Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 14:23:37 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./Be2Cu.save/ file Be.rel-pbe-s-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 106 39 11 4340 974 152 Max 107 40 12 4343 998 154 Sum 3829 1417 421 156301 35557 5521 bravais-lattice index = 14 lattice parameter (alat) = 7.9867 a.u. unit-cell volume = 360.2353 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 38.00 number of Kohn-Sham states= 46 kinetic-energy cutoff = 81.0000 Ry charge density cutoff = 871.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.986695 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Be read from file: /users/gautes/Pseudo/Be.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 56f92c253d4d86db330921f37562b9e7 Pseudo is Ultrasoft, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1041 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Be 4.00 9.01220 Be( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops. (no inversion) found (note: 10 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 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 2) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E s 2 inv. 180 deg rotation - cryst. axis [0,1,0] -s -2 inv. 180 deg rotation - cryst. axis [0,1,0] E Cartesian axes number of k points= 353 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 2) = ( 0.0094340 -0.0054467 0.0077028), wk = 0.0028329 k( 3) = ( 0.0188679 -0.0108934 0.0154056), wk = 0.0028329 k( 4) = ( 0.0283019 -0.0163401 0.0231084), wk = 0.0028329 k( 5) = ( 0.0377359 -0.0217868 0.0308112), wk = 0.0028329 k( 6) = ( 0.0471698 -0.0272335 0.0385140), wk = 0.0028329 k( 7) = ( 0.0566038 -0.0326802 0.0462168), wk = 0.0028329 k( 8) = ( 0.0660377 -0.0381269 0.0539196), wk = 0.0028329 k( 9) = ( 0.0754717 -0.0435736 0.0616224), wk = 0.0028329 k( 10) = ( 0.0849057 -0.0490203 0.0693252), wk = 0.0028329 k( 11) = ( 0.0943396 -0.0544670 0.0770280), wk = 0.0028329 k( 12) = ( 0.1037736 -0.0599137 0.0847308), wk = 0.0028329 k( 13) = ( 0.1132076 -0.0653604 0.0924336), wk = 0.0028329 k( 14) = ( 0.1226415 -0.0708071 0.1001364), wk = 0.0028329 k( 15) = ( 0.1320755 -0.0762538 0.1078392), wk = 0.0028329 k( 16) = ( 0.1415094 -0.0817005 0.1155420), wk = 0.0028329 k( 17) = ( 0.1509434 -0.0871472 0.1232448), wk = 0.0028329 k( 18) = ( 0.1603774 -0.0925939 0.1309476), wk = 0.0028329 k( 19) = ( 0.1698113 -0.0980406 0.1386504), wk = 0.0028329 k( 20) = ( 0.1792453 -0.1034873 0.1463532), wk = 0.0028329 k( 21) = ( 0.1886792 -0.1089340 0.1540560), wk = 0.0028329 k( 22) = ( 0.1981132 -0.1143807 0.1617588), wk = 0.0028329 k( 23) = ( 0.2075472 -0.1198274 0.1694616), wk = 0.0028329 k( 24) = ( 0.2169811 -0.1252741 0.1771644), wk = 0.0028329 k( 25) = ( 0.2264151 -0.1307208 0.1848671), wk = 0.0028329 k( 26) = ( 0.2358491 -0.1361675 0.1925700), wk = 0.0028329 k( 27) = ( 0.2452830 -0.1416142 0.2002727), wk = 0.0028329 k( 28) = ( 0.2547170 -0.1470609 0.2079755), wk = 0.0028329 k( 29) = ( 0.2641509 -0.1525076 0.2156783), wk = 0.0028329 k( 30) = ( 0.2735849 -0.1579543 0.2233811), wk = 0.0028329 k( 31) = ( 0.2830189 -0.1634010 0.2310839), wk = 0.0028329 k( 32) = ( 0.2924528 -0.1688477 0.2387867), wk = 0.0028329 k( 33) = ( 0.3018868 -0.1742944 0.2464895), wk = 0.0028329 k( 34) = ( 0.3113207 -0.1797411 0.2541923), wk = 0.0028329 k( 35) = ( 0.3207547 -0.1851878 0.2618951), wk = 0.0028329 k( 36) = ( 0.3301887 -0.1906345 0.2695979), wk = 0.0028329 k( 37) = ( 0.3396226 -0.1960812 0.2773007), wk = 0.0028329 k( 38) = ( 0.3490566 -0.2015279 0.2850035), wk = 0.0028329 k( 39) = ( 0.3584906 -0.2069746 0.2927063), wk = 0.0028329 k( 40) = ( 0.3679245 -0.2124213 0.3004091), wk = 0.0028329 k( 41) = ( 0.3773585 -0.2178680 0.3081119), wk = 0.0028329 k( 42) = ( 0.3867925 -0.2233147 0.3158147), wk = 0.0028329 k( 43) = ( 0.3962264 -0.2287614 0.3235175), wk = 0.0028329 k( 44) = ( 0.4056604 -0.2342081 0.3312203), wk = 0.0028329 k( 45) = ( 0.4150943 -0.2396548 0.3389231), wk = 0.0028329 k( 46) = ( 0.4245283 -0.2451015 0.3466259), wk = 0.0028329 k( 47) = ( 0.4339623 -0.2505482 0.3543287), wk = 0.0028329 k( 48) = ( 0.4433962 -0.2559949 0.3620315), wk = 0.0028329 k( 49) = ( 0.4528302 -0.2614416 0.3697343), wk = 0.0028329 k( 50) = ( 0.4622641 -0.2668883 0.3774371), wk = 0.0028329 k( 51) = ( 0.4716981 -0.2723350 0.3851399), wk = 0.0028329 k( 52) = ( 0.4811321 -0.2777817 0.3928427), wk = 0.0028329 k( 53) = ( 0.4905660 -0.2832284 0.4005455), wk = 0.0028329 k( 54) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028329 k( 55) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028329 k( 56) = ( 0.5000000 -0.2779835 0.4158084), wk = 0.0028329 k( 57) = ( 0.5000000 -0.2672918 0.4233686), wk = 0.0028329 k( 58) = ( 0.5000000 -0.2566001 0.4309288), wk = 0.0028329 k( 59) = ( 0.5000000 -0.2459084 0.4384889), wk = 0.0028329 k( 60) = ( 0.5000000 -0.2352168 0.4460491), wk = 0.0028329 k( 61) = ( 0.5000000 -0.2245251 0.4536092), wk = 0.0028329 k( 62) = ( 0.5000000 -0.2138334 0.4611694), wk = 0.0028329 k( 63) = ( 0.5000000 -0.2031418 0.4687295), wk = 0.0028329 k( 64) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0028329 k( 65) = ( 0.5000000 -0.1817584 0.4838498), wk = 0.0028329 k( 66) = ( 0.5000000 -0.1710667 0.4914100), wk = 0.0028329 k( 67) = ( 0.5000000 -0.1603751 0.4989701), wk = 0.0028329 k( 68) = ( 0.5000000 -0.1496834 0.5065303), wk = 0.0028329 k( 69) = ( 0.5000000 -0.1389917 0.5140904), wk = 0.0028329 k( 70) = ( 0.5000000 -0.1283001 0.5216506), wk = 0.0028329 k( 71) = ( 0.5000000 -0.1176084 0.5292107), wk = 0.0028329 k( 72) = ( 0.5000000 -0.1069167 0.5367709), wk = 0.0028329 k( 73) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0028329 k( 74) = ( 0.5000000 -0.0855334 0.5518912), wk = 0.0028329 k( 75) = ( 0.5000000 -0.0748417 0.5594514), wk = 0.0028329 k( 76) = ( 0.5000000 -0.0641500 0.5670115), wk = 0.0028329 k( 77) = ( 0.5000000 -0.0534584 0.5745717), wk = 0.0028329 k( 78) = ( 0.5000000 -0.0427667 0.5821318), wk = 0.0028329 k( 79) = ( 0.5000000 -0.0320750 0.5896920), wk = 0.0028329 k( 80) = ( 0.5000000 -0.0213833 0.5972521), wk = 0.0028329 k( 81) = ( 0.5000000 -0.0106917 0.6048123), wk = 0.0028329 k( 82) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0028329 k( 83) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0028329 k( 84) = ( 0.4934211 0.0113951 0.6123724), wk = 0.0028329 k( 85) = ( 0.4868421 0.0227901 0.6123724), wk = 0.0028329 k( 86) = ( 0.4802632 0.0341852 0.6123724), wk = 0.0028329 k( 87) = ( 0.4736842 0.0455803 0.6123724), wk = 0.0028329 k( 88) = ( 0.4671053 0.0569754 0.6123724), wk = 0.0028329 k( 89) = ( 0.4605263 0.0683704 0.6123724), wk = 0.0028329 k( 90) = ( 0.4539474 0.0797655 0.6123724), wk = 0.0028329 k( 91) = ( 0.4473684 0.0911606 0.6123724), wk = 0.0028329 k( 92) = ( 0.4407895 0.1025556 0.6123724), wk = 0.0028329 k( 93) = ( 0.4342105 0.1139507 0.6123724), wk = 0.0028329 k( 94) = ( 0.4276316 0.1253458 0.6123724), wk = 0.0028329 k( 95) = ( 0.4210526 0.1367409 0.6123724), wk = 0.0028329 k( 96) = ( 0.4144737 0.1481359 0.6123724), wk = 0.0028329 k( 97) = ( 0.4078947 0.1595310 0.6123724), wk = 0.0028329 k( 98) = ( 0.4013158 0.1709261 0.6123724), wk = 0.0028329 k( 99) = ( 0.3947368 0.1823211 0.6123724), wk = 0.0028329 k( 100) = ( 0.3881579 0.1937162 0.6123724), wk = 0.0028329 k( 101) = ( 0.3815789 0.2051113 0.6123724), wk = 0.0028329 k( 102) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028329 k( 103) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028329 k( 104) = ( 0.3683036 0.2126402 0.6014372), wk = 0.0028329 k( 105) = ( 0.3616071 0.2087740 0.5905020), wk = 0.0028329 k( 106) = ( 0.3549107 0.2049078 0.5795668), wk = 0.0028329 k( 107) = ( 0.3482143 0.2010416 0.5686315), wk = 0.0028329 k( 108) = ( 0.3415179 0.1971754 0.5576963), wk = 0.0028329 k( 109) = ( 0.3348214 0.1933092 0.5467611), wk = 0.0028329 k( 110) = ( 0.3281250 0.1894431 0.5358259), wk = 0.0028329 k( 111) = ( 0.3214286 0.1855769 0.5248907), wk = 0.0028329 k( 112) = ( 0.3147321 0.1817107 0.5139554), wk = 0.0028329 k( 113) = ( 0.3080357 0.1778445 0.5030202), wk = 0.0028329 k( 114) = ( 0.3013393 0.1739783 0.4920850), wk = 0.0028329 k( 115) = ( 0.2946429 0.1701121 0.4811498), wk = 0.0028329 k( 116) = ( 0.2879464 0.1662459 0.4702146), wk = 0.0028329 k( 117) = ( 0.2812500 0.1623798 0.4592793), wk = 0.0028329 k( 118) = ( 0.2745536 0.1585136 0.4483441), wk = 0.0028329 k( 119) = ( 0.2678571 0.1546474 0.4374089), wk = 0.0028329 k( 120) = ( 0.2611607 0.1507812 0.4264737), wk = 0.0028329 k( 121) = ( 0.2544643 0.1469150 0.4155384), wk = 0.0028329 k( 122) = ( 0.2477679 0.1430488 0.4046032), wk = 0.0028329 k( 123) = ( 0.2410714 0.1391827 0.3936680), wk = 0.0028329 k( 124) = ( 0.2343750 0.1353165 0.3827328), wk = 0.0028329 k( 125) = ( 0.2276786 0.1314503 0.3717975), wk = 0.0028329 k( 126) = ( 0.2209821 0.1275841 0.3608623), wk = 0.0028329 k( 127) = ( 0.2142857 0.1237179 0.3499271), wk = 0.0028329 k( 128) = ( 0.2075893 0.1198517 0.3389919), wk = 0.0028329 k( 129) = ( 0.2008929 0.1159855 0.3280567), wk = 0.0028329 k( 130) = ( 0.1941964 0.1121194 0.3171214), wk = 0.0028329 k( 131) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0028329 k( 132) = ( 0.1808036 0.1043870 0.2952510), wk = 0.0028329 k( 133) = ( 0.1741071 0.1005208 0.2843158), wk = 0.0028329 k( 134) = ( 0.1674107 0.0966546 0.2733806), wk = 0.0028329 k( 135) = ( 0.1607143 0.0927884 0.2624453), wk = 0.0028329 k( 136) = ( 0.1540179 0.0889223 0.2515101), wk = 0.0028329 k( 137) = ( 0.1473214 0.0850561 0.2405749), wk = 0.0028329 k( 138) = ( 0.1406250 0.0811899 0.2296397), wk = 0.0028329 k( 139) = ( 0.1339286 0.0773237 0.2187044), wk = 0.0028329 k( 140) = ( 0.1272321 0.0734575 0.2077692), wk = 0.0028329 k( 141) = ( 0.1205357 0.0695913 0.1968340), wk = 0.0028329 k( 142) = ( 0.1138393 0.0657251 0.1858988), wk = 0.0028329 k( 143) = ( 0.1071429 0.0618590 0.1749635), wk = 0.0028329 k( 144) = ( 0.1004464 0.0579928 0.1640283), wk = 0.0028329 k( 145) = ( 0.0937500 0.0541266 0.1530931), wk = 0.0028329 k( 146) = ( 0.0870536 0.0502604 0.1421579), wk = 0.0028329 k( 147) = ( 0.0803571 0.0463942 0.1312227), wk = 0.0028329 k( 148) = ( 0.0736607 0.0425280 0.1202874), wk = 0.0028329 k( 149) = ( 0.0669643 0.0386619 0.1093522), wk = 0.0028329 k( 150) = ( 0.0602679 0.0347957 0.0984170), wk = 0.0028329 k( 151) = ( 0.0535714 0.0309295 0.0874818), wk = 0.0028329 k( 152) = ( 0.0468750 0.0270633 0.0765466), wk = 0.0028329 k( 153) = ( 0.0401786 0.0231971 0.0656113), wk = 0.0028329 k( 154) = ( 0.0334821 0.0193309 0.0546761), wk = 0.0028329 k( 155) = ( 0.0267857 0.0154647 0.0437409), wk = 0.0028329 k( 156) = ( 0.0200893 0.0115986 0.0328057), wk = 0.0028329 k( 157) = ( 0.0133929 0.0077324 0.0218704), wk = 0.0028329 k( 158) = ( 0.0066964 0.0038662 0.0109352), wk = 0.0028329 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 161) = ( 0.0108696 0.0062755 0.0044375), wk = 0.0028329 k( 162) = ( 0.0217391 0.0125511 0.0088750), wk = 0.0028329 k( 163) = ( 0.0326087 0.0188266 0.0133124), wk = 0.0028329 k( 164) = ( 0.0434783 0.0251022 0.0177499), wk = 0.0028329 k( 165) = ( 0.0543478 0.0313777 0.0221874), wk = 0.0028329 k( 166) = ( 0.0652174 0.0376533 0.0266249), wk = 0.0028329 k( 167) = ( 0.0760870 0.0439288 0.0310624), wk = 0.0028329 k( 168) = ( 0.0869565 0.0502044 0.0354999), wk = 0.0028329 k( 169) = ( 0.0978261 0.0564799 0.0399373), wk = 0.0028329 k( 170) = ( 0.1086957 0.0627555 0.0443748), wk = 0.0028329 k( 171) = ( 0.1195652 0.0690310 0.0488123), wk = 0.0028329 k( 172) = ( 0.1304348 0.0753066 0.0532498), wk = 0.0028329 k( 173) = ( 0.1413043 0.0815821 0.0576873), wk = 0.0028329 k( 174) = ( 0.1521739 0.0878576 0.0621247), wk = 0.0028329 k( 175) = ( 0.1630435 0.0941332 0.0665622), wk = 0.0028329 k( 176) = ( 0.1739130 0.1004087 0.0709997), wk = 0.0028329 k( 177) = ( 0.1847826 0.1066843 0.0754372), wk = 0.0028329 k( 178) = ( 0.1956522 0.1129598 0.0798747), wk = 0.0028329 k( 179) = ( 0.2065217 0.1192354 0.0843121), wk = 0.0028329 k( 180) = ( 0.2173913 0.1255109 0.0887496), wk = 0.0028329 k( 181) = ( 0.2282609 0.1317865 0.0931871), wk = 0.0028329 k( 182) = ( 0.2391304 0.1380620 0.0976246), wk = 0.0028329 k( 183) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0028329 k( 184) = ( 0.2608696 0.1506131 0.1064996), wk = 0.0028329 k( 185) = ( 0.2717391 0.1568887 0.1109370), wk = 0.0028329 k( 186) = ( 0.2826087 0.1631642 0.1153745), wk = 0.0028329 k( 187) = ( 0.2934783 0.1694398 0.1198120), wk = 0.0028329 k( 188) = ( 0.3043478 0.1757153 0.1242495), wk = 0.0028329 k( 189) = ( 0.3152174 0.1819908 0.1286870), wk = 0.0028329 k( 190) = ( 0.3260870 0.1882664 0.1331244), wk = 0.0028329 k( 191) = ( 0.3369565 0.1945419 0.1375619), wk = 0.0028329 k( 192) = ( 0.3478261 0.2008175 0.1419994), wk = 0.0028329 k( 193) = ( 0.3586956 0.2070930 0.1464369), wk = 0.0028329 k( 194) = ( 0.3695652 0.2133686 0.1508744), wk = 0.0028329 k( 195) = ( 0.3804348 0.2196441 0.1553118), wk = 0.0028329 k( 196) = ( 0.3913044 0.2259197 0.1597493), wk = 0.0028329 k( 197) = ( 0.4021739 0.2321952 0.1641868), wk = 0.0028329 k( 198) = ( 0.4130435 0.2384708 0.1686243), wk = 0.0028329 k( 199) = ( 0.4239130 0.2447463 0.1730618), wk = 0.0028329 k( 200) = ( 0.4347826 0.2510219 0.1774993), wk = 0.0028329 k( 201) = ( 0.4456522 0.2572974 0.1819367), wk = 0.0028329 k( 202) = ( 0.4565217 0.2635729 0.1863742), wk = 0.0028329 k( 203) = ( 0.4673913 0.2698485 0.1908117), wk = 0.0028329 k( 204) = ( 0.4782609 0.2761240 0.1952492), wk = 0.0028329 k( 205) = ( 0.4891304 0.2823996 0.1996867), wk = 0.0028329 k( 206) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028329 k( 207) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028329 k( 208) = ( 0.5037879 0.2777405 0.2103097), wk = 0.0028329 k( 209) = ( 0.5075758 0.2668058 0.2164953), wk = 0.0028329 k( 210) = ( 0.5113636 0.2558711 0.2226809), wk = 0.0028329 k( 211) = ( 0.5151515 0.2449365 0.2288665), wk = 0.0028329 k( 212) = ( 0.5189394 0.2340018 0.2350520), wk = 0.0028329 k( 213) = ( 0.5227273 0.2230671 0.2412376), wk = 0.0028329 k( 214) = ( 0.5265152 0.2121325 0.2474232), wk = 0.0028329 k( 215) = ( 0.5303030 0.2011978 0.2536088), wk = 0.0028329 k( 216) = ( 0.5340909 0.1902632 0.2597944), wk = 0.0028329 k( 217) = ( 0.5378788 0.1793285 0.2659800), wk = 0.0028329 k( 218) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0028329 k( 219) = ( 0.5454545 0.1574592 0.2783511), wk = 0.0028329 k( 220) = ( 0.5492424 0.1465245 0.2845367), wk = 0.0028329 k( 221) = ( 0.5530303 0.1355898 0.2907223), wk = 0.0028329 k( 222) = ( 0.5568182 0.1246552 0.2969078), wk = 0.0028329 k( 223) = ( 0.5606061 0.1137205 0.3030934), wk = 0.0028329 k( 224) = ( 0.5643939 0.1027858 0.3092790), wk = 0.0028329 k( 225) = ( 0.5681818 0.0918512 0.3154646), wk = 0.0028329 k( 226) = ( 0.5719697 0.0809165 0.3216502), wk = 0.0028329 k( 227) = ( 0.5757576 0.0699819 0.3278358), wk = 0.0028329 k( 228) = ( 0.5795455 0.0590472 0.3340213), wk = 0.0028329 k( 229) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0028329 k( 230) = ( 0.5871212 0.0371779 0.3463925), wk = 0.0028329 k( 231) = ( 0.5909091 0.0262432 0.3525781), wk = 0.0028329 k( 232) = ( 0.5946970 0.0153085 0.3587636), wk = 0.0028329 k( 233) = ( 0.5984848 0.0043739 0.3649492), wk = 0.0028329 k( 234) = ( 0.6022727 -0.0065608 0.3711348), wk = 0.0028329 k( 235) = ( 0.6060606 -0.0174955 0.3773204), wk = 0.0028329 k( 236) = ( 0.6098485 -0.0284301 0.3835060), wk = 0.0028329 k( 237) = ( 0.6136364 -0.0393648 0.3896915), wk = 0.0028329 k( 238) = ( 0.6174242 -0.0502994 0.3958771), wk = 0.0028329 k( 239) = ( 0.6212121 -0.0612341 0.4020627), wk = 0.0028329 k( 240) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028329 k( 241) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028329 k( 242) = ( 0.6184211 -0.0683704 0.4189917), wk = 0.0028329 k( 243) = ( 0.6118421 -0.0645721 0.4297350), wk = 0.0028329 k( 244) = ( 0.6052632 -0.0607737 0.4404784), wk = 0.0028329 k( 245) = ( 0.5986842 -0.0569754 0.4512218), wk = 0.0028329 k( 246) = ( 0.5921053 -0.0531770 0.4619652), wk = 0.0028329 k( 247) = ( 0.5855263 -0.0493786 0.4727085), wk = 0.0028329 k( 248) = ( 0.5789474 -0.0455803 0.4834519), wk = 0.0028329 k( 249) = ( 0.5723684 -0.0417819 0.4941953), wk = 0.0028329 k( 250) = ( 0.5657895 -0.0379836 0.5049387), wk = 0.0028329 k( 251) = ( 0.5592105 -0.0341852 0.5156820), wk = 0.0028329 k( 252) = ( 0.5526316 -0.0303869 0.5264254), wk = 0.0028329 k( 253) = ( 0.5460526 -0.0265885 0.5371688), wk = 0.0028329 k( 254) = ( 0.5394737 -0.0227901 0.5479122), wk = 0.0028329 k( 255) = ( 0.5328947 -0.0189918 0.5586556), wk = 0.0028329 k( 256) = ( 0.5263158 -0.0151934 0.5693989), wk = 0.0028329 k( 257) = ( 0.5197368 -0.0113951 0.5801423), wk = 0.0028329 k( 258) = ( 0.5131579 -0.0075967 0.5908857), wk = 0.0028329 k( 259) = ( 0.5065789 -0.0037984 0.6016291), wk = 0.0028329 k( 260) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0028329 k( 261) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0028329 k( 262) = ( 0.5000000 0.0075967 0.6016291), wk = 0.0028329 k( 263) = ( 0.5000000 0.0151934 0.5908857), wk = 0.0028329 k( 264) = ( 0.5000000 0.0227901 0.5801423), wk = 0.0028329 k( 265) = ( 0.5000000 0.0303869 0.5693989), wk = 0.0028329 k( 266) = ( 0.5000000 0.0379836 0.5586556), wk = 0.0028329 k( 267) = ( 0.5000000 0.0455803 0.5479122), wk = 0.0028329 k( 268) = ( 0.5000000 0.0531770 0.5371688), wk = 0.0028329 k( 269) = ( 0.5000000 0.0607737 0.5264254), wk = 0.0028329 k( 270) = ( 0.5000000 0.0683704 0.5156820), wk = 0.0028329 k( 271) = ( 0.5000000 0.0759671 0.5049387), wk = 0.0028329 k( 272) = ( 0.5000000 0.0835639 0.4941953), wk = 0.0028329 k( 273) = ( 0.5000000 0.0911606 0.4834519), wk = 0.0028329 k( 274) = ( 0.5000000 0.0987573 0.4727085), wk = 0.0028329 k( 275) = ( 0.5000000 0.1063540 0.4619652), wk = 0.0028329 k( 276) = ( 0.5000000 0.1139507 0.4512218), wk = 0.0028329 k( 277) = ( 0.5000000 0.1215474 0.4404784), wk = 0.0028329 k( 278) = ( 0.5000000 0.1291441 0.4297350), wk = 0.0028329 k( 279) = ( 0.5000000 0.1367409 0.4189917), wk = 0.0028329 k( 280) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0028329 k( 281) = ( 0.5000000 0.1519343 0.3975049), wk = 0.0028329 k( 282) = ( 0.5000000 0.1595310 0.3867615), wk = 0.0028329 k( 283) = ( 0.5000000 0.1671277 0.3760182), wk = 0.0028329 k( 284) = ( 0.5000000 0.1747244 0.3652748), wk = 0.0028329 k( 285) = ( 0.5000000 0.1823211 0.3545314), wk = 0.0028329 k( 286) = ( 0.5000000 0.1899178 0.3437880), wk = 0.0028329 k( 287) = ( 0.5000000 0.1975146 0.3330447), wk = 0.0028329 k( 288) = ( 0.5000000 0.2051113 0.3223013), wk = 0.0028329 k( 289) = ( 0.5000000 0.2127080 0.3115579), wk = 0.0028329 k( 290) = ( 0.5000000 0.2203047 0.3008145), wk = 0.0028329 k( 291) = ( 0.5000000 0.2279014 0.2900712), wk = 0.0028329 k( 292) = ( 0.5000000 0.2354981 0.2793278), wk = 0.0028329 k( 293) = ( 0.5000000 0.2430949 0.2685844), wk = 0.0028329 k( 294) = ( 