 7.2603 7.3205 7.3205 7.5022 7.5022 7.6633 7.6633 7.7536 7.7536 7.9722 7.9722 8.0653 8.0653 8.5071 8.5071 8.6260 8.6260 9.1064 9.1064 9.1858 9.1858 9.5145 9.5145 9.5177 9.5177 k =-0.3910 0.4833 0.1997 ( 11994 PWs) bands (ev): -2.8369 -2.8369 -2.8350 -2.8350 -2.3985 -2.3985 -2.3972 -2.3972 -2.3283 -2.3283 -2.3213 -2.3213 3.4427 3.4427 3.5944 3.5944 4.1658 4.1658 4.2536 4.2536 4.6248 4.6248 4.8012 4.8012 5.3458 5.3458 5.4728 5.4728 5.9347 5.9347 6.2335 6.2335 6.3755 6.3755 6.4141 6.4141 7.1967 7.1967 7.3145 7.3145 7.3659 7.3659 7.5273 7.5273 7.7034 7.7034 7.7772 7.7772 7.9788 7.9788 8.0727 8.0727 8.5265 8.5265 8.6534 8.6534 9.0924 9.0924 9.1758 9.1758 9.5205 9.5205 9.5347 9.5347 k =-0.3971 0.4664 0.1997 ( 12000 PWs) bands (ev): -2.8703 -2.8703 -2.8686 -2.8686 -2.4172 -2.4172 -2.4160 -2.4160 -2.3475 -2.3475 -2.3408 -2.3408 3.4166 3.4166 3.5542 3.5542 4.1679 4.1679 4.2504 4.2504 4.6493 4.6493 4.8073 4.8073 5.4263 5.4263 5.5336 5.5336 5.9975 5.9975 6.2495 6.2495 6.4269 6.4269 6.4472 6.4472 7.2617 7.2617 7.3671 7.3671 7.4101 7.4101 7.5437 7.5437 7.7490 7.7490 7.8014 7.8014 7.9884 7.9884 8.0830 8.0830 8.5449 8.5449 8.6771 8.6771 9.0842 9.0842 9.1697 9.1697 9.5251 9.5251 9.5523 9.5523 k =-0.4031 0.4495 0.1997 ( 11984 PWs) bands (ev): -2.9022 -2.9022 -2.9007 -2.9007 -2.4363 -2.4363 -2.4352 -2.4352 -2.3653 -2.3653 -2.3591 -2.3591 3.3900 3.3900 3.5142 3.5142 4.1633 4.1633 4.2376 4.2376 4.6752 4.6752 4.8130 4.8130 5.5127 5.5127 5.6046 5.6046 6.0606 6.0606 6.2647 6.2647 6.4799 6.4799 6.4839 6.4839 7.3216 7.3216 7.4163 7.4163 7.4532 7.4532 7.5540 7.5540 7.7976 7.7976 7.8274 7.8274 8.0016 8.0016 8.0966 8.0966 8.5628 8.5628 8.6966 8.6966 9.0830 9.0830 9.1680 9.1680 9.5281 9.5281 9.5698 9.5698 k =-0.4092 0.4326 0.1997 ( 11984 PWs) bands (ev): -2.9326 -2.9326 -2.9312 -2.9312 -2.4556 -2.4556 -2.4545 -2.4545 -2.3818 -2.3818 -2.3761 -2.3761 3.3632 3.3632 3.4749 3.4749 4.1536 4.1536 4.2189 4.2189 4.6996 4.6996 4.8176 4.8176 5.6031 5.6031 5.6841 5.6841 6.1236 6.1236 6.2804 6.2804 6.5241 6.5241 6.5332 6.5332 7.3735 7.3735 7.4594 7.4594 7.4954 7.4954 7.5623 7.5623 7.8465 7.8465 7.8561 7.8561 8.0188 8.0188 8.1132 8.1132 8.5807 8.5807 8.7118 8.7118 9.0892 9.0892 9.1706 9.1706 9.5291 9.5291 9.5865 9.5865 k =-0.4153 0.4157 0.1997 ( 11984 PWs) bands (ev): -2.9613 -2.9613 -2.9601 -2.9601 -2.4748 -2.4748 -2.4736 -2.4736 -2.3972 -2.3972 -2.3920 -2.3920 3.3367 3.3367 3.4367 3.4367 4.1402 4.1402 4.1969 4.1969 4.7207 4.7207 4.8210 4.8210 5.6952 5.6952 5.7701 5.7701 6.1866 6.1866 6.2978 6.2978 6.5680 6.5680 6.5861 6.5861 7.4154 7.4154 7.4907 7.4907 7.5372 7.5372 7.5747 7.5747 7.8883 7.8883 7.8939 7.8939 8.0401 8.0401 8.1324 8.1324 8.5994 8.5994 8.7235 8.7235 9.1025 9.1025 9.1771 9.1771 9.5279 9.5279 9.6017 9.6017 k =-0.4213 0.3988 0.1997 ( 12000 PWs) bands (ev): -2.9883 -2.9883 -2.9873 -2.9873 -2.4935 -2.4935 -2.4923 -2.4923 -2.4115 -2.4115 -2.4067 -2.4067 3.3107 3.3107 3.4000 3.4000 4.1244 4.1244 4.1732 4.1732 4.7381 4.7381 4.8229 4.8229 5.7860 5.7860 5.8595 5.8595 6.2504 6.2504 6.3181 6.3181 6.6153 6.6153 6.6382 6.6382 7.4469 7.4469 7.5051 7.5051 7.5782 7.5782 7.5970 7.5970 7.9236 7.9236 7.9381 7.9381 8.0653 8.0653 8.1540 8.1540 8.6194 8.6194 8.7329 8.7329 9.1217 9.1217 9.1873 9.1873 9.5240 9.5240 9.6147 9.6147 k =-0.4274 0.3819 0.1997 ( 12004 PWs) bands (ev): -3.0136 -3.0136 -3.0127 -3.0127 -2.5115 -2.5115 -2.5104 -2.5104 -2.4248 -2.4248 -2.4205 -2.4205 3.2856 3.2856 3.3651 3.3651 4.1072 4.1072 4.1492 4.1492 4.7520 4.7520 4.8234 4.8234 5.8725 5.8725 5.9485 5.9485 6.3163 6.3163 6.3431 6.3431 6.6654 6.6654 6.6891 6.6891 7.4696 7.4696 7.5066 7.5066 7.6170 7.6170 7.6256 7.6256 7.9605 7.9605 7.9780 7.9780 8.0945 8.0945 8.1777 8.1777 8.6411 8.6411 8.7414 8.7414 9.1449 9.1449 9.2003 9.2003 9.5173 9.5173 9.6249 9.6249 k =-0.4334 0.3650 0.1997 ( 11992 PWs) bands (ev): -3.0370 -3.0370 -3.0362 -3.0362 -2.5287 -2.5287 -2.5276 -2.5276 -2.4370 -2.4370 -2.4332 -2.4332 3.2618 3.2618 3.3321 3.3321 4.0895 4.0895 4.1255 4.1255 4.7627 4.7627 4.8227 4.8227 5.9513 5.9513 6.0322 6.0322 6.3756 6.3756 6.3858 6.3858 6.7177 6.7177 6.7386 6.7386 7.4859 7.4859 7.5021 7.5021 7.6524 7.6524 7.6542 7.6542 7.9964 7.9964 8.0127 