0.5000000 0.2506916 0.2578410), wk = 0.0028329 k( 295) = ( 0.5000000 0.2582883 0.2470977), wk = 0.0028329 k( 296) = ( 0.5000000 0.2658850 0.2363543), wk = 0.0028329 k( 297) = ( 0.5000000 0.2734817 0.2256109), wk = 0.0028329 k( 298) = ( 0.5000000 0.2810784 0.2148675), wk = 0.0028329 k( 299) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028329 k( 300) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028329 k( 301) = ( 0.4962121 0.2864882 0.2164953), wk = 0.0028329 k( 302) = ( 0.4924242 0.2843013 0.2288665), wk = 0.0028329 k( 303) = ( 0.4886364 0.2821143 0.2412376), wk = 0.0028329 k( 304) = ( 0.4848485 0.2799274 0.2536088), wk = 0.0028329 k( 305) = ( 0.4810606 0.2777405 0.2659799), wk = 0.0028329 k( 306) = ( 0.4772727 0.2755535 0.2783511), wk = 0.0028329 k( 307) = ( 0.4734849 0.2733666 0.2907223), wk = 0.0028329 k( 308) = ( 0.4696970 0.2711797 0.3030934), wk = 0.0028329 k( 309) = ( 0.4659091 0.2689927 0.3154646), wk = 0.0028329 k( 310) = ( 0.4621212 0.2668058 0.3278358), wk = 0.0028329 k( 311) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0028329 k( 312) = ( 0.4545455 0.2624319 0.3525781), wk = 0.0028329 k( 313) = ( 0.4507576 0.2602450 0.3649492), wk = 0.0028329 k( 314) = ( 0.4469697 0.2580581 0.3773204), wk = 0.0028329 k( 315) = ( 0.4431818 0.2558711 0.3896915), wk = 0.0028329 k( 316) = ( 0.4393939 0.2536842 0.4020627), wk = 0.0028329 k( 317) = ( 0.4356061 0.2514973 0.4144339), wk = 0.0028329 k( 318) = ( 0.4318182 0.2493103 0.4268050), wk = 0.0028329 k( 319) = ( 0.4280303 0.2471234 0.4391762), wk = 0.0028329 k( 320) = ( 0.4242424 0.2449365 0.4515474), wk = 0.0028329 k( 321) = ( 0.4204545 0.2427495 0.4639185), wk = 0.0028329 k( 322) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0028329 k( 323) = ( 0.4128788 0.2383757 0.4886608), wk = 0.0028329 k( 324) = ( 0.4090909 0.2361887 0.5010320), wk = 0.0028329 k( 325) = ( 0.4053030 0.2340018 0.5134032), wk = 0.0028329 k( 326) = ( 0.4015151 0.2318149 0.5257743), wk = 0.0028329 k( 327) = ( 0.3977273 0.2296279 0.5381455), wk = 0.0028329 k( 328) = ( 0.3939394 0.2274410 0.5505166), wk = 0.0028329 k( 329) = ( 0.3901515 0.2252541 0.5628878), wk = 0.0028329 k( 330) = ( 0.3863636 0.2230672 0.5752590), wk = 0.0028329 k( 331) = ( 0.3825758 0.2208802 0.5876301), wk = 0.0028329 k( 332) = ( 0.3787879 0.2186933 0.6000013), wk = 0.0028329 k( 333) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028329 k( 334) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028329 k( 335) = ( 0.6184211 -0.0835638 0.4082483), wk = 0.0028329 k( 336) = ( 0.6118421 -0.0949589 0.4082483), wk = 0.0028329 k( 337) = ( 0.6052632 -0.1063540 0.4082483), wk = 0.0028329 k( 338) = ( 0.5986842 -0.1177491 0.4082483), wk = 0.0028329 k( 339) = ( 0.5921053 -0.1291441 0.4082483), wk = 0.0028329 k( 340) = ( 0.5855263 -0.1405392 0.4082483), wk = 0.0028329 k( 341) = ( 0.5789474 -0.1519343 0.4082483), wk = 0.0028329 k( 342) = ( 0.5723684 -0.1633294 0.4082483), wk = 0.0028329 k( 343) = ( 0.5657895 -0.1747244 0.4082483), wk = 0.0028329 k( 344) = ( 0.5592105 -0.1861195 0.4082483), wk = 0.0028329 k( 345) = ( 0.5526316 -0.1975146 0.4082483), wk = 0.0028329 k( 346) = ( 0.5460526 -0.2089096 0.4082483), wk = 0.0028329 k( 347) = ( 0.5394737 -0.2203047 0.4082483), wk = 0.0028329 k( 348) = ( 0.5328947 -0.2316998 0.4082483), wk = 0.0028329 k( 349) = ( 0.5263158 -0.2430948 0.4082483), wk = 0.0028329 k( 350) = ( 0.5197368 -0.2544899 0.4082483), wk = 0.0028329 k( 351) = ( 0.5131579 -0.2658850 0.4082483), wk = 0.0028329 k( 352) = ( 0.5065789 -0.2772801 0.4082483), wk = 0.0028329 k( 353) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028329 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 2) = ( 0.0094340 -0.0000000 0.0094340), wk = 0.0028329 k( 3) = ( 0.0188679 -0.0000000 0.0188679), wk = 0.0028329 k( 4) = ( 0.0283019 -0.0000000 0.0283019), wk = 0.0028329 k( 5) = ( 0.0377359 -0.0000000 0.0377359), wk = 0.0028329 k( 6) = ( 0.0471698 -0.0000000 0.0471698), wk = 0.0028329 k( 7) = ( 0.0566038 -0.0000000 0.0566038), wk = 0.0028329 k( 8) = ( 0.0660377 -0.0000000 0.0660377), wk = 0.0028329 k( 9) = ( 0.0754717 -0.0000000 0.0754717), wk = 0.0028329 k( 10) = ( 0.0849057 -0.0000000 0.0849057), wk = 0.0028329 k( 11) = ( 0.0943396 -0.0000000 0.0943396), wk = 0.0028329 k( 12) = ( 0.1037736 -0.0000000 0.1037736), wk = 0.0028329 k( 13) = ( 0.1132076 -0.0000000 0.1132076), wk = 0.0028329 k( 14) = ( 0.1226415 -0.0000000 0.1226415), wk = 0.0028329 k( 15) = ( 0.1320755 -0.0000000 0.1320755), wk = 0.0028329 k( 16) = ( 0.1415094 -0.0000000 0.1415094), wk = 0.0028329 k( 17) = ( 0.1509434 -0.0000000 0.1509434), wk = 0.0028329 k( 18) = ( 0.1603774 -0.0000000 0.1603774), wk = 0.0028329 k( 19) = ( 0.1698113 -0.0000000 0.1698113), wk = 0.0028329 k( 20) = ( 0.1792453 -0.0000000 0.1792453), wk = 0.0028329 k( 21) = ( 0.1886792 -0.0000000 0.1886793), wk = 0.0028329 k( 22) = ( 0.1981132 -0.0000000 0.1981132), wk = 0.0028329 k( 23) = ( 0.2075472 -0.0000000 0.2075472), wk = 0.0028329 k( 24) = ( 0.2169811 -0.0000000 0.2169811), wk = 0.0028329 k( 25) = ( 0.2264151 -0.0000000 0.2264151), wk = 0.0028329 k( 26) = ( 0.2358491 -0.0000000 0.2358491), wk = 0.0028329 k( 27) = ( 0.2452830 -0.0000000 0.2452830), wk = 0.0028329 k( 28) = ( 0.2547170 -0.0000000 0.2547170), wk = 0.0028329 k( 29) = ( 0.2641509 -0.0000000 0.2641509), wk = 0.0028329 k( 30) = ( 0.2735849 -0.0000000 0.2735849), wk = 0.0028329 k( 31) = ( 0.2830189 -0.0000000 0.2830189), wk = 0.0028329 k( 32) = ( 0.2924528 -0.0000000 0.2924528), wk = 0.0028329 k( 33) = ( 0.3018868 -0.0000000 0.3018868), wk = 0.0028329 k( 34) = ( 0.3113207 -0.0000000 0.3113207), wk = 0.0028329 k( 35) = ( 0.3207547 -0.0000000 0.3207547), wk = 0.0028329 k( 36) = ( 0.3301887 -0.0000000 0.3301887), wk = 0.0028329 k( 37) = ( 0.3396226 -0.0000000 0.3396226), wk = 0.0028329 k( 38) = ( 0.3490566 -0.0000000 0.3490566), wk = 0.0028329 k( 39) = ( 0.3584906 -0.0000000 0.3584906), wk = 0.0028329 k( 40) = ( 0.3679245 -0.0000000 0.3679245), wk = 0.0028329 k( 41) = ( 0.3773585 -0.0000000 0.3773585), wk = 0.0028329 k( 42) = ( 0.3867925 -0.0000000 0.3867924), wk = 0.0028329 k( 43) = ( 0.3962264 -0.0000000 0.3962264), wk = 0.0028329 k( 44) = ( 0.4056604 -0.0000000 0.4056604), wk = 0.0028329 k( 45) = ( 0.4150943 -0.0000000 0.4150943), wk = 0.0028329 k( 46) = ( 0.4245283 -0.0000000 0.4245283), wk = 0.0028329 k( 47) = ( 0.4339623 -0.0000000 0.4339623), wk = 0.0028329 k( 48) = ( 0.4433962 -0.0000000 0.4433962), wk = 0.0028329 k( 49) = ( 0.4528302 -0.0000000 0.4528302), wk = 0.0028329 k( 50) = ( 0.4622641 -0.0000000 0.4622641), wk = 0.0028329 k( 51) = ( 0.4716981 -0.0000000 0.4716981), wk = 0.0028329 k( 52) = ( 0.4811321 -0.0000000 0.4811321), wk = 0.0028329 k( 53) = ( 0.4905660 -0.0000000 0.4905660), wk = 0.0028329 k( 54) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0028329 k( 55) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0028329 k( 56) = ( 0.5000000 0.0092593 0.5092593), wk = 0.0028329 k( 57) = ( 0.5000000 0.0185185 0.5185185), wk = 0.0028329 k( 58) = ( 0.5000000 0.0277778 0.5277778), wk = 0.0028329 k( 59) = ( 0.5000000 0.0370370 0.5370370), wk = 0.0028329 k( 60) = ( 0.5000000 0.0462963 0.5462963), wk = 0.0028329 k( 61) = ( 0.5000000 0.0555556 0.5555556), wk = 0.0028329 k( 62) = ( 0.5000000 0.0648148 0.5648148), wk = 0.0028329 k( 63) = ( 0.5000000 0.0740741 0.5740741), wk = 0.0028329 k( 64) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0028329 k( 65) = ( 0.5000000 0.0925926 0.5925926), wk = 0.0028329 k( 66) = ( 0.5000000 0.1018518 0.6018518), wk = 0.0028329 k( 67) = ( 0.5000000 0.1111111 0.6111111), wk = 0.0028329 k( 68) = ( 0.5000000 0.1203704 0.6203704), wk = 0.0028329 k( 69) = ( 0.5000000 0.1296296 0.6296296), wk = 0.0028329 k( 70) = ( 0.5000000 0.1388889 0.6388889), wk = 0.0028329 k( 71) = ( 0.5000000 0.1481481 0.6481482), wk = 0.0028329 k( 72) = ( 0.5000000 0.1574074 0.6574074), wk = 0.0028329 k( 73) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0028329 k( 74) = ( 0.5000000 0.1759259 0.6759259), wk = 0.0028329 k( 75) = ( 0.5000000 0.1851852 0.6851852), wk = 0.0028329 k( 76) = ( 0.5000000 0.1944444 0.6944444), wk = 0.0028329 k( 77) = ( 0.5000000 0.2037037 0.7037037), wk = 0.0028329 k( 78) = ( 0.5000000 0.2129630 0.7129630), wk = 0.0028329 k( 79) = ( 0.5000000 0.2222222 0.7222222), wk = 0.0028329 k( 80) = ( 0.5000000 0.2314815 0.7314815), wk = 0.0028329 k( 81) = ( 0.5000000 0.2407407 0.7407407), wk = 0.0028329 k( 82) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028329 k( 83) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028329 k( 84) = ( 0.4934211 0.2565789 0.7500000), wk = 0.0028329 k( 85) = ( 0.4868421 0.2631579 0.7500000), wk = 0.0028329 k( 86) = ( 0.4802632 0.2697368 0.7500000), wk = 0.0028329 k( 87) = ( 0.4736842 0.2763158 0.7500000), wk = 0.0028329 k( 88) = ( 0.4671053 0.2828947 0.7500000), wk = 0.0028329 k( 89) = ( 0.4605263 0.2894737 0.7500000), wk = 0.0028329 k( 90) = ( 0.4539474 0.2960526 0.7500000), wk = 0.0028329 k( 91) = ( 0.4473684 0.3026316 0.7500000), wk = 0.0028329 k( 92) = ( 0.4407895 0.3092105 0.7500000), wk = 0.0028329 k( 93) = ( 0.4342105 0.3157895 0.7500000), wk = 0.0028329 k( 94) = ( 0.4276316 0.3223684 0.7500000), wk = 0.0028329 k( 95) = ( 0.4210526 0.3289474 0.7500000), wk = 0.0028329 k( 96) = ( 0.4144737 0.3355263 0.7500000), wk = 0.0028329 k( 97) = ( 0.4078947 0.3421053 0.7500000), wk = 0.0028329 k( 98) = ( 0.4013158 0.3486842 0.7500000), wk = 0.0028329 k( 99) = ( 0.3947368 0.3552632 0.7500000), wk = 0.0028329 k( 100) = ( 0.3881579 0.3618421 0.7500000), wk = 0.0028329 k( 101) = ( 0.3815789 0.3684211 0.7500000), wk = 0.0028329 k( 102) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028329 k( 103) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028329 k( 104) = ( 0.3683036 0.3683036 0.7366071), wk = 0.0028329 k( 105) = ( 0.3616071 0.3616071 0.7232143), wk = 0.0028329 k( 106) = ( 0.3549107 0.3549107 0.7098214), wk = 0.0028329 k( 107) = ( 0.3482143 0.3482143 0.6964286), wk = 0.0028329 k( 108) = ( 0.3415179 0.3415179 0.6830357), wk = 0.0028329 k( 109) = ( 0.3348214 0.3348214 0.6696429), wk = 0.0028329 k( 110) = ( 0.3281250 0.3281250 0.6562500), wk = 0.0028329 k( 111) = ( 0.3214286 0.3214286 0.6428571), wk = 0.0028329 k( 112) = ( 0.3147321 0.3147321 0.6294643), wk = 0.0028329 k( 113) = ( 0.3080357 0.3080357 0.6160714), wk = 0.0028329 k( 114) = ( 0.3013393 0.3013393 0.6026786), wk = 0.0028329 k( 115) = ( 0.2946429 0.2946429 0.5892857), wk = 0.0028329 k( 116) = ( 0.2879464 0.2879464 0.5758929), wk = 0.0028329 k( 117) = ( 0.2812500 0.2812500 0.5625000), wk = 0.0028329 k( 118) = ( 0.2745536 0.2745536 0.5491071), wk = 0.0028329 k( 119) = ( 0.2678571 0.2678571 0.5357143), wk = 0.0028329 k( 120) = ( 0.2611607 0.2611607 0.5223214), wk = 0.0028329 k( 121) = ( 0.2544643 0.2544643 0.5089286), wk = 0.0028329 k( 122) = ( 0.2477679 0.2477679 0.4955357), wk = 0.0028329 k( 123) = ( 0.2410714 0.2410714 0.4821429), wk = 0.0028329 k( 124) = ( 0.2343750 0.2343750 0.4687500), wk = 0.0028329 k( 125) = ( 0.2276786 0.2276786 0.4553571), wk = 0.0028329 k( 126) = ( 0.2209821 0.2209821 0.4419643), wk = 0.0028329 k( 127) = ( 0.2142857 0.2142857 0.4285714), wk = 0.0028329 k( 128) = ( 0.2075893 0.2075893 0.4151786), wk = 0.0028329 k( 129) = ( 0.2008929 0.2008929 0.4017857), wk = 0.0028329 k( 130) = ( 0.1941964 0.1941964 0.3883929), wk = 0.0028329 k( 131) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0028329 k( 132) = ( 0.1808036 0.1808036 0.3616071), wk = 0.0028329 k( 133) = ( 0.1741071 0.1741071 0.3482143), wk = 0.0028329 k( 134) = ( 0.1674107 0.1674107 0.3348214), wk = 0.0028329 k( 135) = ( 0.1607143 0.1607143 0.3214286), wk = 0.0028329 k( 136) = ( 0.1540179 0.1540179 0.3080357), wk = 0.0028329 k( 137) = ( 0.1473214 0.1473214 0.2946429), wk = 0.0028329 k( 138) = ( 0.1406250 0.1406250 0.2812500), wk = 0.0028329 k( 139) = ( 0.1339286 0.1339286 0.2678571), wk = 0.0028329 k( 140) = ( 0.1272321 0.1272321 0.2544643), wk = 0.0028329 k( 141) = ( 0.1205357 0.1205357 0.2410714), wk = 0.0028329 k( 142) = ( 0.1138393 0.1138393 0.2276786), wk = 0.0028329 k( 143) = ( 0.1071429 0.1071429 0.2142857), wk = 0.0028329 k( 144) = ( 0.1004464 0.1004464 0.2008929), wk = 0.0028329 k( 145) = ( 0.0937500 0.0937500 0.1875000), wk = 0.0028329 k( 146) = ( 0.0870536 0.0870536 0.1741071), wk = 0.0028329 k( 147) = ( 0.0803571 0.0803571 0.1607143), wk = 0.0028329 k( 148) = ( 0.0736607 0.0736607 0.1473214), wk = 0.0028329 k( 149) = ( 0.0669643 0.0669643 0.1339286), wk = 0.0028329 k( 150) = ( 0.0602679 0.0602679 0.1205357), wk = 0.0028329 k( 151) = ( 0.0535714 0.0535714 0.1071429), wk = 0.0028329 k( 152) = ( 0.0468750 0.0468750 0.0937500), wk = 0.0028329 k( 153) = ( 0.0401786 0.0401786 0.0803571), wk = 0.0028329 k( 154) = ( 0.0334821 0.0334821 0.0669643), wk = 0.0028329 k( 155) = ( 0.0267857 0.0267857 0.0535714), wk = 0.0028329 k( 156) = ( 0.0200893 0.0200893 0.0401786), wk = 0.0028329 k( 157) = ( 0.0133929 0.0133929 0.0267857), wk = 0.0028329 k( 158) = ( 0.0066964 0.0066964 0.0133929), wk = 0.0028329 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 161) = ( 0.0108696 0.0108696 0.0108696), wk = 0.0028329 k( 162) = ( 0.0217391 0.0217391 0.0217391), wk = 0.0028329 k( 163) = ( 0.0326087 0.0326087 0.0326087), wk = 0.0028329 k( 164) = ( 0.0434783 0.0434783 0.0434783), wk = 0.0028329 k( 165) = ( 0.0543478 0.0543478 0.0543478), wk = 0.0028329 k( 166) = ( 0.0652174 0.0652174 0.0652174), wk = 0.0028329 k( 167) = ( 0.0760870 0.0760870 0.0760870), wk = 0.0028329 k( 168) = ( 0.0869565 0.0869565 0.0869565), wk = 0.0028329 k( 169) = ( 0.0978261 0.0978261 0.0978261), wk = 0.0028329 k( 170) = ( 0.1086957 0.1086956 0.1086957), wk = 0.0028329 k( 171) = ( 0.1195652 0.1195652 0.1195652), wk = 0.0028329 k( 172) = ( 0.1304348 0.1304348 0.1304348), wk = 0.0028329 k( 173) = ( 0.1413043 0.1413043 0.1413043), wk = 0.0028329 k( 174) = ( 0.1521739 0.1521739 0.1521739), wk = 0.0028329 k( 175) = ( 0.1630435 0.1630435 0.1630435), wk = 0.0028329 k( 176) = ( 0.1739130 0.1739130 0.1739130), wk = 0.0028329 k( 177) = ( 0.1847826 0.1847826 0.1847826), wk = 0.0028329 k( 178) = ( 0.1956522 0.1956522 0.1956522), wk = 0.0028329 k( 179) = ( 0.2065217 0.2065217 0.2065217), wk = 0.0028329 k( 180) = ( 0.2173913 0.2173913 0.2173913), wk = 0.0028329 k( 181) = ( 0.2282609 0.2282609 0.2282609), wk = 0.0028329 k( 182) = ( 0.2391304 0.2391304 0.2391304), wk = 0.0028329 k( 183) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0028329 k( 184) = ( 0.2608696 0.2608696 0.2608696), wk = 0.0028329 k( 185) = ( 0.2717391 0.2717391 0.2717391), wk = 0.0028329 k( 186) = ( 0.2826087 0.2826087 0.2826087), wk = 0.0028329 k( 187) = ( 0.2934783 0.2934783 0.2934783), wk = 0.0028329 k( 188) = ( 0.3043478 0.3043478 0.3043478), wk = 0.0028329 k( 189) = ( 0.3152174 0.3152174 0.3152174), wk = 0.0028329 k( 190) = ( 0.3260870 0.3260870 0.3260870), wk = 0.0028329 k( 191) = ( 0.3369565 0.3369565 0.3369565), wk = 0.0028329 k( 192) = ( 0.3478261 0.3478261 0.3478261), wk = 0.0028329 k( 193) = ( 0.3586956 0.3586956 0.3586956), wk = 0.0028329 k( 194) = ( 0.3695652 0.3695652 0.3695652), wk = 0.0028329 k( 195) = ( 0.3804348 0.3804348 0.3804348), wk = 0.0028329 k( 196) = ( 0.3913044 0.3913043 0.3913043), wk = 0.0028329 k( 197) = ( 0.4021739 0.4021739 0.4021739), wk = 0.0028329 k( 198) = ( 0.4130435 0.4130435 0.4130435), wk = 0.0028329 k( 199) = ( 0.4239130 0.4239130 0.4239130), wk = 0.0028329 k( 200) = ( 0.4347826 0.4347826 0.4347826), wk = 0.0028329 k( 201) = ( 0.4456522 0.4456522 0.4456522), wk = 0.0028329 k( 202) = ( 0.4565217 0.4565217 0.4565217), wk = 0.0028329 k( 203) = ( 0.4673913 0.4673913 0.4673913), wk = 0.0028329 k( 204) = ( 0.4782609 0.4782609 0.4782609), wk = 0.0028329 k( 205) = ( 0.4891304 0.4891304 0.4891304), wk = 0.0028329 k( 206) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 207) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 208) = ( 0.5037879 0.4924242 0.5037879), wk = 0.0028329 k( 209) = ( 0.5075758 0.4848485 0.5075758), wk = 0.0028329 k( 210) = ( 0.5113636 0.4772727 0.5113636), wk = 0.0028329 k( 211) = ( 0.5151515 0.4696970 0.5151515), wk = 0.0028329 k( 212) = ( 0.5189394 0.4621212 0.5189394), wk = 0.0028329 k( 213) = ( 0.5227273 0.4545454 0.5227273), wk = 0.0028329 k( 214) = ( 0.5265152 0.4469697 0.5265152), wk = 0.0028329 k( 215) = ( 0.5303030 0.4393939 0.5303030), wk = 0.0028329 k( 216) = ( 0.5340909 0.4318182 0.5340909), wk = 0.0028329 k( 217) = ( 0.5378788 0.4242424 0.5378788), wk = 0.0028329 k( 218) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0028329 k( 219) = ( 0.5454545 0.4090909 0.5454545), wk = 0.0028329 k( 220) = ( 0.5492424 0.4015151 0.5492424), wk = 0.0028329 k( 221) = ( 0.5530303 0.3939394 0.5530303), wk = 0.0028329 k( 222) = ( 0.5568182 0.3863636 0.5568182), wk = 0.0028329 k( 223) = ( 0.5606061 0.3787879 0.5606061), wk = 0.0028329 k( 224) = ( 0.5643939 0.3712121 0.5643939), wk = 0.0028329 k( 225) = ( 0.5681818 0.3636364 0.5681818), wk = 0.0028329 k( 226) = ( 0.5719697 0.3560606 0.5719697), wk = 0.0028329 k( 227) = ( 0.5757576 0.3484848 0.5757576), wk = 0.0028329 k( 228) = ( 0.5795455 0.3409091 0.5795455), wk = 0.0028329 k( 229) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0028329 k( 230) = ( 0.5871212 0.3257576 0.5871212), wk = 0.0028329 k( 231) = ( 0.5909091 0.3181818 0.5909091), wk = 0.0028329 k( 232) = ( 0.5946970 0.3106061 0.5946970), wk = 0.0028329 k( 233) = ( 0.5984848 0.3030303 0.5984848), wk = 0.0028329 k( 234) = ( 0.6022727 0.2954545 0.6022727), wk = 0.0028329 k( 235) = ( 0.6060606 0.2878788 0.6060606), wk = 0.0028329 k( 236) = ( 0.6098485 0.2803030 0.6098485), wk = 0.0028329 k( 237) = ( 0.6136364 0.2727273 0.6136364), wk = 0.0028329 k( 238) = ( 0.6174242 0.2651515 0.6174242), wk = 0.0028329 k( 239) = ( 0.6212121 0.2575758 0.6212121), wk = 0.0028329 k( 240) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028329 k( 241) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028329 k( 242) = ( 0.6184211 0.2500000 0.6315789), wk = 0.0028329 k( 243) = ( 0.6118421 0.2500000 0.6381579), wk = 0.0028329 k( 244) = ( 0.6052632 0.2500000 0.6447368), wk = 0.0028329 k( 245) = ( 0.5986842 0.2500000 0.6513158), wk = 0.0028329 k( 246) = ( 0.5921053 0.2500000 0.6578947), wk = 0.0028329 k( 247) = ( 0.5855263 0.2500000 0.6644737), wk = 0.0028329 k( 248) = ( 0.5789474 0.2500000 0.6710526), wk = 0.0028329 k( 249) = ( 0.5723684 0.2500000 0.6776316), wk = 0.0028329 k( 250) = ( 0.5657895 0.2500000 0.6842105), wk = 0.0028329 k( 251) = ( 0.5592105 0.2500000 0.6907895), wk = 0.0028329 k( 252) = ( 0.5526316 0.2500000 0.6973684), wk = 0.0028329 k( 253) = ( 0.5460526 0.2500000 0.7039474), wk = 0.0028329 k( 254) = ( 0.5394737 0.2500000 0.7105263), wk = 0.0028329 k( 255) = ( 0.5328947 0.2500000 0.7171053), wk = 0.0028329 k( 256) = ( 0.5263158 0.2500000 0.7236842), wk = 0.0028329 k( 257) = ( 