8.0127 8.1271 8.1271 8.2039 8.2039 8.6645 8.6645 8.7504 8.7504 9.1698 9.1698 9.2152 9.2152 9.5076 9.5076 9.6282 9.6283 k =-0.4395 0.3481 0.1997 ( 11994 PWs) bands (ev): -3.0586 -3.0586 -3.0578 -3.0578 -2.5448 -2.5448 -2.5437 -2.5437 -2.4483 -2.4483 -2.4448 -2.4448 3.2394 3.2394 3.3013 3.3013 4.0719 4.0719 4.1027 4.1027 4.7707 4.7707 4.8211 4.8211 6.0201 6.0201 6.1047 6.1047 6.4193 6.4193 6.4596 6.4596 6.7715 6.7715 6.7864 6.7864 7.4951 7.4951 7.4981 7.4981 7.6798 7.6798 7.6836 7.6836 8.0283 8.0283 8.0422 8.0422 8.1622 8.1622 8.2327 8.2327 8.6894 8.6894 8.7608 8.7608 9.1931 9.1931 9.2302 9.2302 9.4952 9.4952 9.5839 9.5839 k =-0.4455 0.3312 0.1997 ( 11978 PWs) bands (ev): -3.0782 -3.0782 -3.0776 -3.0776 -2.5596 -2.5596 -2.5586 -2.5586 -2.4585 -2.4585 -2.4555 -2.4555 3.2187 3.2187 3.2728 3.2728 4.0550 4.0550 4.0812 4.0812 4.7767 4.7767 4.8188 4.8188 6.0778 6.0778 6.1614 6.1614 6.4766 6.4766 6.5365 6.5365 6.8266 6.8266 6.8326 6.8326 7.4873 7.4873 7.5083 7.5083 7.7018 7.7018 7.7105 7.7105 8.0536 8.0536 8.0666 8.0666 8.1985 8.1985 8.2642 8.2642 8.7149 8.7149 8.7734 8.7734 9.2107 9.2107 9.2424 9.2424 9.4822 9.4822 9.5406 9.5406 k =-0.4516 0.3143 0.1997 ( 11982 PWs) bands (ev): -3.0959 -3.0959 -3.0953 -3.0953 -2.5732 -2.5732 -2.5722 -2.5722 -2.4678 -2.4678 -2.4652 -2.4652 3.1999 3.1999 3.2468 3.2468 4.0392 4.0392 4.0613 4.0613 4.7809 4.7809 4.8160 4.8160 6.1250 6.1250 6.2021 6.2021 6.5452 6.5452 6.6137 6.6137 6.8771 6.8771 6.8829 6.8829 7.4799 7.4799 7.5179 7.5179 7.7202 7.7202 7.7333 7.7333 8.0710 8.0710 8.0860 8.0860 8.2349 8.2349 8.2974 8.2974 8.7403 8.7403 8.7885 8.7885 9.2171 9.2171 9.2470 9.2470 9.4727 9.4727 9.5067 9.5067 k =-0.4576 0.2974 0.1997 ( 11974 PWs) bands (ev): -3.1115 -3.1115 -3.1110 -3.1110 -2.5853 -2.5853 -2.5845 -2.5845 -2.4760 -2.4760 -2.4737 -2.4737 3.1832 3.1832 3.2233 3.2233 4.0247 4.0247 4.0432 4.0432 4.7840 4.7840 4.8129 4.8129 6.1631 6.1631 6.2302 6.2302 6.6190 6.6190 6.6868 6.6868 6.9201 6.9201 6.9408 6.9408 7.4736 7.4736 7.5278 7.5278 7.7358 7.7358 7.7524 7.7524 8.0803 8.0803 8.1001 8.1001 8.2702 8.2702 8.3306 8.3306 8.7647 8.7647 8.8059 8.8059 9.2083 9.2083 9.2397 9.2397 9.4709 9.4709 9.4851 9.4851 k =-0.4637 0.2805 0.1997 ( 11970 PWs) bands (ev): -3.1251 -3.1251 -3.1247 -3.1247 -2.5960 -2.5960 -2.5952 -2.5952 -2.4832 -2.4832 -2.4812 -2.4812 3.1688 3.1688 3.2024 3.2024 4.0119 4.0119 4.0271 4.0271 4.7862 4.7862 4.8097 4.8097 6.1936 6.1936 6.2497 6.2497 6.6913 6.6913 6.7514 6.7514 6.9621 6.9621 6.9999 6.9999 7.4694 7.4694 7.5384 7.5384 7.7492 7.7492 7.7687 7.7687 8.0823 8.0823 8.1086 8.1086 8.3037 8.3037 8.3617 8.3617 8.7875 8.7875 8.8254 8.8254 9.1849 9.1849 9.2205 9.2205 9.4739 9.4739 9.4741 9.4741 k =-0.4697 0.2636 0.1997 ( 11984 PWs) bands (ev): -3.1367 -3.1367 -3.1364 -3.1364 -2.6051 -2.6051 -2.6045 -2.6045 -2.4893 -2.4893 -2.4877 -2.4877 3.1567 3.1567 3.1842 3.1842 4.0008 4.0008 4.0132 4.0132 4.7877 4.7877 4.8065 4.8065 6.2180 6.2180 6.2631 6.2631 6.7565 6.7565 6.8048 6.8048 7.0035 7.0035 7.0580 7.0580 7.4686 7.4686 7.5492 7.5492 7.7614 7.7614 7.7829 7.7829 8.0783 8.0783 8.1111 8.1111 8.3347 8.3347 8.3890 8.3890 8.8084 8.8084 8.8461 8.8461 9.1524 9.1524 9.1934 9.1934 9.4687 9.4687 9.4726 9.4726 k =-0.4758 0.2467 0.1997 ( 11980 PWs) bands (ev): -3.1462 -3.1462 -3.1459 -3.1459 -2.6126 -2.6126 -2.6121 -2.6121 -2.4942 -2.4942 -2.4930 -2.4930 3.1472 3.1472 3.1689 3.1689 3.9918 3.9918 4.0014 4.0014 4.7890 4.7890 4.8034 4.8034 6.2373 6.2373 6.2723 6.2723 6.8108 6.8108 6.8460 6.8460 7.0444 7.0444 7.1103 7.1103 7.4730 7.4730 7.5588 7.5588 7.7732 7.7732 7.7958 7.7958 8.0699 8.0699 8.1074 8.1074 8.3627 8.3627 8.4109 8.4109 8.8273 8.8273 8.8668 8.8668 9.1174 9.1174 9.1633 9.1633 9.4645 9.4645 9.4658 9.4658 k =-0.4818 0.2298 0.1997 ( 11992 PWs) bands (ev): -3.1536 -3.1536 -3.1534 -3.1534 -2.6185 -2.6185 -2.6181 -2.6181 -2.4981 -2.4981 -2.4972 -2.4972 3.1402 3.1402 3.1563 3.1563 3.9849 3.9849 3.9920 3.9920 4.7901 4.7901 4.8006 4.8006 6.2525 6.2525 6.2779 6.2779 6.8524 6.8524 6.8759 6.8759 7.0839 7.0839 7.1506 7.1506 7.4843 7.4843 7.5653 7.5653 7.7851 7.7851 7.8072 7.8072 8.0599 8.0599 8.0980 8.0980 8.3871 8.3871 8.4265 8.4265 8.8448 8.8448 8.8850 