0.5197368 0.2500000 0.7302632), wk = 0.0028329 k( 258) = ( 0.5131579 0.2500000 0.7368421), wk = 0.0028329 k( 259) = ( 0.5065789 0.2500000 0.7434211), wk = 0.0028329 k( 260) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028329 k( 261) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028329 k( 262) = ( 0.5000000 0.2565789 0.7434211), wk = 0.0028329 k( 263) = ( 0.5000000 0.2631579 0.7368421), wk = 0.0028329 k( 264) = ( 0.5000000 0.2697368 0.7302632), wk = 0.0028329 k( 265) = ( 0.5000000 0.2763158 0.7236842), wk = 0.0028329 k( 266) = ( 0.5000000 0.2828947 0.7171053), wk = 0.0028329 k( 267) = ( 0.5000000 0.2894737 0.7105263), wk = 0.0028329 k( 268) = ( 0.5000000 0.2960526 0.7039474), wk = 0.0028329 k( 269) = ( 0.5000000 0.3026316 0.6973684), wk = 0.0028329 k( 270) = ( 0.5000000 0.3092105 0.6907895), wk = 0.0028329 k( 271) = ( 0.5000000 0.3157895 0.6842105), wk = 0.0028329 k( 272) = ( 0.5000000 0.3223684 0.6776316), wk = 0.0028329 k( 273) = ( 0.5000000 0.3289474 0.6710526), wk = 0.0028329 k( 274) = ( 0.5000000 0.3355263 0.6644737), wk = 0.0028329 k( 275) = ( 0.5000000 0.3421053 0.6578947), wk = 0.0028329 k( 276) = ( 0.5000000 0.3486842 0.6513158), wk = 0.0028329 k( 277) = ( 0.5000000 0.3552632 0.6447368), wk = 0.0028329 k( 278) = ( 0.5000000 0.3618421 0.6381579), wk = 0.0028329 k( 279) = ( 0.5000000 0.3684211 0.6315789), wk = 0.0028329 k( 280) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0028329 k( 281) = ( 0.5000000 0.3815789 0.6184211), wk = 0.0028329 k( 282) = ( 0.5000000 0.3881579 0.6118421), wk = 0.0028329 k( 283) = ( 0.5000000 0.3947368 0.6052632), wk = 0.0028329 k( 284) = ( 0.5000000 0.4013158 0.5986842), wk = 0.0028329 k( 285) = ( 0.5000000 0.4078947 0.5921053), wk = 0.0028329 k( 286) = ( 0.5000000 0.4144737 0.5855263), wk = 0.0028329 k( 287) = ( 0.5000000 0.4210526 0.5789474), wk = 0.0028329 k( 288) = ( 0.5000000 0.4276316 0.5723684), wk = 0.0028329 k( 289) = ( 0.5000000 0.4342105 0.5657895), wk = 0.0028329 k( 290) = ( 0.5000000 0.4407895 0.5592105), wk = 0.0028329 k( 291) = ( 0.5000000 0.4473684 0.5526316), wk = 0.0028329 k( 292) = ( 0.5000000 0.4539474 0.5460526), wk = 0.0028329 k( 293) = ( 0.5000000 0.4605263 0.5394737), wk = 0.0028329 k( 294) = ( 0.5000000 0.4671053 0.5328947), wk = 0.0028329 k( 295) = ( 0.5000000 0.4736842 0.5263158), wk = 0.0028329 k( 296) = ( 0.5000000 0.4802632 0.5197368), wk = 0.0028329 k( 297) = ( 0.5000000 0.4868421 0.5131579), wk = 0.0028329 k( 298) = ( 0.5000000 0.4934210 0.5065789), wk = 0.0028329 k( 299) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 300) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 301) = ( 0.4962121 0.4962121 0.5075758), wk = 0.0028329 k( 302) = ( 0.4924242 0.4924242 0.5151515), wk = 0.0028329 k( 303) = ( 0.4886364 0.4886364 0.5227273), wk = 0.0028329 k( 304) = ( 0.4848485 0.4848485 0.5303030), wk = 0.0028329 k( 305) = ( 0.4810606 0.4810606 0.5378788), wk = 0.0028329 k( 306) = ( 0.4772727 0.4772727 0.5454545), wk = 0.0028329 k( 307) = ( 0.4734849 0.4734848 0.5530303), wk = 0.0028329 k( 308) = ( 0.4696970 0.4696970 0.5606061), wk = 0.0028329 k( 309) = ( 0.4659091 0.4659091 0.5681818), wk = 0.0028329 k( 310) = ( 0.4621212 0.4621212 0.5757576), wk = 0.0028329 k( 311) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0028329 k( 312) = ( 0.4545455 0.4545454 0.5909091), wk = 0.0028329 k( 313) = ( 0.4507576 0.4507576 0.5984848), wk = 0.0028329 k( 314) = ( 0.4469697 0.4469697 0.6060606), wk = 0.0028329 k( 315) = ( 0.4431818 0.4431818 0.6136364), wk = 0.0028329 k( 316) = ( 0.4393939 0.4393939 0.6212121), wk = 0.0028329 k( 317) = ( 0.4356061 0.4356061 0.6287879), wk = 0.0028329 k( 318) = ( 0.4318182 0.4318182 0.6363636), wk = 0.0028329 k( 319) = ( 0.4280303 0.4280303 0.6439394), wk = 0.0028329 k( 320) = ( 0.4242424 0.4242424 0.6515152), wk = 0.0028329 k( 321) = ( 0.4204545 0.4204545 0.6590909), wk = 0.0028329 k( 322) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0028329 k( 323) = ( 0.4128788 0.4128788 0.6742424), wk = 0.0028329 k( 324) = ( 0.4090909 0.4090909 0.6818182), wk = 0.0028329 k( 325) = ( 0.4053030 0.4053030 0.6893939), wk = 0.0028329 k( 326) = ( 0.4015151 0.4015151 0.6969697), wk = 0.0028329 k( 327) = ( 0.3977273 0.3977273 0.7045455), wk = 0.0028329 k( 328) = ( 0.3939394 0.3939394 0.7121212), wk = 0.0028329 k( 329) = ( 0.3901515 0.3901515 0.7196970), wk = 0.0028329 k( 330) = ( 0.3863636 0.3863636 0.7272727), wk = 0.0028329 k( 331) = ( 0.3825758 0.3825758 0.7348485), wk = 0.0028329 k( 332) = ( 0.3787879 0.3787879 0.7424242), wk = 0.0028329 k( 333) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028329 k( 334) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028329 k( 335) = ( 0.6184211 0.2368421 0.6184211), wk = 0.0028329 k( 336) = ( 0.6118421 0.2236842 0.6118421), wk = 0.0028329 k( 337) = ( 0.6052632 0.2105263 0.6052632), wk = 0.0028329 k( 338) = ( 0.5986842 0.1973684 0.5986842), wk = 0.0028329 k( 339) = ( 0.5921053 0.1842105 0.5921053), wk = 0.0028329 k( 340) = ( 0.5855263 0.1710526 0.5855263), wk = 0.0028329 k( 341) = ( 0.5789474 0.1578947 0.5789474), wk = 0.0028329 k( 342) = ( 0.5723684 0.1447368 0.5723684), wk = 0.0028329 k( 343) = ( 0.5657895 0.1315789 0.5657895), wk = 0.0028329 k( 344) = ( 0.5592105 0.1184210 0.5592105), wk = 0.0028329 k( 345) = ( 0.5526316 0.1052632 0.5526316), wk = 0.0028329 k( 346) = ( 0.5460526 0.0921053 0.5460526), wk = 0.0028329 k( 347) = ( 0.5394737 0.0789474 0.5394737), wk = 0.0028329 k( 348) = ( 0.5328947 0.0657895 0.5328947), wk = 0.0028329 k( 349) = ( 0.5263158 0.0526316 0.5263158), wk = 0.0028329 k( 350) = ( 0.5197368 0.0394737 0.5197368), wk = 0.0028329 k( 351) = ( 0.5131579 0.0263158 0.5131579), wk = 0.0028329 k( 352) = ( 0.5065789 0.0131579 0.5065789), wk = 0.0028329 k( 353) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0028329 Dense grid: 156301 G-vectors FFT dimensions: ( 75, 75, 75) Smooth grid: 35557 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 260, 46) NL pseudopotentials 0.25 Mb ( 130, 124) Each V/rho on FFT grid 0.26 Mb ( 16875) Each G-vector array 0.03 Mb ( 4343) G-vector shells 0.01 Mb ( 865) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.73 Mb ( 260, 184) Each subspace H/S matrix 0.03 Mb ( 46, 46) Each matrix 0.17 Mb ( 124, 2, 46) The potential is recalculated from file : ./Be2Cu.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.3 secs Computing kpt #: 2 total cpu time spent up to now is 2.7 secs Computing kpt #: 3 total cpu time spent up to now is 3.2 secs Computing kpt #: 4 total cpu time spent up to now is 3.7 secs Computing kpt #: 5 total cpu time spent up to now is 4.1 secs Computing kpt #: 6 total cpu time spent up to now is 4.6 secs Computing kpt #: 7 total cpu time spent up to now is 5.0 secs Computing kpt #: 8 total cpu time spent up to now is 5.5 secs Computing kpt #: 9 total cpu time spent up to now is 6.0 secs Computing kpt #: 10 total cpu time spent up to now is 6.5 secs Computing kpt #: 11 total cpu time spent up to now is 7.0 secs Computing kpt #: 12 total cpu time spent up to now is 7.4 secs Computing kpt #: 13 total cpu time spent up to now is 7.9 secs Computing kpt #: 14 total cpu time spent up to now is 8.4 secs Computing kpt #: 15 total cpu time spent up to now is 8.9 secs Computing kpt #: 16 total cpu time spent up to now is 9.3 secs Computing kpt #: 17 total cpu time spent up to now is 9.8 secs Computing kpt #: 18 total cpu time spent up to now is 10.3 secs Computing kpt #: 19 total cpu time spent up to now is 10.7 secs Computing kpt #: 20 total cpu time spent up to now is 11.2 secs Computing kpt #: 21 total cpu time spent up to now is 11.6 secs Computing kpt #: 22 total cpu time spent up to now is 12.2 secs Computing kpt #: 23 total cpu time spent up to now is 12.8 secs Computing kpt #: 24 total cpu time spent up to now is 13.7 secs Computing kpt #: 25 total cpu time spent up to now is 14.3 secs Computing kpt #: 26 total cpu time spent up to now is 14.8 secs Computing kpt #: 27 total cpu time spent up to now is 15.4 secs Computing kpt #: 28 total cpu time spent up to now is 15.9 secs Computing kpt #: 29 total cpu time spent up to now is 16.5 secs Computing kpt #: 30 total cpu time spent up to now is 17.0 secs Computing kpt #: 31 total cpu time spent up to now is 17.6 secs Computing kpt #: 32 total cpu time spent up to now is 18.1 secs Computing kpt #: 33 total cpu time spent up to now is 18.7 secs Computing kpt #: 34 total cpu time spent up to now is 19.2 secs Computing kpt #: 35 total cpu time spent up to now is 19.7 secs Computing kpt #: 36 total cpu time spent up to now is 20.3 secs Computing kpt #: 37 total cpu time spent up to now is 20.8 secs Computing kpt #: 38 total cpu time spent up to now is 21.3 secs Computing kpt #: 39 total cpu time spent up to now is 21.7 secs Computing kpt #: 40 total cpu time spent up to now is 22.2 secs Computing kpt #: 41 total cpu time spent up to now is 22.6 secs Computing kpt #: 42 total cpu time spent up to now is 23.1 secs Computing kpt #: 43 total cpu time spent up to now is 23.5 secs Computing kpt #: 44 total cpu time spent up to now is 23.9 secs Computing kpt #: 45 total cpu time spent up to now is 24.3 secs Computing kpt #: 46 total cpu time spent up to now is 24.7 secs Computing kpt #: 47 total cpu time spent up to now is 25.1 secs Computing kpt #: 48 total cpu time spent up to now is 25.5 secs Computing kpt #: 49 total cpu time spent up to now is 25.9 secs Computing kpt #: 50 total cpu time spent up to now is 26.3 secs Computing kpt #: 51 total cpu time spent up to now is 26.7 secs Computing kpt #: 52 total cpu time spent up to now is 27.1 secs Computing kpt #: 53 total cpu time spent up to now is 27.5 secs Computing kpt #: 54 total cpu time spent up to now is 27.9 secs Computing kpt #: 55 total cpu time spent up to now is 28.3 secs Computing kpt #: 56 total cpu time spent up to now is 28.9 secs Computing kpt #: 57 total cpu time spent up to now is 29.4 secs Computing kpt #: 58 total cpu time spent up to now is 30.0 secs Computing kpt #: 59 total cpu time spent up to now is 30.6 secs Computing kpt #: 60 total cpu time spent up to now is 31.2 secs Computing kpt #: 61 total cpu time spent up to now is 31.8 secs Computing kpt #: 62 total cpu time spent up to now is 32.3 secs Computing kpt #: 63 total cpu time spent up to now is 32.9 secs Computing kpt #: 64 total cpu time spent up to now is 33.5 secs Computing kpt #: 65 total cpu time spent up to now is 34.1 secs Computing kpt #: 66 total cpu time spent up to now is 34.7 secs Computing kpt #: 67 total cpu time spent up to now is 35.2 secs Computing kpt #: 68 total cpu time spent up to now is 35.8 secs Computing kpt #: 69 total cpu time spent up to now is 36.3 secs Computing kpt #: 70 total cpu time spent up to now is 36.9 secs Computing kpt #: 71 total cpu time spent up to now is 37.4 secs Computing kpt #: 72 total cpu time spent up to now is 38.0 secs Computing kpt #: 73 total cpu time spent up to now is 38.5 secs Computing kpt #: 74 total cpu time spent up to now is 39.1 secs Computing kpt #: 75 total cpu time spent up to now is 39.6 secs Computing kpt #: 76 total cpu time spent up to now is 40.2 secs Computing kpt #: 77 total cpu time spent up to now is 40.7 secs Computing kpt #: 78 total cpu time spent up to now is 41.3 secs Computing kpt #: 79 total cpu time spent up to now is 41.8 secs Computing kpt #: 80 total cpu time spent up to now is 42.4 secs Computing kpt #: 81 total cpu time spent up to now is 42.9 secs Computing kpt #: 82 total cpu time spent up to now is 43.5 secs Computing kpt #: 83 total cpu time spent up to now is 44.0 secs Computing kpt #: 84 total cpu time spent up to now is 44.5 secs Computing kpt #: 85 total cpu time spent up to now is 45.0 secs Computing kpt #: 86 total cpu time spent up to now is 45.4 secs Computing kpt #: 87 total cpu time spent up to now is 45.8 secs Computing kpt #: 88 total cpu time spent up to now is 46.2 secs Computing kpt #: 89 total cpu time spent up to now is 46.6 secs Computing kpt #: 90 total cpu time spent up to now is 47.0 secs Computing kpt #: 91 total cpu time spent up to now is 47.4 secs Computing kpt #: 92 total cpu time spent up to now is 47.8 secs Computing kpt #: 93 total cpu time spent up to now is 48.2 secs Computing kpt #: 94 total cpu time spent up to now is 48.5 secs Computing kpt #: 95 total cpu time spent up to now is 48.9 secs Computing kpt #: 96 total cpu time spent up to now is 49.3 secs Computing kpt #: 97 total cpu time spent up to now is 49.7 secs Computing kpt #: 98 total cpu time spent up to now is 50.1 secs Computing kpt #: 99 total cpu time spent up to now is 50.5 secs Computing kpt #: 100 total cpu time spent up to now is 50.9 secs Computing kpt #: 101 total cpu time spent up to now is 51.2 secs Computing kpt #: 102 total cpu time spent up to now is 51.6 secs Computing kpt #: 103 total cpu time spent up to now is 52.0 secs Computing kpt #: 104 total cpu time spent up to now is 52.4 secs Computing kpt #: 105 total cpu time spent up to now is 52.7 secs Computing kpt #: 106 total cpu time spent up to now is 53.1 secs Computing kpt #: 107 total cpu time spent up to now is 53.5 secs Computing kpt #: 108 total cpu time spent up to now is 53.9 secs Computing kpt #: 109 total cpu time spent up to now is 54.3 secs Computing kpt #: 110 total cpu time spent up to now is 54.6 secs Computing kpt #: 111 total cpu time spent up to now is 55.0 secs Computing kpt #: 112 total cpu time spent up to now is 55.4 secs Computing kpt #: 113 total cpu time spent up to now is 55.8 secs Computing kpt #: 114 total cpu time spent up to now is 56.2 secs Computing kpt #: 115 total cpu time spent up to now is 56.5 secs Computing kpt #: 116 total cpu time spent up to now is 56.9 secs Computing kpt #: 117 total cpu time spent up to now is 57.3 secs Computing kpt #: 118 total cpu time spent up to now is 57.6 secs Computing kpt #: 119 total cpu time spent up to now is 58.0 secs Computing kpt #: 120 total cpu time spent up to now is 58.4 secs Computing kpt #: 121 total cpu time spent up to now is 58.7 secs Computing kpt #: 122 total cpu time spent up to now is 59.1 secs Computing kpt #: 123 total cpu time spent up to now is 59.4 secs Computing kpt #: 124 total cpu time spent up to now is 59.8 secs Computing kpt #: 125 total cpu time spent up to now is 60.1 secs Computing kpt #: 126 total cpu time spent up to now is 60.5 secs Computing kpt #: 127 total cpu time spent up to now is 60.8 secs Computing kpt #: 128 total cpu time spent up to now is 61.2 secs Computing kpt #: 129 total cpu time spent up to now is 61.6 secs Computing kpt #: 130 total cpu time spent up to now is 61.9 secs Computing kpt #: 131 total cpu time spent up to now is 62.3 secs Computing kpt #: 132 total cpu time spent up to now is 62.7 secs Computing kpt #: 133 total cpu time spent up to now is 63.1 secs Computing kpt #: 134 total cpu time spent up to now is 63.5 secs Computing kpt #: 135 total cpu time spent up to now is 63.9 secs Computing kpt #: 136 total cpu time spent up to now is 64.3 secs Computing kpt #: 137 total cpu time spent up to now is 64.7 secs Computing kpt #: 138 total cpu time spent up to now is 65.1 secs Computing kpt #: 139 total cpu time spent up to now is 65.5 secs Computing kpt #: 140 total cpu time spent up to now is 65.9 secs Computing kpt #: 141 total cpu time spent up to now is 66.4 secs Computing kpt #: 142 total cpu time spent up to now is 66.8 secs Computing kpt #: 143 total cpu time spent up to now is 67.2 secs Computing kpt #: 144 total cpu time spent up to now is 67.7 secs Computing kpt #: 145 total cpu time spent up to now is 68.1 secs Computing kpt #: 146 total cpu time spent up to now is 68.6 secs Computing kpt #: 147 total cpu time spent up to now is 69.0 secs Computing kpt #: 148 total cpu time spent up to now is 69.5 secs Computing kpt #: 149 total cpu time spent up to now is 69.9 secs Computing kpt #: 150 total cpu time spent up to now is 70.4 secs Computing kpt #: 151 total cpu time spent up to now is 70.9 secs Computing kpt #: 152 total cpu time spent up to now is 71.4 secs Computing kpt #: 153 total cpu time spent up to now is 71.8 secs Computing kpt #: 154 total cpu time spent up to now is 72.3 secs Computing kpt #: 155 total cpu time spent up to now is 72.7 secs Computing kpt #: 156 total cpu time spent up to now is 73.2 secs Computing kpt #: 157 total cpu time spent up to now is 73.7 secs Computing kpt #: 158 total cpu time spent up to now is 74.1 secs Computing kpt #: 159 total cpu time spent up to now is 74.6 secs Computing kpt #: 160 total cpu time spent up to now is 75.0 secs Computing kpt #: 161 total cpu time spent up to now is 75.5 secs Computing kpt #: 162 total cpu time spent up to now is 75.9 secs Computing kpt #: 163 total cpu time spent up to now is 76.4 secs Computing kpt #: 164 total cpu time spent up to now is 76.8 secs Computing kpt #: 165 total cpu time spent up to now is 77.3 secs Computing kpt #: 166 total cpu time spent up to now is 77.8 secs Computing kpt #: 167 total cpu time spent up to now is 78.2 secs Computing kpt #: 168 total cpu time spent up to now is 78.7 secs Computing kpt #: 169 total cpu time spent up to now is 79.1 secs Computing kpt #: 170 total cpu time spent up to now is 79.6 secs Computing kpt #: 171 total cpu time spent up to now is 80.1 secs Computing kpt #: 172 total cpu time spent up to now is 80.5 secs Computing kpt #: 173 total cpu time spent up to now is 81.0 secs Computing kpt #: 174 total cpu time spent up to now is 81.5 secs Computing kpt #: 175 total cpu time spent up to now is 81.9 secs Computing kpt #: 176 total cpu time spent up to now is 82.4 secs Computing kpt #: 177 total cpu time spent up to now is 82.9 secs Computing kpt #: 178 total cpu time spent up to now is 83.3 secs Computing kpt #: 179 total cpu time spent up to now is 83.9 secs Computing kpt #: 180 total cpu time spent up to now is 84.4 secs Computing kpt #: 181 total cpu time spent up to now is 84.9 secs Computing kpt #: 182 total cpu time spent up to now is 85.5 secs Computing kpt #: 183 total cpu time spent up to now is 86.0 secs Computing kpt #: 184 total cpu time spent up to now is 86.5 secs Computing kpt #: 185 total cpu time spent up to now is 87.3 secs Computing kpt #: 186 total cpu time spent up to now is 87.8 secs Computing kpt #: 187 total cpu time spent up to now is 88.4 secs Computing kpt #: 188 total cpu time spent up to now is 89.1 secs Computing kpt #: 189 total cpu time spent up to now is 90.0 secs Computing kpt #: 190 total cpu time spent up to now is 90.7 secs Computing kpt #: 191 total cpu time spent up to now is 91.6 secs Computing kpt #: 192 total cpu time spent up to now is 92.1 secs Computing kpt #: 193 total cpu time spent up to now is 92.9 secs Computing kpt #: 194 total cpu