8.8850 9.0859 9.0859 9.1334 9.1334 9.4582 9.4582 9.4599 9.4599 k =-0.4879 0.2129 0.1997 ( 11992 PWs) bands (ev): -3.1589 -3.1589 -3.1587 -3.1587 -2.6227 -2.6227 -2.6225 -2.6225 -2.5008 -2.5008 -2.5002 -2.5002 3.1359 3.1359 3.1466 3.1466 3.9803 3.9803 3.9849 3.9849 4.7913 4.7913 4.7981 4.7981 6.2641 6.2641 6.2807 6.2807 6.8816 6.8816 6.8956 6.8956 7.1199 7.1199 7.1742 7.1742 7.5025 7.5025 7.5661 7.5661 7.7973 7.7973 7.8161 7.8161 8.0518 8.0518 8.0842 8.0842 8.4073 8.4073 8.4354 8.4354 8.8613 8.8613 8.8970 8.8970 9.0640 9.0640 9.1057 9.1057 9.4523 9.4523 9.4552 9.4552 k =-0.4939 0.1960 0.1997 ( 11992 PWs) bands (ev): -3.1620 -3.1620 -3.1620 -3.1620 -2.6252 -2.6252 -2.6251 -2.6251 -2.5024 -2.5024 -2.5021 -2.5021 3.1344 3.1344 3.1397 3.1397 3.9779 3.9779 3.9802 3.9802 4.7926 4.7926 4.7959 4.7959 6.2724 6.2724 6.2806 6.2806 6.8995 6.8995 6.9060 6.9060 7.1498 7.1498 7.1801 7.1801 7.5245 7.5245 7.5594 7.5594 7.8086 7.8086 7.8199 7.8199 8.0498 8.0498 8.0688 8.0688 8.4229 8.4229 8.4376 8.4376 8.8771 8.8771 8.8989 8.8989 9.0566 9.0566 9.0818 9.0818 9.4492 9.4492 9.4512 9.4512 k =-0.5000 0.1791 0.1997 ( 11996 PWs) bands (ev): -3.1631 -3.1631 -3.1631 -3.1631 -2.6260 -2.6260 -2.6260 -2.6260 -2.5028 -2.5028 -2.5028 -2.5028 3.1356 3.1356 3.1356 3.1356 3.9779 3.9779 3.9779 3.9779 4.7941 4.7941 4.7941 4.7941 6.2779 6.2779 6.2779 6.2779 6.9074 6.9074 6.9074 6.9074 7.1709 7.1709 7.1709 7.1709 7.5449 7.5449 7.5449 7.5449 7.8170 7.8170 7.8170 7.8170 8.0560 8.0560 8.0560 8.0560 8.4332 8.4332 8.4332 8.4332 8.8908 8.8908 8.8909 8.8909 9.0640 9.0640 9.0640 9.0640 9.4490 9.4490 9.4490 9.4490 k =-0.5000 0.1791 0.1997 ( 11996 PWs) bands (ev): -3.1631 -3.1631 -3.1631 -3.1631 -2.6260 -2.6260 -2.6260 -2.6260 -2.5028 -2.5028 -2.5028 -2.5028 3.1356 3.1356 3.1356 3.1356 3.9779 3.9779 3.9779 3.9779 4.7941 4.7941 4.7941 4.7941 6.2779 6.2779 6.2779 6.2779 6.9074 6.9074 6.9074 6.9074 7.1709 7.1709 7.1709 7.1709 7.5449 7.5449 7.5449 7.5449 7.8170 7.8170 7.8170 7.8170 8.0560 8.0560 8.0560 8.0560 8.4332 8.4332 8.4332 8.4332 8.8908 8.8908 8.8909 8.8909 9.0640 9.0640 9.0640 9.0640 9.4490 9.4490 9.4490 9.4490 k =-0.5000 0.1791 0.1815 ( 12000 PWs) bands (ev): -3.1815 -3.1815 -3.1433 -3.1433 -2.6422 -2.6422 -2.6099 -2.6099 -2.5168 -2.5168 -2.4901 -2.4901 3.1037 3.1037 3.1740 3.1740 3.8961 3.8961 4.0593 4.0593 4.7492 4.7492 4.8330 4.8330 6.2066 6.2066 6.3521 6.3521 6.9051 6.9051 6.9098 6.9098 7.1609 7.1609 7.1818 7.1818 7.5115 7.5115 7.5774 7.5774 7.8129 7.8129 7.8184 7.8184 8.0426 8.0426 8.0702 8.0702 8.4252 8.4252 8.4417 8.4417 8.8783 8.8783 8.9003 8.9003 9.0486 9.0486 9.0851 9.0851 9.4432 9.4432 9.4544 9.4544 k =-0.5000 0.1791 0.1634 ( 12000 PWs) bands (ev): -3.1986 -3.1986 -3.1224 -3.1224 -2.6585 -2.6585 -2.5938 -2.5938 -2.5317 -2.5317 -2.4790 -2.4790 3.0786 3.0786 3.2183 3.2183 3.8157 3.8157 4.1382 4.1382 4.6998 4.6998 4.8653 4.8653 6.1396 6.1396 6.4277 6.4277 6.9031 6.9031 6.9123 6.9123 7.1521 7.1521 7.1934 7.1934 7.4783 7.4783 7.6078 7.6078 7.8045 7.8045 7.8192 7.8192 8.0318 8.0318 8.0835 8.0835 8.4178 8.4178 8.4503 8.4503 8.8621 8.8621 8.9072 8.9072 9.0399 9.0399 9.1102 9.1102 9.4361 9.4361 9.4601 9.4601 k =-0.5000 0.1791 0.1452 ( 12000 PWs) bands (ev): -3.2141 -3.2141 -3.1005 -3.1005 -2.6749 -2.6749 -2.5780 -2.5780 -2.5469 -2.5469 -2.4698 -2.4698 3.0604 3.0604 3.2677 3.2677 3.7381 3.7381 4.2109 4.2109 4.6491 4.6491 4.8908 4.8908 6.0775 6.0775 6.5028 6.5028 6.9015 6.9015 6.9147 6.9147 7.1443 7.1443 7.2056 7.2056 7.4461 7.4461 7.6340 7.6340 7.7917 7.7917 7.8223 7.8223 8.0247 8.0247 8.0946 8.0946 8.4110 8.4110 8.4586 8.4586 8.8421 8.8421 8.9119 8.9119 9.0380 9.0380 9.1374 9.1374 9.4271 9.4271 9.4664 9.4664 k =-0.5000 0.1791 0.1271 ( 11994 PWs) bands (ev): -3.2279 -3.2279 -3.0779 -3.0779 -2.6915 -2.6915 -2.5637 -2.5637 -2.5608 -2.5608 -2.4625 -2.4625 3.0492 3.0492 3.3205 3.3205 3.6656 3.6656 4.2695 4.2695 4.6046 4.6046 4.9095 4.9095 6.0210 6.0210 6.5753 6.5753 6.9003 6.9003 6.9167 6.9167 7.1377 7.1377 7.2179 7.2179 7.4158 7.4158 7.6536 7.6536 7.7753 7.7753 7.8311 7.8311 8.0217 8.0217 8.1030 8.1030 8.4041 8.4041 8.4663 8.4663 8.8189 8.8189 8.9146 8.9146 9.0424 9.0424 9.1646 9.1646 9.4166 9.4166 9.4735 