time spent up to now is 93.7 secs Computing kpt #: 195 total cpu time spent up to now is 94.6 secs Computing kpt #: 196 total cpu time spent up to now is 95.5 secs Computing kpt #: 197 total cpu time spent up to now is 96.4 secs Computing kpt #: 198 total cpu time spent up to now is 97.2 secs Computing kpt #: 199 total cpu time spent up to now is 97.9 secs Computing kpt #: 200 total cpu time spent up to now is 98.5 secs Computing kpt #: 201 total cpu time spent up to now is 99.0 secs Computing kpt #: 202 total cpu time spent up to now is 99.8 secs Computing kpt #: 203 total cpu time spent up to now is 100.6 secs Computing kpt #: 204 total cpu time spent up to now is 101.4 secs Computing kpt #: 205 total cpu time spent up to now is 102.2 secs Computing kpt #: 206 total cpu time spent up to now is 103.0 secs Computing kpt #: 207 total cpu time spent up to now is 103.8 secs Computing kpt #: 208 total cpu time spent up to now is 104.4 secs Computing kpt #: 209 total cpu time spent up to now is 104.9 secs Computing kpt #: 210 total cpu time spent up to now is 105.3 secs Computing kpt #: 211 total cpu time spent up to now is 105.7 secs Computing kpt #: 212 total cpu time spent up to now is 106.1 secs Computing kpt #: 213 total cpu time spent up to now is 106.5 secs Computing kpt #: 214 total cpu time spent up to now is 106.8 secs Computing kpt #: 215 total cpu time spent up to now is 107.2 secs Computing kpt #: 216 total cpu time spent up to now is 107.6 secs Computing kpt #: 217 total cpu time spent up to now is 107.9 secs Computing kpt #: 218 total cpu time spent up to now is 108.3 secs Computing kpt #: 219 total cpu time spent up to now is 108.7 secs Computing kpt #: 220 total cpu time spent up to now is 109.0 secs Computing kpt #: 221 total cpu time spent up to now is 109.4 secs Computing kpt #: 222 total cpu time spent up to now is 109.8 secs Computing kpt #: 223 total cpu time spent up to now is 110.1 secs Computing kpt #: 224 total cpu time spent up to now is 110.5 secs Computing kpt #: 225 total cpu time spent up to now is 110.9 secs Computing kpt #: 226 total cpu time spent up to now is 111.3 secs Computing kpt #: 227 total cpu time spent up to now is 111.8 secs Computing kpt #: 228 total cpu time spent up to now is 112.3 secs Computing kpt #: 229 total cpu time spent up to now is 112.7 secs Computing kpt #: 230 total cpu time spent up to now is 113.2 secs Computing kpt #: 231 total cpu time spent up to now is 113.6 secs Computing kpt #: 232 total cpu time spent up to now is 114.0 secs Computing kpt #: 233 total cpu time spent up to now is 114.4 secs Computing kpt #: 234 total cpu time spent up to now is 114.7 secs Computing kpt #: 235 total cpu time spent up to now is 115.1 secs Computing kpt #: 236 total cpu time spent up to now is 115.5 secs Computing kpt #: 237 total cpu time spent up to now is 115.9 secs Computing kpt #: 238 total cpu time spent up to now is 116.3 secs Computing kpt #: 239 total cpu time spent up to now is 116.6 secs Computing kpt #: 240 total cpu time spent up to now is 117.0 secs Computing kpt #: 241 total cpu time spent up to now is 117.4 secs Computing kpt #: 242 total cpu time spent up to now is 117.8 secs Computing kpt #: 243 total cpu time spent up to now is 118.2 secs Computing kpt #: 244 total cpu time spent up to now is 118.5 secs Computing kpt #: 245 total cpu time spent up to now is 118.9 secs Computing kpt #: 246 total cpu time spent up to now is 119.3 secs Computing kpt #: 247 total cpu time spent up to now is 119.7 secs Computing kpt #: 248 total cpu time spent up to now is 120.1 secs Computing kpt #: 249 total cpu time spent up to now is 120.5 secs Computing kpt #: 250 total cpu time spent up to now is 120.8 secs Computing kpt #: 251 total cpu time spent up to now is 121.2 secs Computing kpt #: 252 total cpu time spent up to now is 121.6 secs Computing kpt #: 253 total cpu time spent up to now is 122.0 secs Computing kpt #: 254 total cpu time spent up to now is 122.4 secs Computing kpt #: 255 total cpu time spent up to now is 122.8 secs Computing kpt #: 256 total cpu time spent up to now is 123.2 secs Computing kpt #: 257 total cpu time spent up to now is 123.6 secs Computing kpt #: 258 total cpu time spent up to now is 124.0 secs Computing kpt #: 259 total cpu time spent up to now is 124.5 secs Computing kpt #: 260 total cpu time spent up to now is 125.1 secs Computing kpt #: 261 total cpu time spent up to now is 125.6 secs Computing kpt #: 262 total cpu time spent up to now is 126.1 secs Computing kpt #: 263 total cpu time spent up to now is 126.6 secs Computing kpt #: 264 total cpu time spent up to now is 127.0 secs Computing kpt #: 265 total cpu time spent up to now is 127.3 secs Computing kpt #: 266 total cpu time spent up to now is 127.7 secs Computing kpt #: 267 total cpu time spent up to now is 128.1 secs Computing kpt #: 268 total cpu time spent up to now is 128.5 secs Computing kpt #: 269 total cpu time spent up to now is 128.9 secs Computing kpt #: 270 total cpu time spent up to now is 129.3 secs Computing kpt #: 271 total cpu time spent up to now is 129.7 secs Computing kpt #: 272 total cpu time spent up to now is 130.1 secs Computing kpt #: 273 total cpu time spent up to now is 130.5 secs Computing kpt #: 274 total cpu time spent up to now is 130.9 secs Computing kpt #: 275 total cpu time spent up to now is 131.3 secs Computing kpt #: 276 total cpu time spent up to now is 131.8 secs Computing kpt #: 277 total cpu time spent up to now is 132.4 secs Computing kpt #: 278 total cpu time spent up to now is 132.8 secs Computing kpt #: 279 total cpu time spent up to now is 133.3 secs Computing kpt #: 280 total cpu time spent up to now is 133.7 secs Computing kpt #: 281 total cpu time spent up to now is 134.1 secs Computing kpt #: 282 total cpu time spent up to now is 134.5 secs Computing kpt #: 283 total cpu time spent up to now is 134.8 secs Computing kpt #: 284 total cpu time spent up to now is 135.2 secs Computing kpt #: 285 total cpu time spent up to now is 135.6 secs Computing kpt #: 286 total cpu time spent up to now is 135.9 secs Computing kpt #: 287 total cpu time spent up to now is 136.3 secs Computing kpt #: 288 total cpu time spent up to now is 136.7 secs Computing kpt #: 289 total cpu time spent up to now is 137.0 secs Computing kpt #: 290 total cpu time spent up to now is 137.4 secs Computing kpt #: 291 total cpu time spent up to now is 137.8 secs Computing kpt #: 292 total cpu time spent up to now is 138.1 secs Computing kpt #: 293 total cpu time spent up to now is 138.5 secs Computing kpt #: 294 total cpu time spent up to now is 138.9 secs Computing kpt #: 295 total cpu time spent up to now is 139.3 secs Computing kpt #: 296 total cpu time spent up to now is 139.7 secs Computing kpt #: 297 total cpu time spent up to now is 140.2 secs Computing kpt #: 298 total cpu time spent up to now is 140.8 secs Computing kpt #: 299 total cpu time spent up to now is 141.6 secs Computing kpt #: 300 total cpu time spent up to now is 142.4 secs Computing kpt #: 301 total cpu time spent up to now is 143.0 secs Computing kpt #: 302 total cpu time spent up to now is 143.5 secs Computing kpt #: 303 total cpu time spent up to now is 143.9 secs Computing kpt #: 304 total cpu time spent up to now is 144.3 secs Computing kpt #: 305 total cpu time spent up to now is 144.6 secs Computing kpt #: 306 total cpu time spent up to now is 145.0 secs Computing kpt #: 307 total cpu time spent up to now is 145.4 secs Computing kpt #: 308 total cpu time spent up to now is 145.8 secs Computing kpt #: 309 total cpu time spent up to now is 146.1 secs Computing kpt #: 310 total cpu time spent up to now is 146.5 secs Computing kpt #: 311 total cpu time spent up to now is 146.9 secs Computing kpt #: 312 total cpu time spent up to now is 147.2 secs Computing kpt #: 313 total cpu time spent up to now is 147.6 secs Computing kpt #: 314 total cpu time spent up to now is 148.0 secs Computing kpt #: 315 total cpu time spent up to now is 148.3 secs Computing kpt #: 316 total cpu time spent up to now is 148.7 secs Computing kpt #: 317 total cpu time spent up to now is 149.1 secs Computing kpt #: 318 total cpu time spent up to now is 149.5 secs Computing kpt #: 319 total cpu time spent up to now is 149.9 secs Computing kpt #: 320 total cpu time spent up to now is 150.3 secs Computing kpt #: 321 total cpu time spent up to now is 150.8 secs Computing kpt #: 322 total cpu time spent up to now is 151.3 secs Computing kpt #: 323 total cpu time spent up to now is 151.7 secs Computing kpt #: 324 total cpu time spent up to now is 152.1 secs Computing kpt #: 325 total cpu time spent up to now is 152.5 secs Computing kpt #: 326 total cpu time spent up to now is 152.9 secs Computing kpt #: 327 total cpu time spent up to now is 153.3 secs Computing kpt #: 328 total cpu time spent up to now is 153.7 secs Computing kpt #: 329 total cpu time spent up to now is 154.0 secs Computing kpt #: 330 total cpu time spent up to now is 154.4 secs Computing kpt #: 331 total cpu time spent up to now is 154.8 secs Computing kpt #: 332 total cpu time spent up to now is 155.2 secs Computing kpt #: 333 total cpu time spent up to now is 155.6 secs Computing kpt #: 334 total cpu time spent up to now is 156.0 secs Computing kpt #: 335 total cpu time spent up to now is 156.3 secs Computing kpt #: 336 total cpu time spent up to now is 156.7 secs Computing kpt #: 337 total cpu time spent up to now is 157.1 secs Computing kpt #: 338 total cpu time spent up to now is 157.5 secs Computing kpt #: 339 total cpu time spent up to now is 157.8 secs Computing kpt #: 340 total cpu time spent up to now is 158.2 secs Computing kpt #: 341 total cpu time spent up to now is 158.6 secs Computing kpt #: 342 total cpu time spent up to now is 159.2 secs Computing kpt #: 343 total cpu time spent up to now is 159.7 secs Computing kpt #: 344 total cpu time spent up to now is 160.2 secs Computing kpt #: 345 total cpu time spent up to now is 160.7 secs Computing kpt #: 346 total cpu time spent up to now is 161.1 secs Computing kpt #: 347 total cpu time spent up to now is 161.4 secs Computing kpt #: 348 total cpu time spent up to now is 161.8 secs Computing kpt #: 349 total cpu time spent up to now is 162.2 secs Computing kpt #: 350 total cpu time spent up to now is 162.6 secs Computing kpt #: 351 total cpu time spent up to now is 163.1 secs Computing kpt #: 352 total cpu time spent up to now is 163.6 secs Computing kpt #: 353 total cpu time spent up to now is 164.0 secs ethr = 2.63E-08, avg # of iterations = 19.5 total cpu time spent up to now is 164.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0367 0.0367 5.9680 5.9680 5.9680 5.9680 6.3044 6.3044 6.3044 6.3044 6.3622 6.3622 6.4187 6.4187 6.4187 6.4187 6.5696 6.5696 7.0668 7.0668 7.7100 7.7100 7.7100 7.7100 10.8213 10.8213 10.8213 10.8213 10.8795 10.8795 13.9694 13.9694 14.0404 14.0404 14.1168 14.1168 14.1168 14.1168 k = 0.0094-0.0054 0.0077 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0380 0.0380 5.9676 5.9676 5.9684 5.9684 6.3036 6.3036 6.3045 6.3045 6.3618 6.3618 6.4167 6.4167 6.4189 6.4189 6.5683 6.5683 7.0703 7.0703 7.7098 7.7098 7.7102 7.7102 10.8162 10.8162 10.8181 10.8181 10.8755 10.8755 13.9751 13.9751 14.0377 14.0377 14.1091 14.1091 14.1235 14.1235 k = 0.0189-0.0109 0.0154 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0418 0.0418 5.9665 5.9665 5.9695 5.9695 6.3010 6.3010 6.3046 6.3046 6.3608 6.3608 6.4108 6.4108 6.4196 6.4196 6.5648 6.5648 7.0807 7.0807 7.7091 7.7091 7.7108 7.7108 10.8012 10.8012 10.8082 10.8082 10.8640 10.8640 13.9922 13.9922 14.0090 14.0090 14.1071 14.1071 14.1432 14.1432 k = 0.0283-0.0163 0.0231 ( 4473 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0482 0.0482 5.9646 5.9646 5.9714 5.9714 6.2964 6.2964 6.3048 6.3048 6.3595 6.3595 6.4009 6.4009 6.4207 6.4207 6.5600 6.5600 7.0970 7.0970 7.7080 7.7080 7.7117 7.7117 10.7765 10.7765 10.7905 10.7905 10.8466 10.8466 13.9363 13.9363 14.0203 14.0203 14.1315 14.1315 14.1758 14.1758 k = 0.0377-0.0218 0.0308 ( 4465 PWs) bands (ev): -88.8751 -88.8751 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0571 0.0571 5.9615 5.9615 5.9741 5.9741 6.2895 6.2895 6.3048 6.3048 6.3583 6.3583 6.3876 6.3876 6.4223 6.4223 6.5550 6.5550 7.1182 7.1182 7.7065 7.7065 7.7130 7.7130 10.7429 10.7429 10.7638 10.7638 10.8254 10.8254 13.8312 13.8312 14.0594 14.0594 14.1738 14.1738 14.2204 14.2204 k = 0.0472-0.0272 0.0385 ( 4457 PWs) bands (ev): -88.8751 -88.8751 -88.8442 -88.8442 -88.8440 -88.8440 -88.8440 -88.8440 0.0686 0.0686 5.9569 5.9569 5.9774 5.9774 6.2801 6.2801 6.3038 6.3038 6.3576 6.3576 6.3719 6.3719 6.4242 6.4242 6.5508 6.5508 7.1433 7.1433 7.7046 7.7046 7.7145 7.7145 10.7009 10.7009 10.7274 10.7274 10.8021 10.8021 13.7021 13.7021 14.1090 14.1090 14.2293 14.2293 14.2765 14.2765 k = 0.0566-0.0327 0.0462 ( 4453 PWs) bands (ev): -88.8750 -88.8750 -88.8443 -88.8443 -88.8440 -88.8440 -88.8440 -88.8440 0.0825 0.0825 5.9504 5.9504 5.9812 5.9812 6.2681 6.2681 6.3007 6.3007 6.3562 6.3562 6.3575 6.3575 6.4264 6.4264 6.5478 6.5478 7.1713 7.1713 7.7022 7.7022 7.7164 7.7164 10.6515 10.6515 10.6817 10.6817 10.7773 10.7773 13.5543 13.5543 14.1687 14.1687 14.2961 14.2961 14.3430 14.3430 k = 0.0660-0.0381 0.0539 ( 4453 PWs) bands (ev): -88.8749 -88.8749 -88.8444 -88.8444 -88.8440 -88.8440 -88.8440 -88.8440 0.0991 0.0991 5.9414 5.9414 5.9855 5.9855 6.2539 6.2539 6.2930 6.2930 6.3443 6.3443 6.3583 6.3583 6.4290 6.4290 6.5460 6.5460 7.2013 7.2013 7.6995 7.6995 7.7184 7.7184 10.5955 10.5955 10.6284 10.6284 10.7508 10.7508 13.3919 13.3919 14.2381 14.2381 14.3728 14.3728 14.4191 14.4191 k = 0.0755-0.0436 0.0616 ( 4465 PWs) bands (ev): -88.8748 -88.8748 -88.8445 -88.8445 -88.8440 -88.8440 -88.8440 -88.8440 0.1182 0.1182 5.9292 5.9292 5.9901 5.9901 6.2376 6.2376 6.2797 6.2797 6.3384 6.3384 6.3597 6.3597 6.4319 6.4319 6.5454 6.5454 7.2327 7.2327 7.6963 7.6963 7.7207 7.7207 10.5339 10.5339 10.5685 10.5685 10.7226 10.7226 13.2185 13.2185 14.3166 14.3166 14.4585 14.4585 14.5038 14.5038 k = 0.0849-0.0490 0.0693 ( 4457 PWs) bands (ev): -88.8747 -88.8747 -88.8446 -88.8446 -88.8440 -88.8440 -88.8440 -88.8440 0.1398 0.1398 5.9132 5.9132 5.9946 5.9946 6.2198 6.2198 6.2636 6.2636 6.3372 6.3372 6.3619 6.3619 6.4351 6.4351 6.5459 6.5459 7.2649 7.2649 7.6929 7.6929 7.7230 7.7230 10.4673 10.4673 10.5033 10.5033 10.6927 10.6927 13.0365 13.0365 14.4038 14.4038 14.5521 14.5521 14.5962 14.5962 k = 0.0943-0.0545 0.0770 ( 4456 PWs) bands (ev): -88.8746 -88.8746 -88.8447 -88.8447 -88.8440 -88.8440 -88.8440 -88.8440 0.1639 0.1639 5.8928 5.8928 5.9987 5.9987 6.2011 6.2011 6.2479 6.2479 6.3386 6.3386 6.3647 6.3647 6.4386 6.4386 6.5472 6.5472 7.2976 7.2976 7.6891 7.6891 7.7255 7.7255 10.3966 10.3966 10.4338 10.4338 10.6614 10.6614 12.8484 12.8484 14.4992 14.4992 14.6525 14.6525 14.6952 14.6952 k = 0.1038-0.0599 0.0847 ( 4460 PWs) bands (ev): -88.8744 -88.8744 -88.8449 -88.8449 -88.8440 -88.8440 -88.8440 -88.8440 0.1906 0.1906 5.8677 5.8677 6.0015 6.0015 6.1825 6.1825 6.2343 6.2343 6.3415 6.3415 6.3681 6.3681 6.4425 6.4425 6.5493 6.5493 7.3302 7.3302 7.6851 7.6851 7.7279 7.7279 10.3226 10.3226 10.3606 10.3606 10.6289 10.6289 12.6557 12.6557 14.6023 14.6023 14.7590 14.7590 14.7997 14.7997 k = 0.1132-0.0654 0.0924 ( 4456 PWs) bands (ev): -88.8743 -88.8743 -88.8450 -88.8450 -88.8440 -88.8440 -88.8440 -88.8440 0.2197 0.2197 5.8381 5.8381 6.0018 6.0018 6.1654 6.1654 6.2237 6.2237 6.3453 6.3453 6.3721 6.3721 6.4466 6.4466 6.5520 6.5520 7.3626 7.3626 7.6810 7.6810 7.7304 7.7304 10.2457 10.2457 10.2845 10.2845 10.5955 10.5955 12.4601 12.4601 14.7126 14.7126 14.8707 14.8707 14.8989 14.8989 k = 0.1226-0.0708 0.1001 ( 4464 PWs) bands (ev): -88.8741 -88.8741 -88.8452 -88.8452 -88.8440 -88.8440 -88.8440 -88.8440 0.2514 0.2514 5.8043 5.8043 5.9980 5.9980 6.1516 6.1516 6.2161 6.2161 6.3497 6.3497 6.3766 6.3766 6.4510 6.4510 6.5553 6.5553 7.3943 7.3943 7.6768 7.6768 7.7327 7.7327 10.1666 10.1666 10.2060 10.2060 10.5613 10.5613 12.2626 12.2626 14.8297 14.8297 14.9275 14.9275 14.9865 14.9865 k = 0.1321-0.0763 0.1078 ( 4464 PWs) bands (ev): -88.8739 -88.8739 -88.8454 -88.8454 -88.8440 -88.8440 -88.8440 -88.8440 0.2857 0.2857 5.7669 5.7669 5.9885 5.9885 6.1429 6.1429 6.2113 6.2113 6.3547 6.3547 6.3817 6.3817 6.4557 6.4557 6.5592 6.5592 7.4251 7.4251 7.6729 7.6729 7.7350 7.7350 10.0859 10.0859 10.1258 10.1258 10.5266 10.5266 12.0644 12.0644 14.9461 14.9461 14.9594 14.9594 15.1053 15.1053 k = 0.1415-0.0817 0.1155 ( 4456 PWs) bands (ev): -88.8737 -88.8737 -88.8456 -88.8456 -88.8440 -88.8440 -88.8440 -88.8440 0.3224 0.3224 5.7265 5.7265 5.9726 5.9726 6.1401 6.1401 6.2088 6.2088 6.3601 6.3601 6.3873 6.3873 6.4608 6.4608 6.5635 6.5635 7.4544 7.4544 7.6695 7.6695 7.7371 7.7371 10.0038 10.0038 10.0441 10.0441 10.4916 10.4916 11.8662 11.8662 14.9773 14.9773 15.0843 15.0843 15.2233 15.2233 k = 0.1509-0.0871 0.1232 ( 4456 PWs) bands (ev): -88.8735 -88.8735 -88.8458 -88.8458 -88.8440 -88.8440 -88.8440 -88.8440 0.3616 0.3616 5.6836 5.6836 5.9510 5.9510 6.1427 6.1427 6.2082 6.2082 6.3659 6.3659 6.3934 6.3934 6.4661 6.4661 6.5683 6.5683 7.4817 7.4817 7.6671 7.6671 7.7390 7.7390 9.9207 9.9207 9.9615 9.9615 10.4563 10.4563 11.6687 11.6687 15.0055 15.0055 15.2199 15.2199 15.3133 15.3133 k = 0.1604-0.0926 0.1309 ( 4456 PWs) bands (ev): -88.8733 -88.8733 -88.8460 -88.8460 -88.8440 -88.8440 -88.8440 -88.8440 0.4033 0.4033 5.6389 5.6389 5.9249 5.9249 6.1496 6.1496 6.2090 6.2090 6.3720 6.3720 6.4000 6.4000 6.4718 6.4718 6.5735 6.5735 7.5059 7.5059 7.6668 7.6668 7.7407 7.7407 9.8371 9.8371 9.8782 9.8782 10.4211 10.4211 11.4727 11.4727 15.0354 15.0354 15.3610 15.3610 15.3804 15.3804 k = 0.1698-0.0980 0.1387 ( 4460 PWs) bands (ev): -88.8731 -88.8731 -88.8462 -88.8462 -88.8440 -88.8440 -88.8440 -88.8440 0.4475 0.4475 5.5927 5.5927 5.8958 5.8958 6.1595 6.1595 6.2108 6.2108 6.3784 6.3784 6.4070 6.4070 6.4779 6.4779 6.5791 6.5791 7.5258 7.5258 7.6696 7.6696 7.7422 7.7422 9.7531 9.7531 9.7946 9.7946 10.3858 10.3858 11.2788 11.2788 15.0673 15.0673 15.4470 15.4470 15.5074 15.5074 k = 0.1792-0.1035 0.1464 ( 4452 PWs) bands (ev): -88.8728 -88.8728 -88.8464 -88.8464 -88.8440 -88.8440 -88.8440 -88.8440 0.4942 0.4942 5.5454 5.5454 5.8645 5.8645 6.1717 6.1717 6.2131 6.2131 6.3850 6.3850 6.4145 6.4145 6.4843 6.4843 6.5852 6.5852 7.5400 7.5400 7.6769 7.6769 7.7434 7.7434 9.6690 9.6690 9.7108 9.7108 10.3507 10.3507 11.0875 11.0875 15.1011 15.1011 15.5153 15.5153 15.6588 15.6588 k = 0.1887-0.1089 0.1541 ( 4452 PWs) bands (ev): -88.8726 -88.8726 -88.8467 -88.8467 -88.8440 -88.8440 -88.8440 -88.8440 0.5434 0.5434 5.4973 5.4973 5.8318 5.8318 6.1856 6.1856 6.2158 6.2158 6.3917 6.3917 6.4223 6.4223 6.4912 6.4912 6.5917 6.5917 7.5478 7.5478 7.6892 7.6892 7.7443 7.7443 9.5851 9.5851 