9.4735 k =-0.5000 0.1791 0.1089 ( 12000 PWs) bands (ev): -3.2401 -3.2401 -3.0550 -3.0550 -2.7085 -2.7085 -2.5767 -2.5767 -2.5470 -2.5470 -2.4573 -2.4573 3.0450 3.0450 3.3722 3.3722 3.6028 3.6028 4.2980 4.2980 4.5825 4.5825 4.9212 4.9212 5.9705 5.9705 6.6431 6.6431 6.8996 6.8996 6.9182 6.9182 7.1322 7.1322 7.2300 7.2300 7.3883 7.3883 7.6651 7.6651 7.7568 7.7568 7.8478 7.8478 8.0222 8.0222 8.1093 8.1093 8.3958 8.3958 8.4732 8.4732 8.7933 8.7933 8.9153 8.9153 9.0516 9.0516 9.1892 9.1892 9.4071 9.4071 9.4816 9.4816 k =-0.5000 0.1791 0.0908 ( 11980 PWs) bands (ev): -3.2505 -3.2505 -3.0320 -3.0320 -2.7257 -2.7257 -2.5898 -2.5898 -2.5325 -2.5325 -2.4543 -2.4543 3.0476 3.0476 3.4069 3.4069 3.5660 3.5660 4.2815 4.2815 4.5976 4.5976 4.9260 4.9260 5.9264 5.9264 6.7042 6.7042 6.8994 6.8994 6.9188 6.9188 7.1277 7.1277 7.2415 7.2415 7.3643 7.3643 7.6693 7.6693 7.7379 7.7379 7.8715 7.8715 8.0257 8.0257 8.1151 8.1151 8.3844 8.3844 8.4791 8.4791 8.7667 8.7667 8.9140 8.9140 9.0640 9.0640 9.2089 9.2089 9.4023 9.4023 9.4906 9.4906 k =-0.5000 0.1791 0.0726 ( 11978 PWs) bands (ev): -3.2590 -3.2590 -3.0097 -3.0097 -2.7430 -2.7430 -2.6012 -2.6012 -2.5187 -2.5187 -2.4534 -2.4534 3.0565 3.0565 3.3958 3.3958 3.5838 3.5838 4.2300 4.2300 4.6404 4.6404 4.9236 4.9236 5.8890 5.8890 6.7570 6.7570 6.8995 6.8995 6.9182 6.9182 7.1241 7.1241 7.2518 7.2518 7.3445 7.3445 7.6687 7.6687 7.7202 7.7202 7.8988 7.8988 8.0311 8.0311 8.1230 8.1230 8.3678 8.3678 8.4840 8.4840 8.7408 8.7408 8.9113 8.9113 9.0779 9.0779 9.2221 9.2221 9.4043 9.4043 9.4999 9.4999 k =-0.5000 0.1791 0.0545 ( 11986 PWs) bands (ev): -3.2658 -3.2658 -2.9890 -2.9890 -2.7596 -2.7596 -2.6103 -2.6103 -2.5060 -2.5060 -2.4546 -2.4546 3.0708 3.0708 3.3555 3.3555 3.6398 3.6398 4.1621 4.1621 4.6930 4.6930 4.9136 4.9136 5.8588 5.8588 6.8004 6.8004 6.8998 6.8998 6.9159 6.9159 7.1213 7.1213 7.2605 7.2605 7.3294 7.3294 7.6660 7.6660 7.7051 7.7051 7.9246 7.9246 8.0369 8.0369 8.1371 8.1371 8.3445 8.3445 8.4877 8.4877 8.7177 8.7177 8.9080 8.9080 9.0914 9.0914 9.2294 9.2294 9.4121 9.4121 9.5092 9.5092 k =-0.5000 0.1791 0.0363 ( 11992 PWs) bands (ev): -3.2706 -3.2706 -2.9714 -2.9714 -2.7743 -2.7743 -2.6170 -2.6170 -2.4947 -2.4947 -2.4575 -2.4575 3.0886 3.0886 3.3128 3.3128 3.7064 3.7064 4.0896 4.0896 4.7457 4.7457 4.8959 4.8959 5.8365 5.8365 6.8341 6.8341 6.9002 6.9002 6.9116 6.9116 7.1192 7.1192 7.2671 7.2671 7.3190 7.3190 7.6631 7.6631 7.6935 7.6935 7.9449 7.9449 8.0414 8.0414 8.1610 8.1610 8.3135 8.3135 8.4903 8.4903 8.6998 8.6998 8.9048 8.9048 9.1027 9.1027 9.2328 9.2328 9.4218 9.4218 9.5175 9.5175 k =-0.5000 0.1791 0.0182 ( 11990 PWs) bands (ev): -3.2735 -3.2735 -2.9591 -2.9591 -2.7848 -2.7848 -2.6210 -2.6210 -2.4857 -2.4857 -2.4615 -2.4615 3.1056 3.1056 3.2796 3.2796 3.7689 3.7689 4.0238 4.0238 4.7940 4.7940 4.8700 4.8700 5.8228 5.8228 6.8578 6.8578 6.9004 6.9004 6.9055 6.9055 7.1179 7.1179 7.2712 7.2712 7.3129 7.3129 7.6611 7.6611 7.6862 7.6862 7.9572 7.9572 8.0438 8.0438 8.1949 8.1949 8.2761 8.2761 8.4917 8.4917 8.6885 8.6885 8.9026 8.9026 9.1102 9.1102 9.2343 9.2343 9.4295 9.4295 9.5236 9.5236 k =-0.5000 0.1791 0.0000 ( 12010 PWs) bands (ev): -3.2745 -3.2745 -2.9546 -2.9546 -2.7887 -2.7887 -2.6224 -2.6224 -2.4816 -2.4816 -2.4639 -2.4639 3.1133 3.1133 3.2663 3.2663 3.7999 3.7999 3.9916 3.9916 4.8334 4.8334 4.8383 4.8383 5.8182 5.8182 6.8677 6.8677 6.9001 6.9001 6.9019 6.9019 7.1175 7.1175 7.2726 7.2726 7.3109 7.3109 7.6603 7.6603 7.6837 7.6837 7.9612 7.9612 8.0444 8.0444 8.2333 8.2333 8.2368 8.2368 8.4922 8.4922 8.6847 8.6847 8.9018 8.9018 9.1129 9.1129 9.2347 9.2347 9.4324 9.4324 9.5259 9.5259 k = 0.0000 0.0000 0.1997 ( 11940 PWs) bands (ev): -3.9731 -3.9731 -3.9731 -3.9731 -2.8209 -2.8209 -2.8209 -2.8209 -1.4245 -1.4245 -1.4245 -1.4245 3.7641 3.7641 3.7642 3.7642 4.2221 4.2221 4.2221 4.2221 5.2560 5.2560 5.2560 5.2560 5.8252 5.8252 5.8252 5.8252 6.7201 6.7201 6.7201 6.7201 6.8665 6.8665 6.8665 6.8665 7.2388 7.2388 7.2388 7.2388 7.4244 7.4244 7.4244 7.4244 7.5104 7.5104 7.5104 7.5104 7.9683 7.9683 7.9683 7.9683 8.3748 8.3748 8.3748 8.3748 9.3527 9.3527 9.3527 9.3527 9.5935 9.5935 9.5935 9.5935 k =-0.0167 0.0060 0.1997 ( 11958 PWs) bands (ev): -3.9718 -3.9718 -3.9718 -3.9718 -2.8203 -2.8203 -2.8203 -2.8203 -1.4267 -1.4267 -1.4266 -1.4266 3.7560 3.7560 3.7561 3.7561 4.2288 4.2288 4.2288 4.2288 5.2557 5.2557 5.2557 5.2557 5.8269 5.8269 5.8269 5.8269 6.7160 6.7160 6.7160 6.7160 6.8657 6.8657 6.8657 6.8657 7.2407 7.2407 7.2408 7.2408 7.4260 7.4260 7.4260 7.4260 7.5132 7.5132 7.5132 7.5132 7.9700 7.9700 7.9700 7.9700 8.3759 8.3759 8.3759 8.3759 9.3517 9.3517 9.3517 9.3517 9.5936 9.5936 9.5936 9.5936 k =-0.0333 0.0119 0.1997 ( 11954 PWs) bands (ev): -3.9680 -3.9680 -3.9680 -3.9680 -2.8186 -2.8186 -2.8186 -2.8186 -1.4329 -1.4329 -1.4328 -1.4328 3.7336 3.7336 3.7336 3.7336 4.2468 4.2468 4.2468 4.2468 5.2553 5.2553 5.2554 5.2554 5.8319 5.8319 5.8319 5.8319 6.7040 6.7040 6.7040 6.7040 6.8637 6.8637 6.8637 6.8637 7.2461 7.2461 7.2461 7.2461 7.4305 7.4305 7.4305 7.4305 7.5215 7.5215 7.5215 7.5215 7.9748 7.9748 7.9748 7.9748 8.3791 8.3791 8.3791 8.3791 9.3488 9.3488 9.3488 9.3488 9.5938 9.5938 9.5938 9.5938 k =-0.0500 0.0179 0.1997 ( 11964 PWs) bands (ev): -3.9616 -3.9616 -3.9616 -3.9616 -2.8157 -2.8157 -2.8157 -2.8157 -1.4433 -1.4433 -1.4432 -1.4432 3.7009 3.7009 3.7009 3.7009 4.2712 4.2712 4.2712 4.2712 5.2561 5.2561 5.2561 5.2561 5.8395 5.8395 5.8396 5.8396 6.6843 6.6843 6.6843 6.6843 6.8619 6.8619 6.8619 6.8619 7.2540 7.2540 7.2540 7.2540 7.4372 7.4372 7.4372 7.4372 7.5353 7.5353 7.5353 7.5353 7.9826 7.9826 7.9826 7.9826 8.3843 8.3843 8.3843 8.3843 9.3440 9.3440 9.3440 9.3440 9.5942 9.5942 9.5942 9.5942 k =-0.0667 0.0239 0.1997 ( 11972 PWs) bands (ev): -3.9527 -3.9527 -3.9527 -3.9527 -2.8117 -2.8117 -2.8117 -2.8117 -1.4577 -1.4577 -1.4577 -1.4577 3.6620 3.6620 3.6621 3.6621 4.2965 4.2965 4.2965 4.2965 5.2597 5.2597 5.2597 5.2597 5.8492 5.8492 5.8492 5.8492 6.6582 6.6582 6.6582 6.6582 6.8616 6.8616 6.8616 6.8616 7.2635 7.2635 7.2635 7.2635 7.4456 7.4456 7.4456 7.4456 7.5543 7.5543 7.5543 7.5543 7.9932 7.9932 7.9932 7.9932 8.3916 8.3916 8.3916 8.3916 9.3374 9.3374 9.3374 9.3374 9.5945 9.5945 9.5945 9.5945 k =-0.0833 0.0299 0.1997 ( 11964 PWs) bands (ev): -3.9413 -3.9413 -3.9412 -3.9412 -2.8066 -2.8066 -2.8066 -2.8066 -1.4762 -1.4762 -1.4761 -1.4761 3.6204 3.6204 3.6204 3.6204 4.3181 4.3181 4.3181 4.3181 5.2679 5.2679 5.2680 5.2680 5.8600 5.8600 5.8600 5.8600 6.6276 6.6276 6.6276 6.6276 6.8633 6.8633 6.8633 6.8633 7.2736 7.2736 7.2736 7.2736 7.4552 7.4552 7.4552 7.4552 7.5780 7.5780 7.5780 7.5780 8.0063 8.0063 8.0063 8.0063 8.4008 8.4008 8.4008 8.4008 9.3290 9.3290 9.3290 9.3290 9.5947 9.5947 9.5947 9.5947 k =-0.1000 0.0358 0.1997 ( 11960 PWs) bands (ev): -3.9273 -3.9273 -3.9273 -3.9273 -2.8005 -2.8005 -2.8005 -2.8005 -1.4985 -1.4985 -1.4985 -1.4985 3.5781 3.5781 3.5781 3.5781 4.3326 4.3326 4.3326 4.3326 5.2824 5.2824 5.2824 5.2824 5.8709 5.8709 5.8709 5.8709 6.5951 6.5951 6.5951 6.5951 6.8672 6.8672 6.8672 6.8672 7.2836 7.2836 7.2836 7.2836 7.4660 7.4660 7.4660 7.4660 7.6054 7.6054 7.6054 7.6054 8.0213 8.0213 8.0213 8.0213 8.4119 8.4119 8.4119 8.4119 9.3189 9.3189 9.3189 9.3189 9.5946 9.5946 9.5946 9.5946 k =-0.1167 0.0418 0.1997 ( 11966 PWs) bands (ev): -3.9109 -3.9109 -3.9109 -3.9109 -2.7934 -2.7934 -2.7934 -2.7934 -1.5248 -1.5248 -1.5247 -1.5247 3.5367 3.5367 3.5367 3.5367 4.3379 4.3379 4.3379 4.3379 5.3034 5.3034 5.3035 5.3035 5.8811 5.8811 5.8811 5.8811 6.5631 6.5631 6.5631 6.5631 6.8731 6.8731 6.8731 6.8731 7.2929 7.2929 7.2929 7.2929 7.4780 7.4780 7.4780 7.4780 7.6357 7.6357 7.6357 7.6357 8.0378 8.0378 8.0378 8.0378 8.4247 8.4247 8.4247 8.4247 9.3073 9.3073 9.3073 9.3073 9.5938 9.5938 9.5938 9.5938 k =-0.1333 0.0478 0.1997 ( 11960 PWs) bands (ev): -3.8920 -3.8920 -3.8920 -3.8920 -2.7854 -2.7854 -2.7854 -2.7854 -1.5546 -1.5546 -1.5546 -1.5546 3.4970 3.4970 3.4971 3.4971 4.3332 4.3332 4.3333 4.3333 5.3303 5.3303 5.3303 5.3303 5.8900 5.8900 5.8900 5.8900 6.5345 6.5345 6.5345 6.5345 6.8811 6.8811 6.8811 6.8811 7.3011 7.3011 7.3012 7.3012 7.4914 7.4914 7.4914 7.4914 7.6681 7.6681 7.6681 7.6681 8.0552 8.0552 8.0552 8.0552 8.4390 8.4390 8.4390 8.4390 9.2942 9.2942 9.2942 9.2942 9.5921 9.5921 9.5921 9.5921 k =-0.1500 0.0537 0.1997 ( 11996 PWs) bands (ev): -3.8708 -3.8708 -3.8707 -3.8707 -2.7766 -2.7766 -2.7766 -2.7766 -1.5881 -1.5881 -1.5880 -1.5880 3.4599 3.4599 3.4599 3.4599 4.3193 4.3193 4.3193 4.3193 5.3606 5.3606 5.3606 5.3606 5.8972 5.8972 5.8972 5.8972 6.5115 6.5115 6.5115 6.5115 6.8909 6.8909 6.8909 6.8909 7.3083 7.3083 7.3083 7.3083 7.5064 7.5064 7.5065 7.5065 7.7018 7.7018 7.7018 7.7018 8.0731 8.0731 8.0731 8.0731 8.4546 8.4546 8.4546 8.4546 9.2799 9.2799 9.2799 9.2799 9.5892 9.5892 9.5892 9.5892 k =-0.1667 0.0597 0.1997 ( 11996 PWs) bands (ev): -3.8472 -3.8472 -3.8471 -3.8471 -2.7670 -2.7670 -2.7670 -2.7670 -1.6249 -1.6249 -1.6248 -1.6248 3.4255 3.4255 3.4255 3.4255 4.2972 4.2972 4.2973 4.2973 5.3908 5.3908 5.3908 5.3908 5.9034 5.9034 5.9035 5.9035 6.4964 6.4964 6.4964 6.4964 6.9026 6.9026 6.9026 6.9026 7.3143 7.3143 7.3143 7.3143 7.5231 7.5231 7.5232 7.5232 7.7360 7.7360 7.7360 7.7360 8.0911 8.0911 8.0911 8.0911 8.4711 8.4711 8.4711 8.4711 9.2646 9.2646 9.2646 9.2646 9.5847 9.5847 9.5847 9.5847 k =-0.1833 0.0657 0.1997 ( 12000 PWs) bands (ev): -3.8212 -3.8212 -3.8212 -3.8212 -2.7567 -2.7567 -2.7567 -2.7567 -1.6648 -1.6648 -1.6647 -1.6647 3.3941 3.3941 3.3941 3.3941 4.2690 4.2690 4.2690 4.2690 5.4163 5.4163 5.4163 5.4163 5.9103 5.9103 5.9103 5.9103 6.4907 6.4907 6.4907 6.4907 6.9160 6.9160 6.9160 6.9160 7.3195 7.3195 7.3195 7.3195 7.5414 7.5414 7.5414 7.5414 7.7701 7.7701 7.7701 7.7701 8.1089 8.1089 8.1089 8.1089 8.4882 8.4882 8.4882 8.4882 9.2484 9.2484 9.2484 9.2484 9.5786 9.5786 9.5786 9.5786 k =-0.2000 0.0716 0.1997 ( 11992 PWs) bands (ev): -3.7930 -3.7930 -3.7930 -3.7930 -2.7459 -2.7459 -2.7459 -2.7459 -1.7077 -1.7077 -1.7076 -1.7076 3.3657 3.3657 3.3657 3.3657 4.2362 4.2362 4.2363 4.2363 5.4323 5.4323 5.4323 5.4323 5.9202 5.9202 5.9202 5.9202 6.4949 6.4949 6.4950 6.4950 6.9309 6.9309 6.9309 6.9309 7.3244 7.3244 7.3244 7.3244 7.5611 7.5611 7.5611 7.5611 7.8035 7.8035 7.8035 7.8035 8.1265 8.1265 8.1265 8.1265 8.5057 8.5057 8.5057 8.5057 9.2316 9.2316 9.2316 9.2316 9.5710 9.5710 9.5710 9.5710 k =-0.2167 0.0776 0.1997 ( 11986 PWs) bands (ev): -3.7627 -3.7627 -3.7626 -3.7626 -2.7346 -2.7346 -2.7346 -2.7346 -1.7533 -1.7533 -1.7532 -1.7532 3.3402 3.3402 3.3402 3.3402 4.2009 4.2009 4.2009 4.2009 5.4351 5.4351 5.4351 5.4351 5.9356 5.9356 5.9356 5.9356 6.5089 6.5089 6.5089 6.5089 6.9473 6.9473 6.9473 6.9473 7.3295 7.3295 7.3295 7.3295 7.5818 7.5818 7.5818 7.5818 7.8357 7.8357 7.8357 7.8357 8.1438 8.1438 8.1438 8.1438 8.5230 8.5230 8.5231 8.5231 9.2145 9.2145 9.2145 9.2145 9.5622 9.5622 9.5622 9.5622 k =-0.2333 0.0836 0.1997 ( 11990 PWs) bands (ev): -3.7302 -3.7302 -3.7302 -3.7302 -2.7231 -2.7231 -2.7230 -2.7230 -1.8013 -1.8013 -1.8013 -1.8013 3.3174 3.3174 3.3174 3.3174 4.1644 4.1644 4.1644 4.1644 5.4234 5.4234 5.4234 5.4234 5.9574 5.9574 5.9574 5.9574 6.5315 6.5315 6.5315 6.5315 6.9650 6.9650 6.9650 6.9650 7.3354 7.3354 7.3354 7.3354 7.6031 7.6031 7.6031 7.6031 7.8661 7.8661 7.8661 7.8661 8.1612 8.1612 8.1612 8.1612 8.5401 8.5401 8.5401 8.5401 9.1972 9.1972 9.1972 9.1972 9.5530 9.5530 9.5530 9.5530 k =-0.2500 0.0896 0.1997 ( 11988 PWs) bands (ev): -3.6958 -3.6958 -3.6957 -3.6957 -2.7113 -2.7113 -2.7113 -2.7113 -1.8516 -1.8516 -1.8515 -1.8515 3.2971 3.2971 3.2971 3.2971 4.1283 4.1283 4.1283 4.1283 5.3982 5.3982 5.3982 5.3982 5.9845 5.9845 5.9845 5.9845 6.5611 6.5611 6.5611 6.5611 6.9836 6.9836 6.9836 6.9836 7.3430 7.3430 7.3430 7.3430 7.6245 7.6245 7.6245 7.6245 7.8944 7.8944 7.8944 7.8944 8.1789 8.1789 8.1789 8.1789 8.5567 8.5567 8.5567 8.5567 9.1802 9.1802 9.1802 9.1802 9.5443 9.5443 9.5443 9.5443 k =-0.2667 0.0955 0.1997 ( 11994 PWs) bands (ev): -3.6594 -3.6594 -3.6594 -3.6594 -2.6994 -2.6994 -2.6994 -2.6994 -1.9037 -1.9037 -1.9036 -1.9036 3.2789 3.2789 3.2789 3.2789 4.0938 4.0938 4.0938 4.0938 5.3620 5.3620 5.3620 5.3620 6.0150 6.0150 6.0150 6.0150 6.5957 6.5957 6.5957 6.5957 7.0029 7.0029 7.0029 7.0029 7.3530 7.3530 7.3530 7.3530 7.6454 7.6454 7.6454 7.6454 7.9202 7.9202 7.9202 7.9202 8.1973 8.1973 8.1973 8.1973 8.5727 8.5727 8.5727 8.5727 9.1637 9.1637 9.1637 9.1637 9.5370 9.5370 9.5370 9.5370 k =-0.2833 0.1015 0.1997 ( 11992 PWs) bands (ev): -3.6213 -3.6213 -3.6213 -3.6213 -2.6877 -2.6877 -2.6877 -2.6877 -1.9573 -1.9573 -1.9572 -1.9572 3.2624 3.2624 3.2624 