9.6271 9.6271 10.3158 10.3158 10.8994 10.8994 15.1368 15.1368 15.5851 15.5851 15.8147 15.8147 k = 0.1981-0.1144 0.1618 ( 4460 PWs) bands (ev): -88.8723 -88.8723 -88.8470 -88.8470 -88.8440 -88.8440 -88.8440 -88.8440 0.5950 0.5950 5.4485 5.4485 5.7981 5.7981 6.2008 6.2008 6.2183 6.2183 6.3985 6.3985 6.4305 6.4305 6.4987 6.4987 6.5986 6.5986 7.5497 7.5497 7.7059 7.7059 7.7450 7.7450 9.5015 9.5015 9.5436 9.5436 10.2810 10.2810 10.7151 10.7151 15.1746 15.1746 15.6566 15.6566 15.9727 15.9727 k = 0.2075-0.1198 0.1695 ( 4448 PWs) bands (ev): -88.8720 -88.8720 -88.8472 -88.8472 -88.8440 -88.8440 -88.8440 -88.8440 0.6490 0.6490 5.3994 5.3994 5.7637 5.7637 6.2171 6.2171 6.2205 6.2205 6.4054 6.4054 6.4389 6.4389 6.5067 6.5067 6.6060 6.6060 7.5473 7.5473 7.7255 7.7255 7.7454 7.7454 9.4183 9.4183 9.4606 9.4606 10.2466 10.2466 10.5352 10.5352 15.2144 15.2144 15.7295 15.7295 16.0894 16.0894 k = 0.2170-0.1253 0.1772 ( 4432 PWs) bands (ev): -88.8718 -88.8718 -88.8475 -88.8475 -88.8440 -88.8440 -88.8440 -88.8440 0.7055 0.7055 5.3500 5.3500 5.7290 5.7290 6.2219 6.2219 6.2344 6.2344 6.4123 6.4123 6.4475 6.4475 6.5154 6.5154 6.6139 6.6139 7.5417 7.5417 7.7454 7.7454 7.7465 7.7465 9.3357 9.3357 9.3782 9.3782 10.2123 10.2123 10.3602 10.3602 15.2563 15.2563 15.8038 15.8038 16.1980 16.1986 k = 0.2264-0.1307 0.1849 ( 4456 PWs) bands (ev): -88.8715 -88.8715 -88.8478 -88.8478 -88.8440 -88.8440 -88.8440 -88.8440 0.7643 0.7643 5.3004 5.3004 5.6942 5.6942 6.2222 6.2222 6.2524 6.2524 6.4191 6.4191 6.4562 6.4562 6.5249 6.5249 6.6223 6.6223 7.5340 7.5340 7.7451 7.7451 7.7678 7.7678 9.2539 9.2539 9.2965 9.2965 10.1783 10.1783 10.1908 10.1908 15.3003 15.3003 15.8792 15.8792 16.2981 16.2981 k = 0.2358-0.1362 0.1926 ( 4456 PWs) bands (ev): -88.8712 -88.8712 -88.8481 -88.8481 -88.8440 -88.8440 -88.8440 -88.8440 0.8256 0.8256 5.2507 5.2507 5.6595 5.6595 6.2211 6.2211 6.2710 6.2710 6.4258 6.4258 6.4649 6.4649 6.5354 6.5354 6.6313 6.6313 7.5246 7.5246 7.7446 7.7446 7.7885 7.7885 9.1730 9.1730 9.2155 9.2155 10.0278 10.0278 10.1446 10.1446 15.3465 15.3465 15.9557 15.9557 16.3886 16.3886 k = 0.2453-0.1416 0.2003 ( 4432 PWs) bands (ev): -88.8708 -88.8708 -88.8484 -88.8484 -88.8440 -88.8440 -88.8440 -88.8440 0.8893 0.8893 5.2009 5.2009 5.6251 5.6251 6.2181 6.2181 6.2902 6.2902 6.4324 6.4324 6.4736 6.4736 6.5468 6.5468 6.6409 6.6409 7.5140 7.5140 7.7437 7.7437 7.8080 7.8080 9.0931 9.0931 9.1355 9.1355 9.8718 9.8718 10.1111 10.1111 15.3947 15.3947 16.0333 16.0333 16.4713 16.4713 k = 0.2547-0.1471 0.2080 ( 4432 PWs) bands (ev): -88.8705 -88.8705 -88.8488 -88.8488 -88.8440 -88.8440 -88.8440 -88.8440 0.9553 0.9553 5.1510 5.1510 5.5911 5.5911 6.2127 6.2127 6.3098 6.3098 6.4389 6.4389 6.4823 6.4823 6.5593 6.5593 6.6512 6.6512 7.5024 7.5024 7.7425 7.7425 7.8257 7.8257 9.0143 9.0143 9.0564 9.0564 9.7239 9.7239 10.0778 10.0778 15.4452 15.4452 16.1117 16.1117 16.5460 16.5460 k = 0.2642-0.1525 0.2157 ( 4448 PWs) bands (ev): -88.8702 -88.8702 -88.8491 -88.8491 -88.8440 -88.8440 -88.8440 -88.8440 1.0237 1.0237 5.1011 5.1011 5.5577 5.5577 6.2046 6.2046 6.3296 6.3296 6.4452 6.4452 6.4909 6.4909 6.5728 6.5728 6.6622 6.6622 7.4899 7.4899 7.7411 7.7411 7.8411 7.8411 8.9367 8.9367 8.9784 8.9784 9.5847 9.5847 10.0446 10.0446 15.4979 15.4979 16.1910 16.1910 16.6132 16.6132 k = 0.2736-0.1580 0.2234 ( 4456 PWs) bands (ev): -88.8698 -88.8698 -88.8495 -88.8495 -88.8440 -88.8440 -88.8440 -88.8440 1.0943 1.0943 5.0510 5.0510 5.5249 5.5249 6.1932 6.1932 6.3496 6.3496 6.4514 6.4514 6.4997 6.4997 6.5875 6.5875 6.6741 6.6741 7.4767 7.4767 7.7393 7.7393 7.8536 7.8536 8.8604 8.8604 8.9015 8.9015 9.4555 9.4555 10.0116 10.0116 15.5528 15.5528 16.2711 16.2711 16.6734 16.6734 k = 0.2830-0.1634 0.2311 ( 4452 PWs) bands (ev): -88.8695 -88.8695 -88.8498 -88.8498 -88.8440 -88.8440 -88.8440 -88.8440 1.1673 1.1673 5.0007 5.0007 5.4930 5.4930 6.1780 6.1780 6.3696 6.3696 6.4575 6.4575 6.5086 6.5086 6.6034 6.6034 6.6868 6.6868 7.4627 7.4627 7.7372 7.7372 7.8625 7.8625 8.7857 8.7857 8.8258 8.8258 9.3372 9.3372 9.9787 9.9787 15.6100 15.6100 16.3521 16.3521 16.7272 16.7272 k = 0.2925-0.1688 0.2388 ( 4436 PWs) bands (ev): -88.8691 -88.8691 -88.8502 -88.8502 -88.8440 -88.8440 -88.8440 -88.8440 1.2425 1.2425 4.9501 4.9501 5.4621 5.4621 6.1587 6.1587 6.3892 6.3892 6.4635 6.4635 6.5180 6.5180 6.6203 6.6203 6.7006 6.7006 7.4481 7.4481 7.7349 7.7349 7.8673 7.8673 8.7125 8.7125 8.7514 8.7514 9.2309 9.2309 9.9459 9.9459 15.6695 15.6695 16.4339 16.4339 16.7754 16.7754 k = 0.3019-0.1743 0.2465 ( 4436 PWs) bands (ev): -88.8687 -88.8687 -88.8505 -88.8505 -88.8440 -88.8440 -88.8440 -88.8440 1.3199 1.3199 4.8992 4.8992 5.4322 5.4322 6.1348 6.1348 6.4083 6.4083 6.4693 6.4693 6.5280 6.5280 6.6383 6.6383 6.7153 6.7153 7.4328 7.4328 7.7323 7.7323 7.8674 7.8674 8.6410 8.6410 8.6782 8.6782 9.1376 9.1376 9.9131 9.9131 15.7314 15.7314 16.5166 16.5166 16.8187 16.8187 k = 0.3113-0.1797 0.2542 ( 4432 PWs) bands (ev): -88.8684 -88.8684 -88.8509 -88.8509 -88.8440 -88.8440 -88.8440 -88.8440 1.3995 1.3995 4.8476 4.8476 5.4034 5.4034 6.1061 6.1061 6.4264 6.4264 6.4749 6.4749 6.5391 6.5391 6.6574 6.6574 6.7310 6.7310 7.4169 7.4169 7.7295 7.7295 7.8627 7.8627 8.5711 8.5711 8.6064 8.6064 9.0580 9.0580 9.8803 9.8803 15.7956 15.7956 16.6002 16.6002 16.8577 16.8577 k = 0.3208-0.1852 0.2619 ( 4432 PWs) bands (ev): -88.8680 -88.8680 -88.8513 -88.8513 -88.8440 -88.8440 -88.8440 -88.8440 1.4813 1.4813 4.7952 4.7952 5.3760 5.3760 6.0724 6.0724 6.4432 6.4432 6.4805 6.4805 6.5516 6.5516 6.6775 6.6775 6.7479 6.7479 7.4004 7.4004 7.7264 7.7264 7.8530 7.8530 8.5028 8.5028 8.5360 8.5360 8.9926 8.9926 9.8475 9.8475 15.8623 15.8623 16.6847 16.6847 16.8930 16.8930 k = 0.3302-0.1906 0.2696 ( 4432 PWs) bands (ev): -88.8676 -88.8676 -88.8517 -88.8517 -88.8440 -88.8440 -88.8440 -88.8440 1.5652 1.5652 4.7419 4.7419 5.3499 5.3499 6.0338 6.0338 6.4583 6.4583 6.4859 6.4859 6.5658 6.5658 6.6986 6.6986 6.7658 6.7658 7.3834 7.3834 7.7231 7.7231 7.8387 7.8387 8.4360 8.4360 8.4671 8.4671 8.9413 8.9413 9.8147 9.8147 15.9313 15.9313 16.7702 16.7702 16.9250 16.9250 k = 0.3396-0.1961 0.2773 ( 4448 PWs) bands (ev): -88.8672 -88.8672 -88.8521 -88.8521 -88.8440 -88.8440 -88.8440 -88.8440 1.6511 1.6511 4.6872 4.6872 5.3253 5.3253 5.9904 5.9904 6.4714 6.4714 6.4911 6.4911 6.5820 6.5820 6.7207 6.7207 6.7848 6.7848 7.3657 7.3657 7.7196 7.7196 7.8208 7.8208 8.3706 8.3706 8.3996 8.3996 8.9035 8.9035 9.7817 9.7817 16.0028 16.0028 16.8567 16.8567 16.9541 16.9541 k = 0.3491-0.2015 0.2850 ( 4448 PWs) bands (ev): -88.8668 -88.8668 -88.8525 -88.8525 -88.8440 -88.8440 -88.8440 -88.8440 1.7390 1.7390 4.6310 4.6310 5.3023 5.3023 5.9428 5.9428 6.4826 6.4826 6.4961 6.4961 6.6001 6.6001 6.7438 6.7438 6.8049 6.8049 7.3475 7.3475 7.7158 7.7158 7.8002 7.8002 8.3067 8.3067 8.3337 8.3337 8.8781 8.8781 9.7486 9.7486 16.0769 16.0769 16.9434 16.9434 16.9806 16.9806 k = 0.3585-0.2070 0.2927 ( 4440 PWs) bands (ev): -88.8664 -88.8664 -88.8529 -88.8529 -88.8440 -88.8440 -88.8440 -88.8440 1.8288 1.8288 4.5729 4.5729 5.2809 5.2809 5.8915 5.8915 6.4920 6.4920 6.5008 6.5008 6.6199 6.6199 6.7678 6.7678 6.8260 6.8260 7.3288 7.3288 7.7119 7.7119 7.7781 7.7781 8.2444 8.2444 8.2694 8.2694 8.8637 8.8637 9.7154 9.7154 16.1534 16.1534 17.0049 17.0049 17.0066 17.0066 k = 0.3679-0.2124 0.3004 ( 4428 PWs) bands (ev): -88.8659 -88.8659 -88.8533 -88.8533 -88.8440 -88.8440 -88.8440 -88.8440 1.9205 1.9205 4.5125 4.5125 5.2613 5.2613 5.8374 5.8374 6.5000 6.5000 6.5054 6.5054 6.6412 6.6412 6.7926 6.7926 6.8481 6.8481 7.3096 7.3096 7.7079 7.7079 7.7556 7.7556 8.1837 8.1837 8.2068 8.2068 8.8586 8.8586 9.6821 9.6821 16.2325 16.2325 17.0271 17.0271 17.0305 17.0305 k = 0.3774-0.2179 0.3081 ( 4428 PWs) bands (ev): -88.8655 -88.8655 -88.8538 -88.8538 -88.8440 -88.8440 -88.8440 -88.8440 2.0140 2.0140 4.4495 4.4495 5.2436 5.2436 5.7813 5.7813 6.5067 6.5067 6.5097 6.5097 6.6635 6.6635 6.8183 6.8183 6.8711 6.8711 7.2900 7.2900 7.7036 7.7036 7.7336 7.7336 8.1249 8.1249 8.1460 8.1460 8.8613 8.8613 9.6486 9.6486 16.3141 16.3141 17.0473 17.0473 17.0506 17.0506 k = 0.3868-0.2233 0.3158 ( 4436 PWs) bands (ev): -88.8651 -88.8651 -88.8542 -88.8542 -88.8440 -88.8440 -88.8440 -88.8440 2.1092 2.1092 4.3836 4.3836 5.2278 5.2278 5.7243 5.7243 6.5124 6.5124 6.5137 6.5137 6.6867 6.6867 6.8447 6.8447 6.8948 6.8948 7.2699 7.2699 7.6991 7.6991 7.7127 7.7127 8.0681 8.0681 8.0870 8.0870 8.8703 8.8703 9.6148 9.6148 16.3984 16.3984 17.0658 17.0658 17.0688 17.0688 k = 0.3962-0.2288 0.3235 ( 4444 PWs) bands (ev): -88.8646 -88.8646 -88.8546 -88.8546 -88.8440 -88.8440 -88.8440 -88.8440 2.2060 2.2060 4.3144 4.3144 5.2140 5.2140 5.6673 5.6673 6.5173 6.5173 6.5175 6.5175 6.7106 6.7106 6.8719 6.8719 6.9192 6.9192 7.2496 7.2496 7.6932 7.6932 7.6945 7.6945 8.0137 8.0137 8.0301 8.0301 8.8846 8.8846 9.5809 9.5809 16.4853 16.4853 17.0826 17.0826 17.0852 17.0852 k = 0.4057-0.2342 0.3312 ( 4444 PWs) bands (ev): -88.8642 -88.8642 -88.8551 -88.8551 -88.8440 -88.8440 -88.8440 -88.8440 2.3043 2.3043 4.2417 4.2417 5.2024 5.2024 5.6113 5.6113 6.5209 6.5209 6.5215 6.5215 6.7349 6.7349 6.8996 6.8996 6.9440 6.9440 7.2290 7.2290 7.6751 7.6751 7.6896 7.6896 7.9621 7.9621 7.9755 7.9755 8.9031 8.9031 9.5469 9.5469 16.5748 16.5748 17.0978 17.0978 17.1000 17.1000 k = 0.4151-0.2397 0.3389 ( 4436 PWs) bands (ev): -88.8638 -88.8638 -88.8555 -88.8555 -88.8440 -88.8440 -88.8440 -88.8440 2.4039 2.4039 4.1653 4.1653 5.1931 5.1931 5.5573 5.5573 6.5241 6.5241 6.5252 6.5252 6.7595 6.7595 6.9279 6.9279 6.9688 6.9688 7.2084 7.2084 7.6584 7.6584 7.6843 7.6843 7.9137 7.9137 7.9234 7.9234 8.9250 8.9250 9.5126 9.5126 16.6670 16.6670 17.1114 17.1114 17.1133 17.1133 k = 0.4245-0.2451 0.3466 ( 4440 PWs) bands (ev): -88.8633 -88.8633 -88.8560 -88.8560 -88.8440 -88.8440 -88.8440 -88.8440 2.5048 2.5048 4.0852 4.0852 5.1861 5.1861 5.5058 5.5058 6.5270 6.5270 6.5283 6.5283 6.7844 6.7844 6.9564 6.9564 6.9932 6.9932 7.1879 7.1879 7.6427 7.6427 7.6784 7.6784 7.8690 7.8690 7.8743 7.8743 8.9497 8.9497 9.4781 9.4781 16.7619 16.7619 17.1235 17.1235 17.1251 17.1251 k = 0.4340-0.2505 0.3543 ( 4428 PWs) bands (ev): -88.8629 -88.8629 -88.8564 -88.8564 -88.8440 -88.8440 -88.8440 -88.8440 2.6067 2.6067 4.0014 4.0014 5.1816 5.1816 5.4577 5.4577 6.5296 6.5296 6.5309 6.5309 6.8093 6.8093 6.9850 6.9850 7.0161 7.0161 7.1682 7.1682 7.6276 7.6276 7.6715 7.6715 7.8288 7.8288 7.8290 7.8290 8.9766 8.9766 9.4435 9.4435 16.8595 16.8595 17.1342 17.1342 17.1355 17.1355 k = 0.4434-0.2560 0.3620 ( 4432 PWs) bands (ev): -88.8624 -88.8624 -88.8569 -88.8569 -88.8440 -88.8440 -88.8440 -88.8440 2.7096 2.7096 3.9141 3.9141 5.1797 5.1797 5.4132 5.4132 6.5318 6.5318 6.5331 6.5331 6.8343 6.8343 7.0133 7.0133 7.0360 7.0360 7.1505 7.1505 7.6125 7.6125 7.6626 7.6626 7.7887 7.7887 7.7938 7.7938 9.0054 9.0054 9.4088 9.4088 16.9598 16.9598 17.1435 17.1435 17.1444 17.1444 k = 0.4528-0.2614 0.3697 ( 4424 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 2.8131 2.8131 3.8234 3.8234 5.1805 5.1805 5.3726 5.3726 6.5337 6.5337 6.5350 6.5350 6.8593 6.8593 7.0409 7.0409 7.0494 7.0494 7.1373 7.1373 7.5975 7.5975 7.6505 7.6505 7.7554 7.7554 7.7649 7.7649 9.0356 9.0356 9.3740 9.3740 17.0627 17.0627 17.1515 17.1515 17.1519 17.1519 k = 0.4623-0.2669 0.3774 ( 4424 PWs) bands (ev): -88.8615 -88.8615 -88.8578 -88.8578 -88.8440 -88.8440 -88.8440 -88.8440 2.9170 2.9170 3.7297 3.7297 5.1842 5.1842 5.3361 5.3361 6.5353 6.5353 6.5364 6.5364 6.8842 6.8842 7.0514 7.0514 7.0671 7.0671 7.1327 7.1327 7.5831 7.5831 7.6338 7.6338 7.7310 7.7310 7.7422 7.7422 9.0670 9.0670 9.3391 9.3391 17.1547 17.1547 17.1581 17.1581 17.1718 17.1718 k = 0.4717-0.2723 0.3851 ( 4424 PWs) bands (ev): -88.8610 -88.8610 -88.8583 -88.8583 -88.8440 -88.8440 -88.8440 -88.8440 3.0212 3.0212 3.6333 3.6333 5.1909 5.1909 5.3038 5.3038 6.5366 6.5366 6.5375 6.5375 6.9089 6.9089 7.0412 7.0412 7.0912 7.0912 7.1362 7.1362 7.5705 7.5705 7.6134 7.6134 7.7157 7.7157 7.7255 7.7255 9.0994 9.0994 9.3043 9.3043 17.1620 17.1620 17.1629 17.1629 17.2781 17.2781 k = 0.4811-0.2778 0.3928 ( 4440 PWs) bands (ev): -88.8606 -88.8606 -88.8587 -88.8587 -88.8440 -88.8440 -88.8440 -88.8440 3.1254 3.1254 3.5347 3.5347 5.2008 5.2008 5.2755 5.2755 6.5376 6.5376 6.5382 6.5382 6.9332 6.9332 7.0238 7.0238 7.1120 7.1120 7.1413 7.1413 7.5618 7.5618 7.5926 7.5926 7.7073 7.7073 7.7141 7.7141 9.1325 9.1325 9.2694 9.2694 17.1658 17.1658 17.1662 17.1662 17.3894 17.3894 k = 0.4906-0.2832 0.4005 ( 4436 PWs) bands (ev): -88.8601 -88.8601 -88.8592 -88.8592 -88.8440 -88.8440 -88.8440 -88.8440 3.2291 3.2291 3.4341 3.4341 5.2140 5.2140 5.2512 5.2512 6.5382 6.5382 6.5385 6.5385 6.9572 6.9572 7.0030 7.0030 7.1283 7.1283 7.1430 7.1430 7.5591 7.5591 7.5751 7.5751 7.7036 7.7036 7.7070 7.7070 9.1662 9.1662 9.2348 9.2348 17.1680 17.1680 17.1682 17.1682 17.5037 17.5037 k = 0.5000-0.2887 0.4082 ( 4432 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3322 3.3322 3.3322 3.3322 5.2308 5.2308 5.2308 5.2308 6.5386 6.5386 6.5386 6.5386 6.9806 6.9806 6.9806 6.9806 7.1388 7.1388 7.1388 7.1388 7.5635 7.5635 7.5635 7.5635 7.7036 7.7036 7.7036 7.7036 9.2003 9.2003 9.2003 9.2003 17.1688 17.1688 17.1688 17.1688 17.6208 17.6208 k = 0.5000-0.2887 0.4082 ( 4432 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3322 3.3322 3.3322 3.3322 5.2308 5.2308 5.2308 5.2308 6.5386 6.5386 6.5386 6.5386 6.9806 6.9806 6.9806 6.9806 7.1388 7.1388 7.1388 7.1388 7.5635 7.5635 7.5635 7.5635 7.7036 7.7036 7.7036 7.7036 9.2003 9.2003 9.2003 9.2003 17.1688 17.1688 17.1688 17.1688 17.6208 17.6208 k = 0.5000-0.2780 0.4158 ( 4440 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3331 3.3331 3.3332 3.3332 5.2283 5.2283 5.2286 5.2286 6.5360 6.5360 6.5407 6.5407 6.9678 6.9678 6.9874 6.9874 7.1359 7.1359 7.1468 7.1468 7.5614 7.5614 7.5657 7.5657 7.7028 7.7028 7.7042 7.7042 9.2040 9.2040 9.2058 9.2058 17.1355 17.1355 17.1377 17.1377 17.6399 17.6399 k = 0.5000-0.2673 0.4234 ( 4424 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3358 3.3358 3.3361 3.3361 5.2213 5.2213 5.2219 5.2219 6.5330 6.5330 6.5424 6.5424 6.9510 6.9510 6.9869 6.9869 7.1394 7.1394 7.1580 7.1580 7.5595 7.5595 7.5679 7.5679 7.7016 7.7016 7.7046 7.7046 9.2170 9.2170 9.2205 9.2205 17.0528 17.0528 17.0560 17.0560 17.6880 17.6880 k = 0.5000-0.2566 0.4309 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3405 3.3405 3.3409 3.3409 5.2098 5.2098 5.2107 5.2107 6.5298 6.5298 6.5437 6.5437 6.9319 6.9319 6.9797 6.9797 7.1489 7.1489 7.1708 7.1708 7.5578 7.5578 7.5701 7.5701 7.7000 7.7000 7.7047 7.7047 9.2389 9.2389 9.2441 9.2441 16.9422 16.9422 16.9454 16.9454 17.7443 17.7443 k = 0.5000-0.2459 0.4385 ( 4414 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3471 3.3471 3.3476 3.3476 5.1938 5.1938 5.1950 5.1950 6.5263 6.5263 6.5445 6.5445 6.9118 6.9118 6.9676 6.9676 7.1625 7.1625 7.1840 7.1840 7.5562 7.5562 7.5722 7.5722 7.6980 7.6980 7.7047 7.7047 9.2696 9.2696 9.2763 9.2763 16.8158 16.8158 16.8186 16.8186 17.7977 17.7977 k = 0.5000-0.2352 0.4460 ( 4414 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3555 3.3555 3.3561 3.3561 5.1737 5.1737 5.1752 5.1752 6.5225 6.5225 6.5448 6.5448 6.8915 6.8915 6.9527 6.9527 7.1785 7.1785 7.1972 7.1972 7.5549 7.5549 7.5742 7.5742 7.6957 7.6957 7.7045 7.7045 9.3086 9.3086 9.3167 9.3167 16.6797 16.6797 16.6821 16.6821 17.8444 17.8444 k = 0.5000-0.2245 0.4536 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3657 3.3657 3.3665 3.3665 5.1495 5.1495 5.1513 5.1513 6.5186 6.5186 6.5446 6.5446 6.8715 6.8715 6.9362 6.9362 7.1957 7.1957 7.2099 7.2099 7.5538 7.5538 7.5760 7.5760 7.6928 7.6928 7.7042 7.7042 9.3555 9.3555 9.3648 9.3648 16.5374 16.5374 16.5392 16.5392 17.8837 17.8837 k = 0.5000-0.2138 0.4612 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3778 3.3778 3.3788 3.3788 5.1215 5.1215 5.1236 5.1236 6.5147 6.5147 6.5440 6.5440 6.8523 6.8523 6.9191 6.9191 7.2133 7.2133 7.2220 7.2220 7.5528 7.5528 7.5774 7.5774 7.6896 7.6896 7.7038 7.7038 9.4096 9.4096 9.4200 9.4200 16.3910 16.3910 16.3923 16.3923 17.9166 17.9166 k = 0.5000-0.2031 0.4687 ( 4416 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3917 3.3917 3.3928 3.3928 5.0901 5.0901 5.0925 5.0925 6.5107 6.5107 6.5429 6.5429 6.8341 6.8341 6.9021 6.9021 7.2309 7.2309 7.2335 7.2335 7.5520 7.5520 7.5787 7.5787 7.6859 7.6859 7.7033 7.7033 9.4704 9.4704 9.4817 9.4817 16.2419 16.2419 16.2427 16.2427 17.9444 17.9444 k = 0.5000-0.1925 0.4763 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.4073 3.4073 3.4085 3.4085 5.0555 5.0555 5.0582 5.0582 6.5067 6.5067 6.5415 6.5415 6.8171 6.8171 6.8855 6.8855 7.2443 7.2443 7.2482 7.2482 7.5513 7.5513 7.5796 7.5796 7.6817 7.6817 7.7028 7.7028 9.5371 9.5371 9.5492 9.5492 16.0914 16.0914 16.0916 16.0916 17.9681 17.9682 k = 0.5000-0.1818 0.4838 ( 4408 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.4245 3.4245 3.4260 3.4260 5.0180 5.0180 5.0211 5.0211 6.5029 6.5029 6.5397 6.5397 6.8014 6.8014 6.8696 6.8696 7.2544 7.2544 7.2652 7.2652 7.5508 7.5508 7.5802 7.5802 7.6771 7.6771 7.7021 7.7021 9.6091 9.6091 9.6219 9.6219 15.9401 15.9401 15.9404 15.9404 17.9890 17.9890 k = 0.5000-0.1711 0.4914 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.4435 3.4435 3.4451 3.4451 4.9782 4.9782 4.9816 4.9816 6.4991 6.4991 6.5376 6.5376 6.7871 6.7871 6.8546 6.8546 7.2639 7.2639 7.2817 7.2817 7.5504 7.5504 7.5806 7.5806 7.6721 7.6721 7.7014 7.7014 9.6856 9.6856 9.6989 9.6989 15.7890 15.7890 15.7897 15.7897 18.0076 18.0076 k = 0.5000-0.1604 0.4990 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.4639 3.4639 3.4658 3.4658 4.9362 4.9362 4.9400 4.9400 6.4955 6.4955 6.5352 6.5352 6.7741 6.7741 6.8404 6.8404 7.2728 7.2728 7.2978 7.2978 7.5500 7.5500 7.5807 7.5807 7.6667 7.6667 7.7005 7.7005 9.7658 9.7658 9.7796 9.7796 15.6390 15.6390 15.6402 15.6402 18.0245 18.0245 k = 0.5000-0.1497 0.5065 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.4858 3.4858 3.4880 3.4880 4.8926 4.8926 4.8967 4.8967 6.4922 6.4922 6.5327 6.5327 6.7624 6.7624 6.8273 6.8273 7.2812 7.2812 7.3133 7.3133 7.5497 7.5497 7.5806 7.5806 7.6609 7.6609 7.6997 7.6997 9.8489 9.8489 9.8632 9.8632 15.4909 15.4909 15.4926 15.4926 18.0402 18.0402 k = 0.5000-0.1390 0.5141 ( 4416 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.5091 3.5091 3.5115 3.5115 4.8477 4.8477 4.8522 4.8522 6.4890 6.4890 6.5302 6.5302 6.7520 6.7520 6.8152 6.8152 7.2891 7.2891 7.3284 7.3284 7.5494 7.5494 7.5803 7.5803 7.6547 7.6547 7.6987 7.6987 9.9341 9.9341 9.9488 9.9488 15.3456 15.3456 15.3478 15.3478 18.0548 18.0548 k = 0.5000-0.1283 0.5217 ( 4428 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.5336 3.5336 3.5363 3.5363 4.8020 4.8020 4.8068 4.8068 6.4861 6.4861 6.5275 6.5275 6.7427 6.7427 6.8042 6.8042 7.2964 7.2964 7.3430 7.3430 7.5492 7.5492 7.5799 7.5799 7.6482 7.6482 7.6977 7.6977 10.0205 10.0205 10.0355 10.0355 15.2038 15.2038 15.2065 15.2065 18.0686 18.0686 k = 0.5000-0.1176 0.5292 ( 4416 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.5592 3.5592 3.5622 3.5622 4.7558 4.7558 4.7611 4.7611 6.4835 6.4835 6.5249 6.5249 6.7346 6.7346 6.7941 6.7941 7.3033 7.3033 7.3572 7.3572 7.5491 7.5491 7.5793 7.5793 7.6414 7.6414 7.6967 7.6967 10.1071 10.1071 10.1225 10.1225 15.0664 15.0664 15.0696 15.0696 18.0816 18.0816 k = 0.5000-0.1069 0.5368 ( 4424 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.5856 3.5856 3.5889 3.5889 4.7097 4.7097 4.7154 4.7154 6.4811 6.4811 6.5224 6.5224 6.7275 6.7275 6.7850 6.7851 7.3097 7.3097 7.3708 7.3708 7.5490 7.5490 7.5787 7.5787 7.6344 7.6344 7.6956 7.6956 10.1930 10.1930 10.2088 10.2088 14.9344 14.9344 14.9380 14.9380 18.0939 18.0939 k = 0.5000-0.0962 0.5443 ( 4428 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.6125 3.6125 3.6163 3.6163 4.6641 4.6641 4.6703 4.6703 6.4790 6.4790 6.5201 6.5201 6.7213 6.7213 6.7769 6.7769 7.3155 7.3156 7.3839 7.3839 7.5489 7.5489 7.5780 7.5780 7.6271 7.6271 7.6946 7.6946 10.2770 10.2770 10.2931 10.2931 14.8088 14.8088 14.8129 14.8129 18.1054 18.1054 k = 0.5000-0.0855 0.5519 ( 4428 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.6398 3.6398 3.6440 3.6440 4.6196 4.6196 4.6264 4.6264 6.4771 6.4771 6.5178 6.5178 6.7159 6.7159 6.7698 6.7698 7.3209 7.3209 7.3964 7.3964 7.5489 7.5489 7.5772 7.5772 7.6196 7.6196 7.6936 7.6936 10.3580 10.3580 10.3744 10.3744 14.6907 14.6907 14.6954 14.6954 18.1161 18.1161 k = 0.5000-0.0748 0.5595 ( 4430 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.6668 3.6668 3.6715 3.6715 4.5768 4.5768 4.5841 4.5841 6.4754 6.4754 6.5158 6.5158 6.7114 6.7114 6.7635 6.7635 7.3257 7.3257 7.4082 7.4082 7.5490 7.5490 7.5765 7.5765 7.6121 7.6122 7.6926 7.6926 10.4345 10.4345 10.4514 10.4514 14.5814 14.5814 14.5866 14.5866 18.1258 18.1258 k = 0.5000-0.0642 0.5670 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.6931 3.6931 3.6984 3.6984 4.5364 4.5364 4.5443 4.5443 6.4740 6.4740 6.5141 6.5141 6.7076 6.7076 6.7581 6.7581 7.3300 7.3300 7.4193 7.4193 7.5492 7.5492 7.5757 7.5757 7.6047 7.6047 7.6917 7.6917 10.5053 10.5053 10.5225 10.5225 14.4824 14.4824 14.4880 14.4880 18.1345 18.1345 k = 0.5000-0.0535 0.5746 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7180 3.7180 3.7239 3.7239 4.4992 4.4992 4.5077 4.5077 6.4729 6.4729 6.5125 6.5125 6.7044 6.7044 6.7536 6.7536 7.3336 7.3336 7.4295 7.4295 7.5495 7.5495 7.5751 7.5751 7.5974 7.5974 7.6909 7.6909 10.5688 10.5688 10.5863 10.5863 14.3949 14.3949 14.4010 14.4010 18.1422 18.1422 k = 0.5000-0.0428 0.5821 ( 4418 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7406 3.7407 3.7471 3.7471 4.4662 4.4662 4.4754 4.4754 6.4719 6.4719 6.5112 6.5112 6.7019 6.7019 6.7500 6.7500 7.3367 7.3367 7.4385 7.4385 7.5499 7.5499 7.5745 7.5745 7.5906 7.5906 7.6902 7.6902 10.6235 10.6235 10.6413 10.6413 14.3207 14.3207 14.3272 14.3272 18.1486 18.1486 k = 0.5000-0.0321 0.5897 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7600 3.7600 3.7671 3.7671 4.4386 4.4386 4.4484 4.4484 6.4712 6.4712 6.5102 6.5102 6.6999 6.6999 6.7471 6.7471 7.3391 7.3391 7.4461 7.4461 7.5505 7.5505 7.5740 7.5740 7.5844 7.5844 7.6897 7.6897 10.6679 10.6679 10.6860 10.6860 14.2610 14.2610 14.2679 14.2679 18.1537 18.1537 k = 0.5000-0.0214 0.5973 ( 4412 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7750 3.7750 3.7825 3.7825 4.4176 4.4176 4.4279 4.4279 6.4707 6.4707 6.5095 6.5095 6.6986 6.6986 6.7451 6.7451 7.3408 7.3408 7.4519 7.4519 7.5513 7.5513 7.5737 7.5737 7.5792 7.5793 7.6893 7.6893 10.7007 10.7007 10.7191 10.7191 14.2173 14.2173 14.2244 14.2244 18.1574 18.1574 k = 0.5000-0.0107 0.6048 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7845 3.7845 3.7924 3.7924 4.4044 4.4044 4.4151 4.4151 6.4704 6.4704 6.5091 6.5091 6.6977 6.6977 6.7439 6.7439 7.3419 7.3419 7.4556 7.4556 7.5519 7.5519 7.5735 7.5735 7.5757 7.5757 7.6890 7.6890 10.7209 10.7209 10.7394 10.7394 14.1905 14.1905 14.1979 14.1979 18.1596 18.1596 k = 0.5000-0.0000 0.6124 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7878 3.7878 3.7958 3.7958 4.3999 4.3999 4.4107 4.4107 6.4703 6.4703 6.5089 6.5090 6.6975 6.6975 6.7435 6.7435 7.3422 7.3422 7.4569 7.4569 7.5522 7.5522 7.5734 7.5734 7.5745 7.5745 7.6890 7.6890 10.7277 10.7277 10.7462 10.7462 14.1816 14.1816 14.1889 14.1889 18.1604 18.1604 k = 0.5000-0.0000 0.6124 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7878 3.7878 3.7958 3.7958 4.3999 4.3999 4.4107 4.4107 6.4703 6.4703 6.5089 6.5090 6.6975 6.6975 6.7435 6.7435 7.3422 7.3422 7.4569 7.4569 7.5522 7.5522 7.5734 7.5734 7.5745 7.5745 7.6890 7.6890 10.7277 10.7277 10.7462 10.7462 14.1816 14.1816 14.1889 14.1889 18.1604 18.1604 k = 0.4934 0.0114 0.6124 ( 4416 PWs) bands (ev): -88.8599 -88.8599 -88.8594 -88.8594 -88.8440 -88.8440 -88.8440 -88.8440 3.7667 3.7667 3.8103 3.8103 4.3575 4.3575 4.4618 4.4618 6.4666 6.4666 6.5125 6.5125 6.6976 6.6976 6.7440 6.7440 7.3381 7.3381 7.4576 7.4576 7.5525 7.5525 7.5662 7.5662 7.5849 7.5849 7.6896 7.6896 10.6663 10.6663 10.8014 10.8014 14.1845 14.1845 14.1945 14.1945 18.0969 18.0969 k = 0.4868 0.0228 0.6124 ( 4412 PWs) bands (ev): -88.8601 -88.8601 -88.8592 -88.8592 -88.8440 -88.8440 -88.8440 -88.8440 3.7433 3.7433 3.8163 3.8163 4.3124 4.3124 4.5306 4.5306 6.4571 6.4571 6.5212 6.5212 6.6979 6.6979 6.7453 6.7453 7.3260 7.3260 7.4606 7.4606 7.5493 7.5493 7.5660 7.5660 7.5977 7.5977 7.6917 7.6917 10.5873 10.5873 10.8624 10.8624 14.1972 14.1972 14.2065 14.2065 18.0264 18.0264 k = 0.4803 0.0342 0.6124 ( 4419 PWs) bands (ev): -88.8603 -88.8603 -88.8590 -88.8590 -88.8440 -88.8440 -88.8440 -88.8440 3.7210 3.7210 3.8138 3.8138 4.2695 4.2695 4.6086 4.6086 6.4448 6.4448 6.5327 6.5327 6.6987 6.6987 6.7472 6.7472 7.3075 7.3075 7.4654 7.4654 7.5423 7.5423 7.5731 7.5731 7.6118 7.6118 7.6951 7.6951 10.4998 10.4998 10.9207 10.9207 14.2180 14.2180 14.2257 14.2257 17.9536 17.9536 k = 0.4737 0.0456 0.6124 ( 4425 PWs) bands (ev): -88.8605 -88.8605 -88.8588 -88.8588 -88.8440 -88.8440 -88.8440 -88.8440 3.7000 3.7000 3.8058 3.8058 4.2290 4.2290 4.6922 4.6922 6.4308 6.4308 6.5456 6.5456 6.6998 6.6998 6.7497 6.7497 7.2849 7.2849 7.4703 7.4703 7.5346 7.5346 7.5839 7.5839 7.6269 7.6269 7.7001 7.7001 10.4052 10.4052 10.9759 10.9759 14.2401 14.2401 14.2577 14.2577 17.8787 17.8787 k = 0.4671 0.0570 0.6124 ( 4424 PWs) bands (ev): -88.8606 -88.8606 -88.8586 -88.8586 -88.8440 -88.8440 -88.8440 -88.8440 3.6801 3.6801 3.7945 3.7945 4.1909 4.1909 4.7791 4.7791 6.4157 6.4157 6.5595 6.5595 6.7014 6.7014 6.7527 6.7527 7.2598 7.2598 7.4744 7.4744 7.5268 7.5268 7.5965 7.5965 7.6435 7.6435 7.7069 7.7069 10.3046 10.3046 11.0280 11.0280 14.2643 14.2643 14.3001 14.3001 17.8019 17.8019 k = 0.4605 0.0684 0.6124 ( 4422 PWs) bands (ev): -88.8608 -88.8608 -88.8584 -88.8584 -88.8440 -88.8440 -88.8440 -88.8440 3.6616 3.6616 3.7812 3.7812 4.1552 4.1552 4.8672 4.8672 6.3999 6.3999 6.5740 6.5740 6.7033 6.7033 6.7561 6.7561 7.2333 7.2333 7.4772 7.4772 7.5190 7.5190 7.6094 7.6094 7.6613 7.6613 7.7163 7.7163 10.1994 10.1994 11.0765 11.0765 14.2918 14.2918 14.3502 14.3502 17.7234 17.7234 k = 0.4539 0.0798 0.6124 ( 4425 PWs) bands (ev): -88.8610 -88.8610 -88.8583 -88.8583 -88.8440 -88.8440 -88.8440 -88.8440 3.6443 3.6443 3.7671 3.7671 4.1221 4.1221 4.9552 4.9552 6.3835 6.3835 6.5892 6.5892 6.7055 6.7055 6.7600 6.7600 7.2061 7.2061 7.4790 7.4790 7.5112 7.5112 7.6214 7.6214 7.6792 7.6792 7.7302 7.7302 10.0908 10.0908 11.1215 11.1215 14.3221 14.3221 14.4067 14.4067 17.6436 17.6436 k = 0.4474 0.0912 0.6124 ( 4425 PWs) bands (ev): -88.8611 -88.8611 -88.8581 -88.8581 -88.8440 -88.8440 -88.8440 -88.8440 3.6283 3.6283 3.7529 3.7529 4.0915 4.0915 5.0417 5.0417 6.3667 6.3667 6.6048 6.6048 6.7080 6.7080 6.7643 6.7643 7.1787 7.1787 7.4799 7.4799 7.5035 7.5035 7.6320 7.6320 7.6946 7.6946 7.7510 7.7510 9.9802 9.9802 11.1628 11.1628 14.3549 14.3549 14.4682 14.4682 17.5630 17.5630 k = 0.4408 0.1026 0.6124 ( 4423 PWs) bands (ev): -88.8613 -88.8613 -88.8580 -88.8580 -88.8440 -88.8440 -88.8440 -88.8440 3.6137 3.6137 3.7390 3.7390 4.0635 4.0635 5.1257 5.1257 6.3495 6.3495 6.6206 6.6206 6.7109 6.7109 6.7689 6.7689 7.1512 7.1512 7.4801 7.4801 7.4961 7.4961 7.6412 7.6412 7.7064 7.7064 7.7793 7.7793 9.8687 9.8687 11.2004 11.2004 14.3895 14.3895 14.5334 14.5334 17.4821 17.4821 k = 0.4342 0.1140 0.6124 ( 4419 PWs) bands (ev): -88.8614 -88.8614 -88.8579 -88.8579 -88.8440 -88.8440 -88.8440 -88.8440 3.6004 3.6004 3.7258 3.7258 4.0380 4.0380 5.2064 5.2064 6.3321 6.3321 6.6365 6.6365 6.7141 6.7141 6.7739 6.7739 7.1240 7.1240 7.4795 7.4795 7.4891 7.4891 7.6491 7.6491 7.7156 7.7156 7.8134 7.8134 9.7577 9.7577 11.2342 11.2342 14.4252 14.4252 14.6007 14.6007 17.4018 17.4018 k = 0.4276 0.1253 0.6124 ( 4423 PWs) bands (ev): -88.8615 -88.8615 -88.8578 -88.8578 -88.8440 -88.8440 -88.8440 -88.8440 3.5885 3.5885 3.7135 3.7135 4.0152 4.0152 5.2827 5.2827 6.3145 6.3145 6.6520 6.6520 6.7179 6.7179 6.7792 6.7792 7.0974 7.0974 7.4774 7.4774 7.4838 7.4838 7.6559 7.6559 7.7232 7.7232 7.8518 7.8518 9.6485 9.6485 11.2643 11.2643 14.4612 14.4612 14.6688 14.6688 17.3230 17.3230 k = 0.4211 0.1367 0.6124 ( 4421 PWs) bands (ev): -88.8616 -88.8616 -88.8577 -88.8577 -88.8440 -88.8440 -88.8440 -88.8440 3.5779 3.5779 3.7024 3.7024 3.9950 3.9950 5.3539 5.3539 6.2970 6.2970 6.6666 6.6666 6.7227 6.7227 6.7845 6.7845 7.0714 7.0714 7.4725 7.4725 7.4815 7.4815 7.6617 7.6617 7.7297 7.7297 7.8931 7.8931 9.5425 9.5425 11.2906 11.2906 14.4964 14.4964 14.7361 14.7361 17.2470 17.2470 k = 0.4145 0.1481 0.6124 ( 4421 PWs) bands (ev): -88.8617 -88.8617 -88.8576 -88.8576 -88.8440 -88.8440 -88.8440 -88.8440 3.5688 3.5688 3.6925 3.6925 3.9775 3.9775 5.4190 5.4190 6.2799 6.2799 6.6793 6.6793 6.7292 6.7292 6.7898 6.7898 7.0464 7.0464 7.4667 7.4667 7.4805 7.4805 7.6667 7.6667 7.7352 7.7352 7.9363 7.9363 9.4415 9.4415 11.3133 11.3133 14.5299 14.5299 14.8007 14.8007 17.1751 17.1751 k = 0.4079 0.1595 0.6124 ( 4422 PWs) bands (ev): -88.8618 -88.8618 -88.8575 -88.8575 -88.8440 -88.8440 -88.8440 -88.8440 3.5610 3.5610 3.6840 3.6840 3.9627 3.9627 5.4770 5.4770 6.2635 6.2635 6.6891 6.6891 6.7381 6.7381 6.7948 6.7948 7.0227 7.0227 7.4612 7.4612 7.4799 7.4799 7.6708 7.6708 7.7398 7.7398 7.9800 7.9800 9.3475 9.3475 11.3323 11.3323 14.5606 14.5606 14.8609 14.8609 17.1092 17.1092 k = 0.4013 0.1709 0.6124 ( 4420 PWs) bands (ev): -88.8618 -88.8618 -88.8575 -88.8575 -88.8440 -88.8440 -88.8440 -88.8440 3.5546 3.5546 3.6770 3.6770 3.9505 3.9505 5.5269 5.5269 6.2484 6.2484 6.6959 6.6959 6.7491 6.7491 6.7994 6.7994 7.0008 7.0008 7.4565 7.4565 7.4794 7.4794 7.6742 7.6742 7.7436 7.7436 8.0224 8.0224 9.2629 9.2629 11.3478 11.3478 14.5875 14.5875 14.9144 14.9144 17.0510 17.0510 k = 0.3947 0.1823 0.6124 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5496 3.5496 3.6715 3.6715 3.9411 3.9411 5.5675 5.5675 6.2352 6.2352 6.7001 6.7001 6.7609 6.7609 6.8033 6.8033 6.9814 6.9814 7.4525 7.4525 7.4790 7.4790 7.6768 7.6768 7.7466 7.7466 8.0609 8.0609 9.1909 9.1909 11.3598 11.3598 14.6096 14.6096 14.9592 14.9592 17.0027 17.0027 k = 0.3882 0.1937 0.6124 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5461 3.5461 3.6675 3.6675 3.9343 3.9343 5.5977 5.5977 6.2249 6.2249 6.7027 6.7027 6.7716 6.7716 6.8063 6.8063 6.9657 6.9657 7.4496 7.4496 7.4787 7.4787 7.6786 7.6786 7.7487 7.7487 8.0924 8.0924 9.1351 9.1351 11.3683 11.3683 14.6261 14.6261 14.9931 14.9931 16.9663 16.9663 k = 0.3816 0.2051 0.6124 ( 4426 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5439 3.5439 3.6651 3.6651 3.9302 3.9302 5.6164 5.6164 6.2182 6.2182 6.7041 6.7041 6.7792 6.7792 6.8083 6.8083 6.9551 6.9551 7.4479 7.4479 7.4786 7.4786 7.6798 7.6798 7.7500 7.7500 8.1133 8.1133 9.0995 9.0995 11.3734 11.3734 14.6363 14.6363 15.0143 15.0143 16.9436 16.9436 k = 0.3750 0.2165 0.6124 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.3750 0.2165 0.6124 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.3683 0.2126 0.6014 ( 4420 PWs) bands (ev): -88.8622 -88.8622 -88.8571 -88.8571 -88.8440 -88.8440 -88.8440 -88.8440 3.4977 3.4977 3.6996 3.6996 3.9001 3.9001 5.6621 5.6621 6.1964 6.1964 6.6980 6.6980 6.7847 6.7847 6.8026 6.8026 6.9558 6.9558 7.4363 7.4363 7.4637 7.4637 7.6851 7.6851 7.7572 7.7572 8.1949 8.1949 9.0718 9.0718 11.5432 11.5432 14.5064 14.5064 14.9097 14.9097 16.8765 16.8765 k = 0.3616 0.2088 0.5905 ( 4430 PWs) bands (ev): -88.8624 -88.8624 -88.8569 -88.8569 -88.8440 -88.8440 -88.8440 -88.8440 3.4265 3.4265 3.7365 3.7365 3.8986 3.8986 5.7024 5.7024 6.1776 6.1776 6.6904 6.6904 6.7851 6.7851 6.7970 6.7970 6.9640 6.9640 7.4225 7.4225 7.4520 7.4520 7.6901 7.6901 7.7646 7.7646 8.2709 8.2709 9.0551 9.0551 11.7117 11.7117 14.3750 14.3750 14.8017 14.8017 16.8163 16.8163 k = 0.3549 0.2049 0.5796 ( 4428 PWs) bands (ev): -88.8627 -88.8627 -88.8566 -88.8566 -88.8440 -88.8440 -88.8440 -88.8440 3.3386 3.3386 3.7749 3.7749 3.9159 3.9159 5.7435 5.7435 6.1597 6.1597 6.6821 6.6821 6.7828 6.7828 6.7920 6.7920 6.9758 6.9758 7.4051 7.4051 7.4441 7.4441 7.6952 7.6952 7.7727 7.7727 8.3489 8.3489 9.0370 9.0370 11.8799 11.8799 14.2456 14.2456 14.6975 14.6975 16.7557 16.7557 k = 0.3482 0.2010 0.5686 ( 4432 PWs) bands (ev): -88.8629 -88.8629 -88.8563 -88.8563 -88.8440 -88.8440 -88.8440 -88.8440 3.2416 3.2416 3.8149 3.8149 3.9445 3.9445 5.7850 5.7850 6.1426 6.1426 6.6734 6.6734 6.7785 6.7785 6.7871 6.7871 6.9904 6.9904 7.3855 7.3855 7.4396 7.4396 7.7001 7.7001 7.7817 7.7817 8.4287 8.4287 9.0176 9.0176 12.0473 12.0473 14.1182 14.1182 14.5973 14.5973 16.6948 16.6948 k = 0.3415 0.1972 0.5577 ( 4430 PWs) bands (ev): -88.8632 -88.8632 -88.8561 -88.8561 -88.8440 -88.8440 -88.8440 -88.8440 3.1399 3.1399 3.8563 3.8563 3.9801 3.9801 5.8267 5.8267 6.1266 6.1266 6.6645 6.6645 6.7730 6.7730 6.7818 6.7819 7.0071 7.0071 7.3647 7.3647 7.4378 7.4378 7.7050 7.7050 7.7917 7.7917 8.5102 8.5102 8.9968 8.9968 12.2133 12.2133 13.9930 13.9930 14.5012 14.5012 16.6338 16.6338 k = 0.3348 0.1933 0.5468 ( 4426 PWs) bands (ev): -88.8635 -88.8635 -88.8558 -88.8558 -88.8440 -88.8440 -88.8440 -88.8440 3.0359 3.0359 3.8991 3.8991 4.0206 4.0206 5.8679 5.8679 6.1116 6.1116 6.6554 6.6554 6.7667 6.7667 6.7763 6.7763 7.0252 7.0252 7.3434 7.3434 7.4387 7.4387 7.7098 7.7098 7.8027 7.8027 8.5934 8.5934 8.9747 8.9747 12.3774 12.3774 13.8699 13.8699 14.4093 14.4093 16.5727 16.5727 k = 0.3281 0.1894 0.5358 ( 4426 PWs) bands (ev): -88.8638 -88.8638 -88.8555 -88.8555 -88.8440 -88.8440 -88.8440 -88.8440 2.9309 2.9309 3.9434 3.9434 4.0646 4.0646 5.9082 5.9082 6.0981 6.0981 6.6462 6.6462 6.7594 6.7594 6.7707 6.7707 7.0436 7.0436 7.3224 7.3224 7.4424 7.4424 7.7143 7.7143 7.8148 7.8148 8.6781 8.6781 8.9514 8.9514 12.5389 12.5389 13.7491 13.7491 14.3217 14.3217 16.5117 16.5117 k = 0.3214 0.1856 0.5249 ( 4436 PWs) bands (ev): -88.8641 -88.8641 -88.8552 -88.8552 -88.8440 -88.8440 -88.8440 -88.8440 2.8257 2.8257 3.9889 3.9889 4.1114 4.1114 5.9464 5.9464 6.0866 6.0866 6.6369 6.6369 6.7515 6.7515 6.7654 6.7654 7.0613 7.0613 7.3024 7.3024 7.4494 7.4494 7.7186 7.7186 7.8283 7.8283 8.7634 8.7634 8.9278 8.9278 12.6971 12.6971 13.6305 13.6305 14.2383 14.2383 16.4510 16.4510 k = 0.3147 0.1817 0.5140 ( 4436 PWs) bands (ev): -88.8644 -88.8644 -88.8549 -88.8549 -88.8440 -88.8440 -88.8440 -88.8440 2.7208 2.7208 4.0358 4.0358 4.1606 4.1606 5.9804 5.9804 6.0789 6.0789 6.6274 6.6274 6.7429 6.7429 6.7602 6.7602 7.0767 7.0767 7.2848 7.2848 7.4599 7.4599 7.7227 7.7227 7.8432 7.8432 8.8429 8.8429 8.9103 8.9103 12.8514 12.8514 13.5142 13.5142 14.1593 14.1593 16.3906 16.3906 k = 0.3080 0.1778 0.5030 ( 4438 PWs) bands (ev): -88.8647 -88.8647 -88.8546 -88.8546 -88.8440 -88.8440 -88.8440 -88.8440 2.6167 2.6167 4.0839 4.0839 4.2118 4.2118 6.0051 6.0051 6.0797 6.0797 6.6179 6.6179 6.7340 6.7340 6.7552 6.7552 7.0878 7.0878 7.2716 7.2716 7.4744 7.4744 7.7266 7.7266 7.8596 7.8596 8.8586 8.8586 8.9569 8.9569 13.0010 13.0010 13.4003 13.4003 14.0847 14.0847 16.3307 16.3307 k = 0.3013 0.1740 0.4921 ( 4436 PWs) bands (ev): -88.8650 -88.8650 -88.8543 -88.8543 -88.8440 -88.8440 -88.8440 -88.8440 2.5137 2.5137 4.1332 4.1332 4.2647 4.2647 6.0143 6.0143 6.0947 6.0947 6.6082 6.6082 6.7249 6.7249 6.7502 6.7502 7.0919 7.0919 7.2652 7.2652 7.4932 7.4932 7.7303 7.7303 7.8778 7.8778 8.8333 8.8333 9.0448 9.0448 13.1453 13.1453 13.2887 13.2887 14.0145 14.0145 16.2713 16.2713 k = 0.2946 0.1701 0.4811 ( 4432 PWs) bands (ev): -88.8653 -88.8653 -88.8540 -88.8540 -88.8440 -88.8440 -88.8440 -88.8440 2.4118 2.4118 4.1837 4.1837 4.3193 4.3193 6.0121 6.0121 6.1195 6.1195 6.5985 6.5985 6.7157 6.7157 6.7453 6.7453 7.0873 7.0873 7.2672 7.2672 7.5167 7.5167 7.7337 7.7337 7.8978 7.8978 8.8030 8.8030 9.1380 9.1380 13.1794 13.1794 13.2836 13.2836 13.9487 13.9487 16.2125 16.2125 k = 0.2879 0.1662 0.4702 ( 4432 PWs) bands (ev): -88.8656 -88.8656 -88.8537 -88.8537 -88.8440 -88.8440 -88.8440 -88.8440 2.3113 2.3113 4.2352 4.2352 4.3753 4.3753 6.0057 6.0057 6.1465 6.1465 6.5886 6.5886 6.7063 6.7063 6.7403 6.7403 7.0746 7.0746 7.2769 7.2769 7.5453 7.5453 7.7370 7.7370 7.9198 7.9198 8.7705 8.7705 9.2337 9.2337 13.0726 13.0726 13.4149 13.4149 13.8875 13.8875 16.1545 16.1545 k = 0.2812 0.1624 0.4593 ( 4432 PWs) bands (ev): -88.8659 -88.8659 -88.8534 -88.8534 -88.8440 -88.8440 -88.8440 -88.8440 2.2123 2.2123 4.2878 4.2878 4.4325 4.4325 5.9981 5.9981 6.1723 6.1723 6.5787 6.5787 6.6970 6.6970 6.7352 6.7352 7.0559 7.0560 7.2922 7.2922 7.5790 7.5790 7.7402 7.7402 7.9440 7.9440 8.7363 8.7363 9.3316 9.3316 12.9683 12.9683 13.5387 13.5387 13.8307 13.8307 16.0972 16.0972 k = 0.2746 0.1585 0.4483 ( 4431 PWs) bands (ev): -88.8662 -88.8662 -88.8530 -88.8530 -88.8440 -88.8440 -88.8440 -88.8440 2.1150 2.1150 4.3414 4.3414 4.4909 4.4909 5.9904 5.9904 6.1957 6.1957 6.5688 6.5688 6.6877 6.6877 6.7300 6.7300 7.0334 7.0334 7.3107 7.3107 7.6178 7.6178 7.7437 7.7437 7.9707 7.9707 8.7006 8.7006 9.4314 9.4314 12.8664 12.8664 13.6544 13.6544 13.7784 13.7784 16.0408 16.0408 k = 0.2679 0.1546 0.4374 ( 4435 PWs) bands (ev): -88.8666 -88.8666 -88.8527 -88.8527 -88.8440 -88.8440 -88.8440 -88.8440 2.0193 2.0193 4.3959 4.3959 4.5504 4.5504 5.9830 5.9830 6.2162 6.2162 6.5588 6.5588 6.6785 6.6785 6.7247 6.7247 7.0084 7.0084 7.3310 7.3310 7.6608 7.6608 7.7484 7.7484 7.9998 7.9998 8.6635 8.6635 9.5331 9.5331 12.7670 12.7670 13.7296 13.7296 13.7623 13.7623 15.9852 15.9852 k = 0.2612 0.1508 0.4265 ( 4431 PWs) bands (ev): -88.8669 -88.8669 -88.8524 -88.8524 -88.8440 -88.8440 -88.8440 -88.8440 1.9255 1.9255 4.4512 4.4512 4.6107 4.6107 5.9760 5.9760 6.2336 6.2336 6.5488 6.5488 6.6692 6.6692 6.7191 6.7191 6.9820 6.9820 7.3521 7.3521 7.7037 7.7037 7.7584 7.7584 8.0317 8.0317 8.6251 8.6251 9.6366 9.6366 12.6700 12.6700 13.6867 13.6867 13.8595 13.8595 15.9306 15.9306 k = 0.2545 0.1469 0.4155 ( 4435 PWs) bands (ev): -88.8672 -88.8672 -88.8520 -88.8520 -88.8440 -88.8440 -88.8440 -88.8440 1.8335 1.8335 4.5074 4.5074 4.6718 4.6718 5.9696 5.9696 6.2480 6.2480 6.5388 6.5388 6.6600 6.6600 6.7133 6.7133 6.9546 6.9546 7.3734 7.3734 7.7303 7.7303 