3.2624 4.0619 4.0619 4.0619 4.0619 5.3178 5.3178 5.3178 5.3178 6.0467 6.0467 6.0468 6.0468 6.6332 6.6332 6.6333 6.6333 7.0225 7.0225 7.0225 7.0225 7.3659 7.3659 7.3659 7.3659 7.6653 7.6653 7.6653 7.6653 7.9433 7.9433 7.9434 7.9434 8.2168 8.2168 8.2169 8.2169 8.5882 8.5882 8.5882 8.5882 9.1482 9.1482 9.1482 9.1482 9.5317 9.5317 9.5317 9.5317 k =-0.3000 0.1075 0.1997 ( 11974 PWs) bands (ev): -3.5816 -3.5816 -3.5816 -3.5816 -2.6762 -2.6762 -2.6762 -2.6762 -2.0121 -2.0121 -2.0121 -2.0121 3.2472 3.2472 3.2472 3.2472 4.0335 4.0335 4.0335 4.0335 5.2681 5.2681 5.2681 5.2681 6.0782 6.0782 6.0782 6.0782 6.6717 6.6717 6.6717 6.6717 7.0419 7.0419 7.0419 7.0419 7.3821 7.3821 7.3821 7.3821 7.6836 7.6836 7.6836 7.6836 7.9640 7.9640 7.9640 7.9640 8.2377 8.2377 8.2377 8.2377 8.6037 8.6037 8.6037 8.6037 9.1337 9.1337 9.1337 9.1337 9.5289 9.5289 9.5289 9.5289 k =-0.3167 0.1134 0.1997 ( 11986 PWs) bands (ev): -3.5405 -3.5405 -3.5405 -3.5405 -2.6651 -2.6651 -2.6651 -2.6651 -2.0677 -2.0677 -2.0677 -2.0677 3.2331 3.2331 3.2331 3.2331 4.0094 4.0094 4.0094 4.0094 5.2151 5.2151 5.2151 5.2151 6.1084 6.1084 6.1084 6.1084 6.7093 6.7093 6.7094 6.7094 7.0607 7.0607 7.0607 7.0607 7.4017 7.4017 7.4017 7.4017 7.7000 7.7000 7.7000 7.7000 7.9823 7.9823 7.9823 7.9823 8.2599 8.2599 8.2599 8.2599 8.6196 8.6196 8.6196 8.6196 9.1207 9.1207 9.1207 9.1207 9.5286 9.5286 9.5286 9.5286 k =-0.3333 0.1194 0.1997 ( 11996 PWs) bands (ev): -3.4983 -3.4983 -3.4982 -3.4982 -2.6545 -2.6545 -2.6545 -2.6545 -2.1237 -2.1237 -2.1237 -2.1237 3.2196 3.2196 3.2197 3.2197 3.9899 3.9899 3.9899 3.9899 5.1603 5.1603 5.1604 5.1604 6.1367 6.1367 6.1367 6.1367 6.7447 6.7447 6.7447 6.7447 7.0784 7.0784 7.0785 7.0785 7.4239 7.4239 7.4239 7.4239 7.7145 7.7145 7.7145 7.7145 7.9984 7.9984 7.9984 7.9984 8.2831 8.2831 8.2831 8.2831 8.6367 8.6367 8.6367 8.6367 9.1093 9.1093 9.1093 9.1093 9.5305 9.5305 9.5305 9.5305 k =-0.3500 0.1254 0.1997 ( 11996 PWs) bands (ev): -3.4552 -3.4552 -3.4551 -3.4551 -2.6448 -2.6448 -2.6447 -2.6447 -2.1795 -2.1795 -2.1795 -2.1795 3.2067 3.2067 3.2068 3.2068 3.9754 3.9754 3.9754 3.9754 5.1054 5.1054 5.1054 5.1054 6.1628 6.1628 6.1628 6.1628 6.7769 6.7769 6.7769 6.7769 7.0949 7.0949 7.0949 7.0949 7.4476 7.4476 7.4476 7.4476 7.7272 7.7272 7.7273 7.7273 8.0125 8.0125 8.0125 8.0125 8.3068 8.3068 8.3068 8.3068 8.6560 8.6560 8.6560 8.6560 9.0994 9.0994 9.0994 9.0994 9.5340 9.5340 9.5340 9.5340 k =-0.3667 0.1313 0.1997 ( 12002 PWs) bands (ev): -3.4116 -3.4116 -3.4116 -3.4116 -2.6359 -2.6359 -2.6359 -2.6359 -2.2345 -2.2345 -2.2345 -2.2345 3.1944 3.1944 3.1944 3.1944 3.9656 3.9656 3.9657 3.9657 5.0514 5.0514 5.0514 5.0514 6.1864 6.1864 6.1864 6.1864 6.8054 6.8054 6.8054 6.8054 7.1099 7.1099 7.1099 7.1099 7.4712 7.4712 7.4712 7.4712 7.7390 7.7390 7.7390 7.7390 8.0246 8.0246 8.0246 8.0246 8.3303 8.3303 8.3303 8.3303 8.6784 8.6784 8.6784 8.6784 9.0910 9.0910 9.0910 9.0910 9.5379 9.5379 9.5379 9.5379 k =-0.3833 0.1373 0.1997 ( 12004 PWs) bands (ev): -3.3681 -3.3681 -3.3681 -3.3681 -2.6283 -2.6283 -2.6283 -2.6283 -2.2879 -2.2879 -2.2879 -2.2879 3.1825 3.1825 3.1825 3.1825 3.9604 3.9604 3.9604 3.9604 4.9996 4.9996 4.9997 4.9997 6.2075 6.2075 6.2075 6.2075 6.8301 6.8301 6.8301 6.8301 7.1235 7.1235 7.1235 7.1235 7.4927 7.4927 7.4927 7.4927 7.7506 7.7506 7.7506 7.7506 8.0346 8.0346 8.0347 8.0347 8.3526 8.3526 8.3526 8.3526 8.7046 8.7046 8.7046 8.7046 9.0841 9.0841 9.0841 9.0841 9.5403 9.5403 9.5403 9.5403 k =-0.4000 0.1433 0.1997 ( 12018 PWs) bands (ev): -3.3254 -3.3254 -3.3253 -3.3253 -2.6223 -2.6223 -2.6223 -2.6223 -2.3388 -2.3388 -2.3387 -2.3387 3.1714 3.1714 3.1715 3.1715 3.9591 3.9591 3.9591 3.9591 4.9512 4.9512 4.9512 4.9512 6.2260 6.2260 6.2260 6.2260 6.8511 6.8511 6.8511 6.8511 7.1355 7.1355 7.1355 7.1355 7.5108 7.5108 7.5108 7.5108 7.7626 7.7626 7.7626 7.7626 8.0425 8.0425 8.0425 8.0425 8.3731 8.3731 8.3731 8.3731 8.7347 8.7347 8.7347 8.7347 9.0783 9.0783 9.0783 9.0783 9.5384 9.5384 9.5384 9.5384 k =-0.4167 0.1493 0.1997 ( 12020 PWs) bands (ev): -3.2843 -3.2843 -3.2843 -3.2843 -2.6181 -2.6181 -2.6181 -2.6181 -2.3857 -2.3857 -2.3857 -2.3857 3.1614 3.1614 3.1614 3.1614 3.9609 3.9609 3.9609 3.9609 4.9071 4.9071 4.9071 