7.7900 7.7900 8.0665 8.0665 8.5856 8.5856 9.7419 9.7419 12.5756 12.5756 13.6477 13.6477 13.9478 13.9478 15.8770 15.8770 k = 0.2478 0.1430 0.4046 ( 4445 PWs) bands (ev): -88.8676 -88.8676 -88.8517 -88.8517 -88.8440 -88.8440 -88.8440 -88.8440 1.7435 1.7435 4.5643 4.5643 4.7335 4.7335 5.9637 5.9637 6.2592 6.2592 6.5289 6.5289 6.6508 6.6508 6.7071 6.7071 6.9268 6.9268 7.3945 7.3945 7.7387 7.7387 7.8449 7.8449 8.1044 8.1044 8.5450 8.5450 9.8491 9.8491 12.4837 12.4837 13.6130 13.6130 14.0266 14.0266 15.8245 15.8245 k = 0.2411 0.1392 0.3937 ( 4433 PWs) bands (ev): -88.8679 -88.8679 -88.8514 -88.8514 -88.8440 -88.8440 -88.8440 -88.8440 1.6554 1.6554 4.6218 4.6218 4.7957 4.7957 5.9584 5.9584 6.2677 6.2677 6.5191 6.5191 6.6416 6.6416 6.7007 6.7007 6.8988 6.8988 7.4150 7.4150 7.7420 7.7420 7.9094 7.9094 8.1455 8.1455 8.5033 8.5033 9.9580 9.9580 12.3943 12.3943 13.5826 13.5826 14.0957 14.0957 15.7730 15.7730 k = 0.2344 0.1353 0.3827 ( 4433 PWs) bands (ev): -88.8682 -88.8682 -88.8511 -88.8511 -88.8440 -88.8440 -88.8440 -88.8440 1.5694 1.5694 4.6800 4.6800 4.8583 4.8583 5.9537 5.9537 6.2736 6.2736 6.5094 6.5094 6.6324 6.6324 6.6938 6.6938 6.8709 6.8709 7.4348 7.4348 7.7438 7.7438 7.9797 7.9797 8.1899 8.1899 8.4609 8.4609 10.0687 10.0687 12.3074 12.3074 13.5565 13.5565 14.1554 14.1554 15.7227 15.7227 k = 0.2277 0.1315 0.3718 ( 4437 PWs) bands (ev): -88.8685 -88.8685 -88.8507 -88.8507 -88.8440 -88.8440 -88.8440 -88.8440 1.4854 1.4854 4.7387 4.7387 4.9211 4.9211 5.9496 5.9496 6.2771 6.2771 6.4999 6.4999 6.6232 6.6232 6.6865 6.6865 6.8433 6.8433 7.4537 7.4537 7.7448 7.7448 8.0546 8.0546 8.2378 8.2378 8.4179 8.4179 10.1812 10.1812 12.2231 12.2231 13.5347 13.5347 14.2059 14.2059 15.6735 15.6735 k = 0.2210 0.1276 0.3609 ( 4435 PWs) bands (ev): -88.8689 -88.8689 -88.8504 -88.8504 -88.8440 -88.8440 -88.8440 -88.8440 1.4036 1.4036 4.7979 4.7979 4.9840 4.9840 5.9461 5.9461 6.2785 6.2785 6.4905 6.4905 6.6140 6.6140 6.6786 6.6786 6.8163 6.8163 7.4718 7.4718 7.7453 7.7453 8.1331 8.1331 8.2884 8.2884 8.3754 8.3754 10.2954 10.2954 12.1414 12.1414 13.5170 13.5170 14.2477 14.2477 15.6255 15.6255 k = 0.2143 0.1237 0.3499 ( 4443 PWs) bands (ev): -88.8692 -88.8692 -88.8501 -88.8501 -88.8440 -88.8440 -88.8440 -88.8440 1.3239 1.3239 4.8574 4.8574 5.0469 5.0469 5.9432 5.9432 6.2780 6.2780 6.4813 6.4813 6.6046 6.6047 6.6700 6.6700 6.7901 6.7901 7.4889 7.4889 7.7455 7.7455 8.2140 8.2140 8.3191 8.3191 8.3570 8.3570 10.4114 10.4114 12.0622 12.0622 13.5035 13.5035 14.2814 14.2814 15.5788 15.5788 k = 0.2076 0.1199 0.3390 ( 4437 PWs) bands (ev): -88.8695 -88.8695 -88.8498 -88.8498 -88.8440 -88.8440 -88.8440 -88.8440 1.2464 1.2464 4.9172 4.9172 5.1096 5.1096 5.9408 5.9408 6.2760 6.2760 6.4723 6.4723 6.5952 6.5952 6.6606 6.6606 6.7652 6.7652 7.5050 7.5050 7.7454 7.7454 8.2748 8.2748 8.3028 8.3028 8.4118 8.4118 10.5290 10.5290 11.9855 11.9855 13.4941 13.4941 14.3075 14.3075 15.5333 15.5333 k = 0.2009 0.1160 0.3281 ( 4425 PWs) bands (ev): -88.8698 -88.8698 -88.8495 -88.8495 -88.8440 -88.8440 -88.8440 -88.8440 1.1712 1.1712 4.9773 4.9773 5.1719 5.1719 5.9390 5.9390 6.2725 6.2725 6.4635 6.4635 6.5856 6.5856 6.6501 6.6501 6.7419 6.7419 7.5202 7.5202 7.7450 7.7450 8.2339 8.2339 8.3822 8.3822 8.4789 8.4789 10.6484 10.6484 11.9115 11.9115 13.4887 13.4887 14.3267 14.3267 15.4890 15.4890 k = 0.1942 0.1121 0.3171 ( 4427 PWs) bands (ev): -88.8701 -88.8701 -88.8491 -88.8491 -88.8440 -88.8440 -88.8440 -88.8440 1.0981 1.0981 5.0375 5.0375 5.2338 5.2338 5.9377 5.9377 6.2679 6.2679 6.4549 6.4549 6.5758 6.5758 6.6382 6.6382 6.7207 6.7207 7.5344 7.5344 7.7444 7.7444 8.1884 8.1884 8.4636 8.4636 8.5540 8.5540 10.7693 10.7693 11.8400 11.8400 13.4873 13.4873 14.3397 14.3397 15.4460 15.4460 k = 0.1875 0.1083 0.3062 ( 4423 PWs) bands (ev): -88.8704 -88.8704 -88.8488 -88.8488 -88.8440 -88.8440 -88.8440 -88.8440 1.0274 1.0274 5.0977 5.0977 5.2950 5.2950 5.9369 5.9369 6.2623 6.2623 6.4466 6.4466 6.5656 6.5656 6.6250 6.6250 6.7019 6.7019 7.5477 7.5477 7.7435 7.7435 8.1424 8.1424 8.5430 8.5430 8.6373 8.6373 10.8919 10.8919 11.7711 11.7711 13.4897 13.4897 14.3472 14.3472 15.4044 15.4044 k = 0.1808 0.1044 0.2953 ( 4443 PWs) bands (ev): -88.8707 -88.8707 -88.8485 -88.8485 -88.8440 -88.8440 -88.8440 -88.8440 0.9590 0.9590 5.1579 5.1579 5.3554 5.3554 5.9367 5.9367 6.2558 6.2558 6.4384 6.4384 6.5549 6.5549 6.6105 6.6105 6.6856 6.6856 7.5600 7.5600 7.7423 7.7423 8.0962 8.0962 8.6209 8.6209 8.7275 8.7275 11.0160 11.0160 11.7047 11.7047 13.4960 13.4960 14.3498 14.3498 15.3640 15.3640 k = 0.1741 0.1005 0.2843 ( 4443 PWs) bands (ev): -88.8710 -88.8710 -88.8483 -88.8483 -88.8440 -88.8440 -88.8440 -88.8440 0.8929 0.8929 5.2180 5.2180 5.4148 5.4148 5.9369 5.9369 6.2487 6.2487 6.4305 6.4305 6.5434 6.5434 6.5954 6.5954 6.6715 6.6715 7.5714 7.5714 7.7410 7.7410 8.0500 8.0500 8.6989 8.6989 8.8226 8.8226 11.1415 11.1415 11.6410 11.6410 13.5060 13.5060 14.3481 14.3481 15.3250 15.3250 k = 0.1674 0.0967 0.2734 ( 4443 PWs) bands (ev): -88.8713 -88.8713 -88.8480 -88.8480 -88.8440 -88.8440 -88.8440 -88.8440 0.8291 0.8291 5.2777 5.2777 5.4731 5.4731 5.9375 5.9375 6.2410 6.2410 6.4229 6.4229 6.5310 6.5310 6.5804 6.5804 6.6594 6.6594 7.5818 7.5818 7.7394 7.7394 8.0040 8.0040 8.7782 8.7782 8.9211 8.9211 11.2683 11.2683 11.5801 11.5801 13.5196 13.5196 14.3428 14.3428 15.2874 15.2874 k = 0.1607 0.0928 0.2624 ( 4441 PWs) bands (ev): -88.8716 -88.8716 -88.8477 -88.8477 -88.8440 -88.8440 -88.8440 -88.8440 0.7677 0.7677 5.3371 5.3371 5.5301 5.5301 5.9387 5.9387 6.2330 6.2330 6.4154 6.4154 6.5174 6.5174 6.5662 6.5662 6.6485 6.6485 7.5912 7.5912 7.7376 7.7376 7.9585 7.9585 8.8593 8.8593 9.0219 9.0219 11.3953 11.3953 11.5229 11.5229 13.5368 13.5368 14.3344 14.3344 15.2510 15.2510 k = 0.1540 0.0889 0.2515 ( 4449 PWs) bands (ev): -88.8719 -88.8719 -88.8474 -88.8474 -88.8440 -88.8440 -88.8440 -88.8440 0.7087 0.7087 5.3960 5.3960 5.5856 5.5856 5.9403 5.9403 6.2248 6.2248 6.4082 6.4082 6.5029 6.5029 6.5534 6.5534 6.6387 6.6387 7.5995 7.5995 7.7354 7.7354 7.9137 7.9137 8.9428 8.9428 9.1243 9.1243 11.4590 11.4590 11.5329 11.5329 13.5573 13.5573 14.3233 14.3233 15.2161 15.2161 k = 0.1473 0.0851 0.2406 ( 4439 PWs) bands (ev): -88.8721 -88.8721 -88.8471 -88.8471 -88.8440 -88.8440 -88.8440 -88.8440 0.6521 0.6521 5.4543 5.4543 5.6393 5.6393 5.9425 5.9425 6.2164 6.2164 6.4012 6.4012 6.4877 6.4877 6.5418 6.5418 6.6295 6.6295 7.6065 7.6065 7.7327 7.7327 7.8702 7.8702 9.0287 9.0287 9.2277 9.2277 11.4088 11.4088 11.6605 11.6605 13.5811 13.5811 14.3100 14.3100 15.1825 15.1825 k = 0.1406 0.0812 0.2296 ( 4443 PWs) bands (ev): -88.8724 -88.8724 -88.8469 -88.8469 -88.8440 -88.8440 -88.8440 -88.8440 0.5979 0.5979 5.5116 5.5116 5.6912 5.6912 5.9452 5.9452 6.2082 6.2082 6.3944 6.3945 6.4724 6.4724 6.5313 6.5313 6.6209 6.6209 7.6116 7.6116 7.7292 7.7292 7.8289 7.8289 9.1170 9.1170 9.3316 9.3316 11.3581 11.3581 11.7923 11.7923 13.6080 13.6080 14.2950 14.2950 15.1503 15.1503 k = 0.1339 0.0773 0.2187 ( 4443 PWs) bands (ev): -88.8726 -88.8726 -88.8466 -88.8466 -88.8440 -88.8440 -88.8440 -88.8440 0.5461 0.5461 5.5680 5.5680 5.7407 5.7407 5.9487 5.9487 6.2003 6.2003 6.3879 6.3879 6.4573 6.4573 6.5216 6.5216 6.6128 6.6128 7.6139 7.6139 7.7240 7.7240 7.7917 7.7917 9.2078 9.2078 9.4356 9.4356 11.3096 11.3096 11.9254 11.9254 13.6378 13.6378 14.2786 14.2786 15.1195 15.1195 k = 0.1272 0.0735 0.2078 ( 4443 PWs) bands (ev): -88.8729 -88.8729 -88.8464 -88.8464 -88.8440 -88.8440 -88.8440 -88.8440 0.4968 0.4968 5.6230 5.6230 5.7875 5.7875 5.9532 5.9532 6.1930 6.1930 6.3814 6.3814 6.4430 6.4430 6.5125 6.5125 6.6050 6.6050 7.6112 7.6112 7.7152 7.7152 7.7629 7.7629 9.3009 9.3009 9.5394 9.5394 11.2634 11.2634 12.0596 12.0596 13.6702 13.6702 14.2612 14.2612 15.0901 15.0901 k = 0.1205 0.0696 0.1968 ( 4449 PWs) bands (ev): -88.8731 -88.8731 -88.8462 -88.8462 -88.8440 -88.8440 -88.8440 -88.8440 0.4499 0.4499 5.6764 5.6764 5.8308 5.8308 5.9594 5.9594 6.1865 6.1865 6.3751 6.3751 6.4296 6.4296 6.5040 6.5040 6.5976 6.5976 7.6002 7.6002 7.7025 7.7025 7.7462 7.7462 9.3963 9.3963 9.6425 9.6425 11.2197 11.2197 12.1945 12.1945 13.7049 13.7049 14.2430 14.2430 15.0620 15.0620 k = 0.1138 0.0657 0.1859 ( 4449 PWs) bands (ev): -88.8733 -88.8733 -88.8459 -88.8459 -88.8440 -88.8440 -88.8440 -88.8440 0.4055 0.4055 5.7277 5.7277 5.8691 5.8691 5.9685 5.9685 6.1814 6.1814 6.3689 6.3689 6.4173 6.4173 6.4958 6.4959 6.5905 6.5905 7.5780 7.5780 7.6923 7.6923 7.7380 7.7380 9.4936 9.4936 9.7446 9.7446 11.1785 11.1785 12.3300 12.3300 13.7415 13.7415 14.2245 14.2245 15.0354 15.0354 k = 0.1071 0.0619 0.1750 ( 4453 PWs) bands (ev): -88.8735 -88.8735 -88.8457 -88.8457 -88.8440 -88.8440 -88.8440 -88.8440 0.3636 0.3636 5.7761 5.7761 5.8999 5.8999 5.9831 5.9831 6.1782 6.1783 6.3628 6.3628 6.4062 6.4062 6.4881 6.4881 6.5838 6.5838 7.5468 7.5468 7.6878 7.6878 7.7333 7.7333 9.5927 9.5927 9.8453 9.8453 11.1396 11.1396 12.4658 12.4658 13.7798 13.7798 14.2057 14.2057 15.0100 15.0100 k = 0.1004 0.0580 0.1640 ( 4453 PWs) bands (ev): -88.8737 -88.8737 -88.8455 -88.8455 -88.8440 -88.8440 -88.8440 -88.8440 0.3242 0.3242 5.8209 5.8209 5.9212 5.9212 6.0050 6.0050 6.1777 6.1777 6.3566 6.3566 6.3966 6.3966 6.4807 6.4807 6.5775 6.5775 7.5105 7.5105 7.6871 7.6871 7.7299 7.7299 9.6932 9.6932 9.9441 9.9441 11.1033 11.1033 12.6016 12.6016 13.8190 13.8190 14.1870 14.1870 14.9861 14.9861 k = 0.0938 0.0541 0.1531 ( 4443 PWs) bands (ev): -88.8739 -88.8739 -88.8453 -88.8453 -88.8440 -88.8440 -88.8440 -88.8440 0.2873 0.2873 5.8607 5.8607 5.9346 5.9346 6.0330 6.0330 6.1807 6.1807 6.3506 6.3506 6.3882 6.3882 6.4736 6.4736 6.5716 6.5716 7.4719 7.4719 7.6884 7.6884 7.7272 7.7272 9.7948 9.7948 10.0406 10.0406 11.0693 11.0693 12.7371 12.7371 13.8587 13.8587 14.1686 14.1686 14.9634 14.9634 k = 0.0871 0.0503 0.1422 ( 4445 PWs) bands (ev): -88.8741 -88.8741 -88.8452 -88.8452 -88.8440 -88.8440 -88.8440 -88.8440 0.2529 0.2529 5.8939 5.8939 5.9439 5.9439 6.0640 6.0640 6.1880 6.1880 6.3446 6.3446 6.3812 6.3812 6.4668 6.4668 6.5661 6.5662 7.4325 7.4325 7.6905 7.6905 7.7248 7.7248 9.8970 9.8970 10.1345 10.1345 11.0378 11.0378 12.8719 12.8719 13.8980 13.8980 14.1506 14.1506 14.9421 14.9421 k = 0.0804 0.0464 0.1312 ( 4445 PWs) bands (ev): -88.8743 -88.8743 -88.8450 -88.8450 -88.8440 -88.8440 -88.8440 -88.8440 0.2210 0.2210 5.9190 5.9190 5.9516 5.9516 6.0963 6.0963 6.1998 6.1998 6.3389 6.3389 6.3753 6.3753 6.4604 6.4604 6.5613 6.5613 7.3930 7.3930 7.6929 7.6929 7.7226 7.7226 9.9993 9.9993 10.2251 10.2251 11.0087 11.0087 13.0054 13.0054 13.9362 13.9362 14.1333 14.1333 14.9220 14.9220 k = 0.0737 0.0425 0.1203 ( 4441 PWs) bands (ev): -88.8744 -88.8744 -88.8448 -88.8448 -88.8440 -88.8440 -88.8440 -88.8440 0.1916 0.1916 5.9356 5.9356 5.9591 5.9591 6.1290 6.1290 6.2161 6.2161 6.3335 6.3335 6.3705 6.3705 6.4544 6.4544 6.5570 6.5570 7.3538 7.3538 7.6954 7.6954 7.7207 7.7207 10.1010 10.1010 10.3119 10.3119 10.9820 10.9820 13.1371 13.1371 13.9723 13.9723 14.1169 14.1169 14.9032 14.9032 k = 0.0670 0.0387 0.1094 ( 4455 PWs) bands (ev): -88.8746 -88.8746 -88.8447 -88.8447 -88.8440 -88.8440 -88.8440 -88.8440 0.1648 0.1648 5.9454 5.9454 5.9658 5.9658 6.1612 6.1612 6.2359 6.2359 6.3286 6.3286 6.3666 6.3666 6.4486 6.4487 6.5534 6.5534 7.3154 7.3154 7.6978 7.6978 7.7189 7.7189 10.2012 10.2012 10.3945 10.3945 10.9577 10.9577 13.2663 13.2663 14.0050 14.0050 14.1016 14.1016 14.8852 14.8852 k = 0.0603 0.0348 0.0984 ( 4451 PWs) bands (ev): -88.8747 -88.8747 -88.8446 -88.8446 -88.8440 -88.8440 -88.8440 -88.8440 0.1405 0.1405 5.9514 5.9514 5.9706 5.9706 6.1917 6.1917 6.2584 6.2584 6.3244 6.3244 6.3637 6.3637 6.4433 6.4433 6.5507 6.5507 7.2779 7.2779 7.7001 7.7001 7.7172 7.7172 10.2992 10.2992 10.4721 10.4721 10.9359 10.9359 13.3919 13.3919 14.0326 14.0326 14.0881 14.0881 14.8353 14.8353 k = 0.0536 0.0309 0.0875 ( 4461 PWs) bands (ev): -88.8748 -88.8748 -88.8445 -88.8445 -88.8440 -88.8440 -88.8440 -88.8440 0.1187 0.1187 5.9555 5.9555 5.9730 5.9730 6.2189 6.2189 6.2825 6.2826 6.3212 6.3212 6.3616 6.3616 6.4385 6.4385 6.5490 6.5490 7.2418 7.2418 7.7022 7.7022 7.7158 7.7158 10.3936 10.3936 10.5442 10.5442 10.9165 10.9165 13.5128 13.5128 14.0512 14.0512 14.0795 14.0795 14.6895 14.6895 k = 0.0469 0.0271 0.0765 ( 4457 PWs) bands (ev): -88.8749 -88.8749 -88.8444 -88.8444 -88.8440 -88.8440 -88.8440 -88.8440 0.0995 0.0995 5.9588 5.9588 5.9737 5.9737 6.2420 6.2420 6.3042 6.3042 6.3220 6.3220 6.3605 6.3605 6.4340 6.4340 6.5484 6.5484 7.2074 7.2074 7.7040 7.7040 7.7144 7.7144 10.4831 10.4831 10.6101 10.6101 10.8997 10.8997 13.6277 13.6277 14.0513 14.0513 14.0844 14.0844 14.5537 14.5537 k = 0.0402 0.0232 0.0656 ( 4457 PWs) bands (ev): -88.8750 -88.8750 -88.8443 -88.8443 -88.8440 -88.8440 -88.8440 -88.8440 0.0829 0.0829 5.9614 5.9614 5.9733 5.9733 6.2609 6.2609 6.3100 6.3100 6.3379 6.3379 6.3609 6.3609 6.4301 6.4301 6.5492 6.5492 7.1751 7.1751 7.7056 7.7056 7.7133 7.7133 10.5661 10.5661 10.6691 10.6691 10.8854 10.8854 13.7346 13.7346 14.0419 14.0419 14.0934 14.0934 14.4312 14.4312 k = 0.0335 0.0193 0.0547 ( 4461 PWs) bands (ev): -88.8751 -88.8751 -88.8442 -88.8442 -88.8440 -88.8440 -88.8440 -88.8440 0.0688 0.0688 5.9634 5.9634 5.9723 5.9723 6.2758 6.2758 6.3089 6.3089 6.3534 6.3534 6.3679 6.3679 6.4267 6.4267 6.5516 6.5516 7.1455 7.1455 7.7069 7.7069 7.7123 7.7123 10.6406 10.6406 10.7203 10.7203 10.8741 10.8741 13.8314 13.8314 14.0310 14.0310 14.0986 14.0986 14.3247 14.3247 k = 0.0268 0.0155 0.0437 ( 4473 PWs) bands (ev): -88.8751 -88.8751 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0573 0.0573 5.9651 5.9651 5.9710 5.9710 6.2871 6.2871 6.3074 6.3074 6.3575 6.3575 6.3844 6.3844 6.4239 6.4239 6.5553 6.5553 7.1193 7.1193 7.7080 7.7080 7.7115 7.7115 10.7046 10.7046 10.7627 10.7627 10.8663 10.8663 13.9150 13.9150 14.0195 14.0195 14.0994 14.0994 14.2376 14.2376 k = 0.0201 0.0116 0.0328 ( 4471 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0483 0.0483 5.9664 5.9664 5.9698 5.9698 6.2951 6.2951 6.3061 6.3061 6.3593 6.3593 6.3994 6.3994 6.4216 6.4216 6.5600 6.5600 7.0974 7.0974 7.7089 7.7089 7.7108 7.7108 10.7559 10.7559 10.7944 10.7944 10.8636 10.8636 13.9794 13.9794 14.0080 14.0080 14.0980 14.0980 14.1742 14.1742 k = 0.0134 0.0077 0.0219 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0419 0.0419 5.9673 5.9673 5.9688 5.9688 6.3005 6.3005 6.3051 6.3051 6.3608 6.3608 6.4102 6.4102 6.4200 6.4200 6.5648 6.5648 7.0808 7.0808 7.7095 7.7095 7.7104 7.7104 10.7926 10.7926 10.8128 10.8128 10.8678 10.8678 13.9878 13.9878 14.0257 14.0257 14.1001 14.1001 14.1371 14.1371 k = 0.0067 0.0039 0.0109 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0380 0.0380 5.9678 5.9678 5.9682 5.9682 6.3034 6.3034 6.3046 6.3046 6.3618 6.3618 6.4166 6.4166 6.4190 6.4190 6.5683 6.5683 7.0704 7.0704 7.7099 7.7099 7.7101 7.7101 10.8142 10.8142 10.8198 10.8198 10.8757 10.8757 13.9749 13.9749 14.0388 14.0388 14.1106 14.1106 14.1210 14.1210 k = 0.0000 0.0000 0.0000 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0367 0.0367 5.9680 5.9680 5.9680 5.9680 6.3044 6.3044 6.3044 6.3044 6.3622 6.3622 6.4187 6.4187 6.4187 6.4187 6.5696 6.5696 7.0668 7.0668 7.7100 7.7100 7.7100 7.7100 10.8213 10.8213 10.8213 10.8213 10.8795 10.8795 13.9694 13.9694 14.0404 14.0404 14.1168 14.1168 14.1168 14.1168 k = 0.0000 0.0000 0.0000 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0367 0.0367 5.9680 5.9680 5.9680 5.9680 6.3044 6.3044 6.3044 6.3044 6.3622 6.3622 6.4187 6.4187 6.4187 6.4187 6.5696 6.5696 7.0668 7.0668 7.7100 7.7100 7.7100 7.7100 10.8213 10.8213 10.8213 10.8213 10.8795 10.8795 13.9694 13.9694 14.0404 14.0404 14.1168 14.1168 14.1168 14.1168 k = 0.0109 0.0063 0.0044 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 -88.8440 0.0380 0.0380 5.9679 5.9679 5.9681 5.9681 6.3034 6.3034 6.3046 6.3046 6.3618 6.3618 6.4166 6.4166 6.4190 6.4190 6.5683 6.5683 7.0703 7.0703 7.7100 7.7100 7.7100 7.7100 10.8137 10.8137 10.8204 10.8204 10.8758 10.8758 13.9747 13.9747 14.0392 14.0392 14.1113 14.1113 14.1200 14.1200 k = 0.0217 0.0126 0.0089 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0418 0.0418 5.9677 5.9677 5.9684 5.9684 6.3004 6.3004 6.3053 6.3053 6.3608 6.3608 6.4102 6.4102 6.4201 6.4201 6.5648 6.5648 7.0807 7.0807 7.7098 7.7098 7.7101 7.7101 10.7884 10.7884 10.8178 10.8178 10.8677 10.8677 13.9865 13.9865 14.0330 14.0330 14.0949 14.0949 14.1360 14.1360 k = 0.0326 0.0188 0.0133 ( 4477 PWs) bands (ev): -88.8752 -88.8752 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0481 0.0481 5.9674 5.9674 5.9688 5.9688 6.2949 6.2949 6.3064 6.3064 6.3593 6.3593 6.3992 6.3992 6.4219 6.4219 6.5601 6.5601 7.0972 7.0972 7.7096 7.7096 7.7102 7.7102 10.7432 10.7432 10.8134 10.8134 10.8588 10.8588 13.9930 13.9930 14.0207 14.0207 14.0682 14.0682 14.1765 14.1765 k = 0.0435 0.0251 0.0177 ( 4468 PWs) bands (ev): -88.8751 -88.8751 -88.8441 -88.8441 -88.8440 -88.8440 -88.8440 -88.8440 0.0570 0.0570 5.9669 5.9669 5.9694 5.9694 6.2863 6.2863 6.3080 6.3080 6.3577 6.3577 6.3838 6.3838 6.4243 6.4243 6.5555 6.5555 7.1189 7.1189 7.7093 7.7093 7.7103 7.7103 10.6795 10.6795 10.8073 10.8073 10.8498 10.8498 13.9752 13.9752 14.0169 14.0169 14.0321 14.0321 14.2445 14.2445 k = 0.0543 0.0314 0.0222 ( 4462 PWs) bands (ev): -88.8751 -88.8751 -88.8442 -88.8442 -88.8440 -88.8440 -88.8440 -88.8440 0.0684 0.0684 5.9663 5.9663 5.9700 5.9700 6.2737 6.2737 6.3101 6.3101 6.3561 6.3561 6.3649 6.3649 6.4274 6.4274 6.5519 6.5519 7.1451 7.1451 7.7088 7.7088 7.7105 7.7105 10.6006 10.6006 10.7995 10.7995 10.8398 10.8398 13.9379 13.9379 13.9876 13.9876 14.0197 14.0197 14.3356 14.3356 k = 0.0652 0.0377 0.0266 ( 4453 PWs) bands (ev): -88.8750 -88.8750 -88.8443 -88.8443 -88.8440 -88.8440 -88.8440 -88.8440 0.0823 0.0823 5.9655 5.9655 5.9705 5.9705 6.2555 6.2555 6.3128 6.3128 6.3431 6.3431 6.3560 6.3560 6.4312 6.4312 6.5497 6.5497 7.1747 7.1747 7.7083 7.7083 7.7107 7.7107 10.5094 10.5094 10.7899 10.7899 10.8284 10.8284 13.8911 13.8911 13.9359 13.9359 14.0227 14.0227 14.4447 14.4447 k = 0.0761 0.0439 0.0311 ( 4453 PWs) bands (ev): -88.8749 -88.8749 -88.8444 -88.8444 -88.8440 -88.8440 -88.8440 -88.8440 0.0988 0.0988 5.9644 5.9644 5.9707 5.9707 6.2302 6.2302 6.3160 6.3160 6.3224 6.3224 6.3555 6.3555 6.4356 6.4356 6.5490 6.5490 7.2071 7.2071 7.7077 7.7077 7.7109 7.7109 10.4084 10.4084 10.7785 10.7785 10.8153 10.8153 13.8376 13.8376 13.8783 13.8783 14.0252 14.0252 14.5677 14.5677 k = 0.0870 0.0502 0.0355 ( 4447 PWs) bands (ev): -88.8748 -88.8748 -88.8445 -88.8445 -88.8440 -88.8440 -88.8440 -88.8440 0.1178 0.1178 5.9632 5.9632 5.9702 5.9702 6.1974 6.1974 6.3034 6.3034 6.3198 6.3198 6.3558 6.3558 6.4406 6.4406 6.5496 6.5496 7.2417 7.2417 7.7070 7.7070 7.7113 7.7113 10.2999 10.2999 10.7653 10.7653 10.8005 10.8005 13.7792 13.7792 13.8160 13.8160 14.0274 14.0274 14.7011 14.7011 k = 0.0978 0.0565 0.0399 ( 4459 PWs) bands (ev): -88.8747 -88.8747 -88.8446 -88.8446 -88.8440 -88.8440 -88.8440 -88.8440 0.1392 0.1392 5.9617 