4.9071 6.2417 6.2417 6.2417 6.2417 6.8685 6.8685 6.8686 6.8686 7.1459 7.1459 7.1459 7.1459 7.5245 7.5245 7.5245 7.5245 7.7751 7.7751 7.7751 7.7751 8.0483 8.0483 8.0483 8.0483 8.3910 8.3910 8.3910 8.3910 8.7680 8.7680 8.7680 8.7680 9.0737 9.0737 9.0737 9.0737 9.5291 9.5291 9.5291 9.5291 k =-0.4333 0.1552 0.1997 ( 12016 PWs) bands (ev): -3.2463 -3.2463 -3.2462 -3.2462 -2.6163 -2.6163 -2.6163 -2.6163 -2.4270 -2.4270 -2.4269 -2.4269 3.1526 3.1526 3.1526 3.1526 3.9646 3.9646 3.9646 3.9646 4.8687 4.8687 4.8687 4.8687 6.2547 6.2547 6.2547 6.2547 6.8826 6.8826 6.8826 6.8826 7.1547 7.1547 7.1547 7.1547 7.5339 7.5339 7.5339 7.5339 7.7878 7.7878 7.7878 7.7878 8.0521 8.0521 8.0521 8.0521 8.4059 8.4059 8.4059 8.4059 8.8027 8.8027 8.8027 8.8027 9.0701 9.0701 9.0701 9.0701 9.5121 9.5121 9.5121 9.5121 k =-0.4500 0.1612 0.1997 ( 12012 PWs) bands (ev): -3.2129 -3.2129 -3.2128 -3.2128 -2.6172 -2.6172 -2.6172 -2.6172 -2.4605 -2.4605 -2.4604 -2.4604 3.1454 3.1454 3.1454 3.1454 3.9693 3.9693 3.9693 3.9693 4.8372 4.8372 4.8372 4.8372 6.2648 6.2648 6.2648 6.2648 6.8935 6.8935 6.8935 6.8935 7.1617 7.1617 7.1617 7.1617 7.5397 7.5397 7.5397 7.5397 7.7994 7.7994 7.7994 7.7994 8.0544 8.0544 8.0544 8.0544 8.4178 8.4178 8.4178 8.4178 8.8361 8.8361 8.8361 8.8361 9.0673 9.0673 9.0673 9.0673 9.4905 9.4905 9.4905 9.4905 k =-0.4667 0.1672 0.1997 ( 12010 PWs) bands (ev): -3.1864 -3.1864 -3.1863 -3.1863 -2.6205 -2.6205 -2.6205 -2.6205 -2.4845 -2.4845 -2.4844 -2.4844 3.1400 3.1400 3.1400 3.1400 3.9736 3.9736 3.9736 3.9736 4.8136 4.8136 4.8136 4.8136 6.2721 6.2721 6.2721 6.2721 6.9012 6.9012 6.9012 6.9012 7.1668 7.1668 7.1668 7.1668 7.5429 7.5429 7.5429 7.5429 7.8088 7.8088 7.8088 7.8088 8.0555 8.0555 8.0555 8.0555 8.4263 8.4263 8.4263 8.4263 8.8645 8.8645 8.8646 8.8646 9.0654 9.0654 9.0654 9.0654 9.4697 9.4697 9.4697 9.4697 k =-0.4833 0.1731 0.1997 ( 12004 PWs) bands (ev): -3.1691 -3.1691 -3.1691 -3.1691 -2.6243 -2.6243 -2.6243 -2.6243 -2.4984 -2.4984 -2.4983 -2.4983 3.1367 3.1367 3.1367 3.1367 3.9767 3.9767 3.9767 3.9767 4.7990 4.7990 4.7990 4.7990 6.2764 6.2764 6.2764 6.2764 6.9058 6.9058 6.9058 6.9058 7.1698 7.1698 7.1699 7.1699 7.5445 7.5445 7.5445 7.5445 7.8149 7.8149 7.8149 7.8149 8.0559 8.0559 8.0559 8.0559 8.4315 8.4315 8.4315 8.4315 8.8839 8.8839 8.8839 8.8839 9.0643 9.0643 9.0643 9.0643 9.4545 9.4545 9.4545 9.4545 k =-0.5000 0.1791 0.1997 ( 11996 PWs) bands (ev): -3.1631 -3.1631 -3.1631 -3.1631 -2.6260 -2.6260 -2.6260 -2.6260 -2.5028 -2.5028 -2.5028 -2.5028 3.1356 3.1356 3.1356 3.1356 3.9779 3.9779 3.9779 3.9779 4.7941 4.7941 4.7941 4.7941 6.2779 6.2779 6.2779 6.2779 6.9074 6.9074 6.9074 6.9074 7.1709 7.1709 7.1709 7.1709 7.5449 7.5449 7.5449 7.5449 7.8170 7.8170 7.8170 7.8170 8.0560 8.0560 8.0560 8.0560 8.4332 8.4332 8.4332 8.4332 8.8908 8.8908 8.8909 8.8909 9.0640 9.0640 9.0640 9.0640 9.4490 9.4490 9.4490 9.4490 Writing output data file ZrBi.save init_run : 0.43s CPU 0.92s WALL ( 1 calls) electrons : 1335.99s CPU 1348.09s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.05s WALL ( 1 calls) potinit : 0.05s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 1335.99s CPU 1348.08s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 312 calls) cegterg : 1268.64s CPU 1279.70s WALL ( 1400 calls) Called by sum_band: Called by *egterg: h_psi : 816.19s CPU 834.81s WALL ( 27412 calls) g_psi : 1.51s CPU 1.61s WALL ( 25700 calls) cdiaghg : 344.51s CPU 334.78s WALL ( 26012 calls) cegterg:over : 64.23s CPU 60.38s WALL ( 25700 calls) cegterg:upda : 27.32s CPU 35.97s WALL ( 25700 calls) cegterg:last : 17.01s CPU 18.61s WALL ( 3818 calls) Called by h_psi: h_psi:vloc : 747.19s CPU 755.80s WALL ( 27412 calls) h_psi:vnl : 68.75s CPU 78.05s WALL ( 27412 calls) add_vuspsi : 28.74s CPU 34.96s WALL ( 27412 calls) General routines calbec : 39.98s CPU 43.02s WALL ( 27412 calls) fft : 0.02s CPU 0.05s WALL ( 14 calls) fftw : 742.01s CPU 734.02s WALL ( 2936708 calls) davcio : 0.04s CPU 0.21s WALL ( 624 calls) Parallel routines fft_scatter : 685.59s CPU 501.16s WALL ( 2936722 calls) PWSCF : 23m31.00s CPU 24m 0.59s WALL This run was terminated on: 2:23:47 22Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=