5.9617 5.9684 5.9684 6.1583 6.1583 6.2864 6.2864 6.3242 6.3242 6.3568 6.3568 6.4463 6.4463 6.5515 6.5515 7.2779 7.2779 7.7062 7.7062 7.7117 7.7117 10.1858 10.1858 10.7504 10.7504 10.7838 10.7838 13.7171 13.7171 13.7500 13.7500 14.0294 14.0294 14.8406 14.8406 k = 0.1087 0.0628 0.0444 ( 4453 PWs) bands (ev): -88.8746 -88.8746 -88.8447 -88.8447 -88.8440 -88.8440 -88.8440 -88.8440 0.1632 0.1632 5.9600 5.9600 5.9637 5.9637 6.1154 6.1154 6.2709 6.2709 6.3291 6.3291 6.3584 6.3584 6.4526 6.4526 6.5544 6.5544 7.3154 7.3154 7.7053 7.7053 7.7122 7.7122 10.0675 10.0675 10.7337 10.7337 10.7652 10.7652 13.6524 13.6524 13.6814 13.6814 14.0312 14.0312 14.9261 14.9261 k = 0.1196 0.0690 0.0488 ( 4453 PWs) bands (ev): -88.8744 -88.8744 -88.8448 -88.8448 -88.8440 -88.8440 -88.8440 -88.8440 0.1897 0.1897 5.9523 5.9523 5.9580 5.9580 6.0735 6.0735 6.2565 6.2565 6.3346 6.3346 6.3606 6.3606 6.4596 6.4596 6.5582 6.5582 7.3537 7.3537 7.7043 7.7043 7.7128 7.7128 9.9465 9.9465 10.7151 10.7151 10.7446 10.7446 13.5860 13.5860 13.6112 13.6112 14.0328 14.0328 14.9607 14.9607 k = 0.1304 0.0753 0.0532 ( 4456 PWs) bands (ev): -88.8743 -88.8743 -88.8450 -88.8450 -88.8440 -88.8440 -88.8440 -88.8440 0.2187 0.2187 5.9268 5.9268 5.9558 5.9558 6.0407 6.0407 6.2429 6.2429 6.3405 6.3405 6.3635 6.3635 6.4673 6.4673 6.5629 6.5629 7.3925 7.3925 7.7032 7.7032 7.7137 7.7137 9.8238 9.8238 10.6948 10.6948 10.7222 10.7222 13.5187 13.5187 13.5400 13.5400 14.0341 14.0341 14.9967 14.9967 k = 0.1413 0.0816 0.0577 ( 4444 PWs) bands (ev): -88.8741 -88.8741 -88.8451 -88.8451 -88.8440 -88.8440 -88.8440 -88.8440 0.2502 0.2502 5.8823 5.8823 5.9533 5.9533 6.0221 6.0221 6.2302 6.2302 6.3469 6.3469 6.3669 6.3669 6.4758 6.4758 6.5683 6.5683 7.4315 7.4315 7.7020 7.7020 7.7149 7.7149 9.7003 9.7003 10.6727 10.6727 10.6979 10.6979 13.4513 13.4513 13.4685 13.4685 14.0352 14.0352 15.0356 15.0356 k = 0.1522 0.0879 0.0621 ( 4456 PWs) bands (ev): -88.8740 -88.8740 -88.8453 -88.8453 -88.8440 -88.8440 -88.8440 -88.8440 0.2842 0.2842 5.8236 5.8236 5.9506 5.9506 6.0135 6.0135 6.2183 6.2183 6.3535 6.3535 6.3709 6.3709 6.4852 6.4852 6.5746 6.5746 7.4701 7.4701 7.7007 7.7007 7.7167 7.7167 9.5768 9.5768 10.6489 10.6489 10.6716 10.6716 13.3843 13.3843 13.3975 13.3975 14.0359 14.0359 15.0773 15.0773 k = 0.1630 0.0941 0.0666 ( 4459 PWs) bands (ev): -88.8738 -88.8738 -88.8455 -88.8455 -88.8440 -88.8440 -88.8440 -88.8440 0.3206 0.3206 5.7562 5.7562 5.9477 5.9477 6.0094 6.0094 6.2073 6.2073 6.3603 6.3603 6.3754 6.3754 6.4954 6.4954 6.5816 6.5816 7.5078 7.5078 7.6992 7.6992 7.7192 7.7192 9.4539 9.4539 10.6232 10.6232 10.6435 10.6435 13.3182 13.3182 13.3273 13.3273 14.0363 14.0363 15.1219 15.1219 k = 0.1739 0.1004 0.0710 ( 4459 PWs) bands (ev): -88.8736 -88.8736 -88.8457 -88.8457 -88.8440 -88.8440 -88.8440 -88.8440 0.3595 0.3595 5.6830 5.6830 5.9445 5.9445 6.0071 6.0071 6.1973 6.1973 6.3672 6.3672 6.3803 6.3803 6.5067 6.5067 6.5896 6.5896 7.5440 7.5440 7.6977 7.6977 7.7232 7.7232 9.3321 9.3321 10.5959 10.5959 10.6136 10.6136 13.2535 13.2535 13.2583 13.2583 14.0363 14.0363 15.1694 15.1694 k = 0.1848 0.1067 0.0754 ( 4456 PWs) bands (ev): -88.8734 -88.8734 -88.8459 -88.8459 -88.8440 -88.8440 -88.8440 -88.8440 0.4009 0.4009 5.6051 5.6051 5.9412 5.9412 6.0057 6.0057 6.1883 6.1883 6.3741 6.3741 6.3855 6.3855 6.5191 6.5191 6.5985 6.5985 7.5773 7.5773 7.6960 7.6960 7.7296 7.7296 9.2120 9.2120 10.5670 10.5670 10.5820 10.5820 13.1904 13.1904 13.1910 13.1910 14.0358 14.0358 15.2197 15.2197 k = 0.1957 0.1130 0.0799 ( 4447 PWs) bands (ev): -88.8732 -88.8732 -88.8461 -88.8461 -88.8440 -88.8440 -88.8440 -88.8440 0.4447 0.4447 5.5232 5.5232 5.9378 5.9378 6.0047 6.0047 6.1805 6.1805 6.3808 6.3808 6.3910 6.3910 6.5325 6.5325 6.6084 6.6084 7.6061 7.6061 7.6941 7.6941 7.7398 7.7398 9.0938 9.0938 10.5364 10.5364 10.5487 10.5487 13.1257 13.1257 13.1294 13.1294 14.0348 14.0348 15.2728 15.2728 k = 0.2065 0.1192 0.0843 ( 4441 PWs) bands (ev): -88.8729 -88.8729 -88.8463 -88.8463 -88.8440 -88.8440 -88.8440 -88.8440 0.4909 0.4909 5.4377 5.4377 5.9342 5.9342 6.0038 6.0038 6.1740 6.1740 6.3872 6.3872 6.3966 6.3966 6.5471 6.5471 6.6194 6.6194 7.6286 7.6286 7.6922 7.6922 7.7554 7.7554 8.9781 8.9781 10.5043 10.5043 10.5139 10.5139 13.0625 13.0625 13.0705 13.0705 14.0333 14.0333 15.3285 15.3285 k = 0.2174 0.1255 0.0887 ( 4444 PWs) bands (ev): -88.8727 -88.8727 -88.8466 -88.8466 -88.8440 -88.8440 -88.8440 -88.8440 0.5395 0.5395 5.3490 5.3490 5.9305 5.9305 6.0029 6.0029 6.1688 6.1688 6.3934 6.3934 6.4022 6.4022 6.5628 6.5628 6.6314 6.6314 7.6439 7.6439 7.6901 7.6901 7.7769 7.7769 8.8651 8.8651 10.4708 10.4708 10.4776 10.4776 13.0017 13.0017 13.0140 13.0140 14.0313 14.0313 15.3868 15.3868 k = 0.2283 0.1318 0.0932 ( 4444 PWs) bands (ev): -88.8725 -88.8725 -88.8468 -88.8468 -88.8440 -88.8440 -88.8440 -88.8440 0.5906 0.5906 5.2573 5.2573 5.9267 5.9267 6.0019 6.0019 6.1651 6.1651 6.3992 6.3992 6.4077 6.4077 6.5797 6.5797 6.6447 6.6447 7.6530 7.6530 7.6878 7.6878 7.8029 7.8029 8.7552 8.7552 10.4359 10.4359 10.4400 10.4400 12.9435 12.9435 12.9599 12.9599 14.0289 14.0289 15.4475 15.4475 k = 0.2391 0.1381 0.0976 ( 4444 PWs) bands (ev): -88.8722 -88.8722 -88.8470 -88.8470 -88.8440 -88.8440 -88.8440 -88.8440 0.6440 0.6440 5.1628 5.1628 5.9229 5.9229 6.0009 6.0009 6.1628 6.1628 6.4047 6.4047 6.4130 6.4130 6.5977 6.5977 6.6592 6.6592 7.6579 7.6579 7.6854 7.6854 7.8311 7.8311 8.6492 8.6492 10.3999 10.3999 10.4012 10.4012 12.8879 12.8879 12.9085 12.9085 14.0259 14.0259 15.5107 15.5107 k = 0.2500 0.1443 0.1021 ( 4450 PWs) bands (ev): -88.8720 -88.8720 -88.8473 -88.8473 -88.8440 -88.8440 -88.8440 -88.8440 0.6998 0.6998 5.0658 5.0658 5.9191 5.9191 5.9998 5.9998 6.1620 6.1620 6.4097 6.4097 6.4181 6.4181 6.6167 6.6167 6.6750 6.6750 7.6599 7.6599 7.6828 7.6828 7.8592 7.8592 8.5476 8.5476 10.3615 10.3615 10.3628 10.3628 12.8350 12.8350 12.8597 12.8597 14.0225 14.0225 15.5762 15.5762 k = 0.2609 0.1506 0.1065 ( 4438 PWs) bands (ev): -88.8717 -88.8717 -88.8475 -88.8475 -88.8440 -88.8440 -88.8440 -88.8440 0.7579 0.7579 4.9665 4.9665 5.9153 5.9153 5.9986 5.9986 6.1628 6.1628 6.4144 6.4144 6.4228 6.4228 6.6366 6.6366 6.6920 6.6920 7.6599 7.6599 7.6800 7.6800 7.8849 7.8849 8.4518 8.4518 10.3210 10.3210 10.3249 10.3249 12.7849 12.7849 12.8136 12.8136 14.0186 14.0186 15.6438 15.6438 k = 0.2717 0.1569 0.1109 ( 4447 PWs) bands (ev): -88.8715 -88.8715 -88.8478 -88.8478 -88.8440 -88.8440 -88.8440 -88.8440 0.8183 0.8183 4.8650 4.8650 5.9115 5.9115 5.9973 5.9973 6.1653 6.1653 6.4186 6.4186 6.4272 6.4272 6.6573 6.6573 6.7101 6.7101 7.6585 7.6585 7.6771 7.6771 7.9053 7.9053 8.3640 8.3640 10.2799 10.2799 10.2862 10.2862 12.7376 12.7376 12.7702 12.7702 14.0144 14.0144 15.7134 15.7135 k = 0.2826 0.1632 0.1154 ( 4432 PWs) bands (ev): -88.8712 -88.8712 -88.8481 -88.8481 -88.8440 -88.8440 -88.8440 -88.8440 0.8811 0.8811 4.7617 4.7617 5.9077 5.9077 5.9959 5.9959 6.1695 6.1695 6.4226 6.4226 6.4312 6.4312 6.6788 6.6788 6.7294 6.7294 7.6560 7.6560 7.6740 7.6740 7.9160 7.9160 8.2886 8.2886 10.2384 10.2384 10.2471 10.2471 12.6930 12.6930 12.7295 12.7295 14.0098 14.0098 15.7849 15.7849 k = 0.2935 0.1694 0.1198 ( 4432 PWs) bands (ev): -88.8709 -88.8709 -88.8483 -88.8483 -88.8440 -88.8440 -88.8440 -88.8440 0.9461 0.9461 4.6568 4.6568 5.9041 5.9041 5.9944 5.9944 6.1754 6.1754 6.4261 6.4261 6.4348 6.4348 6.7010 6.7010 6.7497 6.7497 7.6524 7.6524 7.6706 7.6706 7.9097 7.9097 8.2324 8.2324 10.1968 10.1968 10.2077 10.2077 12.6513 12.6513 12.6913 12.6913 14.0050 14.0050 15.8581 15.8582 k = 0.3043 0.1757 0.1242 ( 4438 PWs) bands (ev): -88.8707 -88.8707 -88.8486 -88.8486 -88.8440 -88.8440 -88.8440 -88.8440 1.0134 1.0134 4.5504 4.5504 5.9005 5.9005 5.9929 5.9929 6.1832 6.1832 6.4294 6.4294 6.4381 6.4381 6.7236 6.7236 6.7709 6.7709 7.6477 7.6477 7.6671 7.6671 7.8804 7.8804 8.2014 8.2014 10.1553 10.1553 10.1682 10.1682 12.6122 12.6122 12.6557 12.6557 13.9999 13.9999 15.9328 15.9328 k = 0.3152 0.1820 0.1287 ( 4438 PWs) bands (ev): -88.8704 -88.8704 -88.8489 -88.8489 -88.8440 -88.8440 -88.8440 -88.8440 1.0829 1.0829 4.4428 4.4428 5.8970 5.8970 5.9914 5.9914 6.1927 6.1927 6.4323 6.4323 6.4410 6.4410 6.7466 6.7466 6.7930 6.7930 7.6416 7.6416 7.6633 7.6633 7.8302 7.8302 8.1939 8.1939 10.1141 10.1141 10.1289 10.1289 12.5759 12.5759 12.6226 12.6226 13.9947 13.9947 16.0087 16.0087 k = 0.3261 0.1883 0.1331 ( 4450 PWs) bands (ev): -88.8701 -88.8701 -88.8491 -88.8491 -88.8440 -88.8440 -88.8440 -88.8440 1.1546 1.1546 4.3342 4.3342 5.8937 5.8937 5.9899 5.9899 6.2040 6.2040 6.4350 6.4350 6.4436 6.4436 6.7698 6.7698 6.8157 6.8157 7.6329 7.6329 7.6594 7.6594 7.7685 7.7685 8.2014 8.2014 10.0735 10.0735 10.0900 10.0900 12.5421 12.5421 12.5920 12.5920 13.9895 13.9895 16.0856 16.0856 k = 0.3370 0.1945 0.1376 ( 4450 PWs) bands (ev): -88.8699 -88.8699 -88.8494 -88.8494 -88.8440 -88.8440 -88.8440 -88.8440 1.2284 1.2284 4.2248 4.2248 5.8905 5.8905 5.9883 5.9883 6.2172 6.2172 6.4374 6.4374 6.4459 6.4459 6.7931 6.7931 6.8389 6.8389 7.6180 7.6180 7.6552 7.6552 7.7063 7.7063 8.2166 8.2166 10.0338 10.0338 10.0517 10.0517 12.5109 12.5109 12.5637 12.5637 13.9841 13.9841 16.1631 16.1632 k = 0.3478 0.2008 0.1420 ( 4443 PWs) bands (ev): -88.8696 -88.8696 -88.8497 -88.8497 -88.8440 -88.8440 -88.8440 -88.8440 1.3043 1.3043 4.1148 4.1148 5.8875 5.8875 5.9868 5.9868 6.2322 6.2322 6.4396 6.4396 6.4480 6.4480 6.8164 6.8164 6.8624 6.8624 7.5835 7.5835 7.6509 7.6509 7.6608 7.6608 8.2353 8.2353 9.9951 9.9951 10.0144 10.0144 12.4822 12.4822 12.5377 12.5377 13.9789 13.9789 16.2411 16.2411 k = 0.3587 0.2071 0.1464 ( 4443 PWs) bands (ev): -88.8694 -88.8694 -88.8499 -88.8499 -88.8440 -88.8440 -88.8440 -88.8440 1.3824 1.3824 4.0043 4.0043 5.8846 5.8846 5.9853 5.9853 6.2491 6.2491 6.4415 6.4415 6.4499 6.4499 6.8394 6.8394 6.8862 6.8862 7.5245 7.5245 7.6394 7.6394 7.6464 7.6464 8.2554 8.2554 9.9578 9.9578 9.9782 9.9782 12.4558 12.4558 12.5138 12.5138 13.9737 13.9737 16.3189 16.3189 k = 0.3696 0.2134 0.1509 ( 4437 PWs) bands (ev): -88.8691 -88.8691 -88.8502 -88.8502 -88.8440 -88.8440 -88.8440 -88.8440 1.4624 1.4624 3.8937 3.8937 5.8819 5.8819 5.9838 5.9838 6.2677 6.2677 6.4432 6.4432 6.4516 6.4516 6.8620 6.8620 6.9098 6.9098 7.4571 7.4571 7.6271 7.6271 7.6417 7.6417 8.2756 8.2756 9.9220 9.9220 9.9435 9.9435 12.4318 12.4318 12.4921 12.4921 13.9687 13.9687 16.3962 16.3962 k = 0.3804 0.2196 0.1553 ( 4440 PWs) bands (ev): -88.8689 -88.8689 -88.8504 -88.8504 -88.8440 -88.8440 -88.8440 -88.8440 1.5444 1.5444 3.7830 3.7830 5.8794 5.8794 5.9825 5.9825 6.2879 6.2879 6.4448 6.4448 6.4532 6.4532 6.8840 6.8840 6.9331 6.9331 7.3887 7.3887 7.6171 7.6171 7.6369 7.6369 8.2952 8.2952 9.8881 9.8881 9.9104 9.9104 12.4100 12.4100 12.4724 12.4724 13.9639 13.9639 16.4723 16.4723 k = 0.3913 0.2259 0.1597 ( 4440 PWs) bands (ev): -88.8687 -88.8687 -88.8506 -88.8506 -88.8440 -88.8440 -88.8440 -88.8440 1.6283 1.6283 3.6725 3.6725 5.8771 5.8771 5.9812 5.9812 6.3098 6.3098 6.4461 6.4461 6.4550 6.4550 6.9052 6.9052 6.9558 6.9558 7.3216 7.3216 7.6079 7.6079 7.6321 7.6321 8.3138 8.3138 9.8562 9.8562 9.8792 9.8792 12.3904 12.3904 12.4547 12.4547 13.9593 13.9593 16.5468 16.5468 k = 0.4022 0.2322 0.1642 ( 4425 PWs) bands (ev): -88.8684 -88.8684 -88.8508 -88.8508 -88.8440 -88.8440 -88.8440 -88.8440 1.7140 1.7140 3.5624 3.5624 5.8750 5.8750 5.9799 5.9799 6.3330 6.3330 6.4473 6.4473 6.4569 6.4569 6.9254 6.9254 6.9774 6.9774 7.2568 7.2568 7.5989 7.5989 7.6273 7.6273 8.3312 8.3312 9.8267 9.8267 9.8501 9.8501 12.3728 12.3728 12.4389 12.4389 13.9551 13.9551 16.6187 16.6187 k = 0.4130 0.2385 0.1686 ( 4443 PWs) bands (ev): -88.8682 -88.8682 -88.8510 -88.8510 -88.8440 -88.8440 -88.8440 -88.8440 1.8014 1.8014 3.4528 3.4528 5.8731 5.8731 5.9788 5.9788 6.3570 6.3570 6.4483 6.4483 6.4594 6.4594 6.9444 6.9444 6.9971 6.9971 7.1954 7.1954 7.5900 7.5900 7.6225 7.6225 8.3471 8.3471 9.7996 9.7996 9.8235 9.8235 12.3573 12.3573 12.4249 12.4249 13.9512 13.9512 16.6874 16.6874 k = 0.4239 0.2447 0.1731 ( 4437 PWs) bands (ev): -88.8681 -88.8681 -88.8512 -88.8512 -88.8440 -88.8440 -88.8440 -88.8440 1.8904 1.8904 3.3441 3.3441 5.8714 5.8714 5.9778 5.9778 6.3812 6.3812 6.4492 6.4492 6.4630 6.4630 6.9619 6.9619 7.0132 7.0132 7.1391 7.1391 7.5813 7.5813 7.6180 7.6180 8.3613 8.3613 9.7752 9.7752 9.7994 9.7994 12.3438 12.3438 12.4127 12.4127 13.9476 13.9476 16.7518 16.7518 k = 0.4348 0.2510 0.1775 ( 4431 PWs) bands (ev): -88.8679 -88.8679 -88.8514 -88.8514 -88.8440 -88.8440 -88.8440 -88.8440 1.9807 1.9807 3.2365 3.2365 5.8699 5.8699 5.9769 5.9769 6.4037 6.4037 6.4499 6.4499 6.4694 6.4694 6.9777 6.9777 7.0186 7.0186 7.0951 7.0951 7.5730 7.5730 7.6137 7.6137 8.3739 8.3739 9.7536 9.7536 9.7781 9.7781 12.3322 12.3322 12.4023 12.4023 13.9445 13.9445 16.8110 16.8110 k = 0.4457 0.2573 0.1819 ( 4437 PWs) bands (ev): -88.8678 -88.8678 -88.8515 -88.8515 -88.8440 -88.8440 -88.8440 -88.8440 2.0721 2.0721 3.1304 3.1304 5.8686 5.8686 5.9762 5.9762 6.4216 6.4216 6.4505 6.4505 6.4809 6.4809 6.9916 6.9916 6.9966 6.9966 7.0804 7.0804 7.5652 7.5652 7.6097 7.6097 8.3846 8.3846 9.7351 9.7351 9.7597 9.7597 12.3224 12.3224 12.3935 12.3935 13.9418 13.9418 16.8636 16.8637 k = 0.4565 0.2636 0.1864 ( 4449 PWs) bands (ev): -88.8677 -88.8677 -88.8516 -88.8516 -88.8440 -88.8440 -88.8440 -88.8440 2.1638 2.1638 3.0266 3.0266 5.8676 5.8676 5.9755 5.9755 6.4326 6.4326 6.4510 6.4510 6.4991 6.4991 6.9567 6.9567 7.0034 7.0034 7.0857 7.0857 7.5583 7.5583 7.6063 7.6063 8.3934 8.3934 9.7198 9.7198 9.7445 9.7445 12.3145 12.3145 12.3864 12.3864 13.9396 13.9396 16.8893 16.8893 k = 0.4674 0.2698 0.1908 ( 4449 PWs) bands (ev): -88.8676 -88.8676 -88.8517 -88.8517 -88.8440 -88.8440 -88.8440 -88.8440 2.2547 2.2547 2.9261 2.9261 5.8668 5.8668 5.9750 5.9750 6.4384 6.4384 6.4514 6.4514 6.5211 6.5211 6.9166 6.9166 7.0127 7.0127 7.0944 7.0944 7.5525 7.5525 7.6035 7.6035 8.4003 8.4003 9.7077 9.7077 9.7325 9.7325 12.3083 12.3083 12.3808 12.3808 13.9378 13.9378 16.9079 16.9080 k = 0.4783 0.2761 0.1952 ( 4449 PWs) bands (ev): -88.8675 -88.8675 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.3419 2.3419 2.8321 2.8321 5.8662 5.8662 5.9747 5.9747 6.4413 6.4413 6.4517 6.4517 6.5423 6.5423 6.8828 6.8828 7.0196 7.0196 7.1018 7.1018 7.5481 7.5481 7.6014 7.6014 8.4053 8.4053 9.6990 9.6990 9.7238 9.7238 12.3040 12.3040 12.3769 12.3769 13.9366 13.9366 16.9216 16.9216 k = 0.4891 0.2824 0.1997 ( 4446 PWs) bands (ev): -88.8675 -88.8675 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4163 2.4163 2.7536 2.7536 5.8659 5.8659 5.9745 5.9745 6.4426 6.4426 6.4518 6.4518 6.5581 6.5581 6.8596 6.8596 7.0237 7.0237 7.1065 7.1065 7.5453 7.5453 7.6001 7.6001 8.4083 8.4083 9.6938 9.6938 9.7186 9.7186 12.3014 12.3014 12.3746 12.3746 13.9358 13.9358 16.9299 16.9299 k = 0.5000 0.2887 0.2041 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4505 2.4505 2.7181 2.7181 5.8658 5.8658 5.9744 5.9744 6.4430 6.4430 6.4519 6.4519 6.5640 6.5640 6.8513 6.8513 7.0251 7.0251 7.1082 7.1082 7.5444 7.5444 7.5997 7.5997 8.4093 8.4093 9.6920 9.6920 9.7169 9.7169 12.3005 12.3005 12.3738 12.3738 13.9356 13.9356 16.9327 16.9327 k = 0.5000 0.2887 0.2041 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4505 2.4505 2.7181 2.7181 5.8658 5.8658 5.9744 5.9744 6.4430 6.4430 6.4519 6.4519 6.5640 6.5640 6.8513 6.8513 7.0251 7.0251 7.1082 7.1082 7.5444 7.5444 7.5997 7.5997 8.4093 8.4093 9.6920 9.6920 9.7169 9.7169 12.3005 12.3005 12.3738 12.3738 13.9356 13.9356 16.9327 16.9327 k = 0.5038 0.2777 0.2103 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4519 2.4519 2.7189 2.7189 5.8640 5.8640 5.9725 5.9725 6.4433 6.4433 6.4523 6.4523 6.5631 6.5631 6.8540 6.8540 7.0250 7.0250 7.1078 7.1078 7.5442 7.5442 7.5996 7.5996 8.4102 8.4102 9.6860 9.6860 9.7113 9.7113 12.3053 12.3053 12.3784 12.3784 13.9425 13.9425 16.8021 16.8021 k = 0.5076 0.2668 0.2165 ( 4444 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4559 2.4559 2.7214 2.7214 5.8584 5.8584 5.9674 5.9674 6.4441 6.4441 6.4534 6.4534 6.5603 6.5603 6.8619 6.8619 7.0246 7.0246 7.1066 7.1066 7.5438 7.5438 7.5993 7.5993 8.4128 8.4128 9.6656 9.6656 9.6977 9.6977 12.3192 12.3192 12.3920 12.3920 13.9634 13.9634 16.6447 16.6447 k = 0.5114 0.2559 0.2227 ( 4438 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4626 2.4626 2.7256 2.7256 5.8477 5.8477 5.9608 5.9608 6.4452 6.4452 6.4553 6.4553 6.5559 6.5559 6.8746 6.8746 7.0240 7.0240 7.1047 7.1047 7.5430 7.5430 7.5989 7.5989 8.4170 8.4170 9.6285 9.6285 9.6795 9.6795 12.3414 12.3414 12.4139 12.4139 13.9983 13.9983 16.4884 16.4884 k = 0.5152 0.2449 0.2289 ( 4438 PWs) bands (ev): -88.8673 -88.8673 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4720 2.4720 2.7314 2.7314 5.8305 5.8305 5.9547 5.9547 6.4465 6.4465 6.4580 6.4580 6.5499 6.5499 6.8913 6.8913 7.0232 7.0232 7.1021 7.1021 7.5418 7.5418 7.5984 7.5984 8.4226 8.4226 9.5767 9.5767 9.6570 9.6570 12.3709 12.3709 12.4430 12.4430 14.0473 14.0473 16.3347 16.3347 k = 0.5189 0.2340 0.2351 ( 4438 PWs) bands (ev): -88.8673 -88.8673 -88.8520 -88.8520 -88.8440 -88.8440 -88.8440 -88.8440 2.4841 2.4841 2.7389 2.7389 5.8059 5.8059 5.9506 5.9506 6.4476 6.4477 6.4612 6.4612 6.5427 6.5427 6.9113 6.9113 7.0222 7.0222 7.0989 7.0989 7.5401 7.5401 7.5981 7.5981 8.4295 8.4295 9.5134 9.5134 9.6296 9.6296 12.4066 12.4066 12.4777 12.4777 14.1100 14.1100 16.1842 16.1842 k = 0.5227 0.2231 0.2412 ( 4434 PWs) bands (ev): -88.8672 -88.8672 -88.8521 -88.8521 -88.8440 -88.8440 -88.8440 -88.8440 2.4989 2.4989 2.7480 2.7480 5.7743 5.7743 5.9491 5.9491 6.4480 6.4480 6.4650 6.4650 6.5349 6.5349 6.9335 6.9335 7.0212 7.0212 7.0952 7.0952 7.5378 7.5378 7.5980 7.5980 8.4373 8.4373 9.4414 9.4414 9.5975 9.5975 12.4473 12.4473 12.5162 12.5162 14.1862 14.1862 16.0381 16.0381 k = 0.5265 0.2121 0.2474 ( 4428 PWs) bands (ev): -88.8671 -88.8671 -88.8522 -88.8522 -88.8440 -88.8440 -88.8440 -88.8440 2.5163 2.5163 2.7588 2.7588 5.7365 5.7365 5.9498 5.9498 6.4468 6.4468 6.4691 6.4691 6.5275 6.5275 6.9567 6.9567 7.0206 7.0206 7.0913 7.0913 7.5349 7.5349 7.5982 7.5982 8.4456 8.4456 9.3633 9.3633 9.5609 9.5609 12.4917 12.4917 12.5574 12.5574 14.2749 14.2749 15.8973 15.8973 k = 0.5303 0.2012 0.2536 ( 4430 PWs) bands (ev): -88.8670 -88.8670 -88.8523 -88.8523 -88.8440 -88.8440 -88.8440 -88.8440 2.5364 2.5364 2.7713 2.7713 5.6936 5.6936 5.9523 5.9523 6.4423 6.4423 6.4735 6.4735 6.5219 6.5219 6.9786 6.9786 7.0215 7.0215 7.0876 7.0876 7.5314 7.5314 7.5988 7.5988 8.4536 8.4536 9.2816 9.2816 9.5203 9.5203 12.5372 12.5372 12.6017 12.6017 14.3746 14.3746 15.7635 15.7635 k = 0.5341 0.1903 0.2598 ( 4430 PWs) bands (ev): -88.8669 -88.8669 -88.8524 -88.8524 -88.8440 -88.8440 -88.8440 -88.8440 2.5591 2.5591 2.7854 2.7854 5.6464 5.6464 5.9563 5.9563 6.4331 6.4331 6.4783 6.4783 6.5195 6.5195 6.9940 6.9940 7.0274 7.0274 7.0854 7.0854 7.5272 7.5272 7.5999 7.5999 8.4605 8.4605 9.1992 9.1992 9.4760 9.4760 12.5800 12.5800 12.6508 12.6508 14.4825 14.4825 15.6392 15.6392 k = 0.5379 0.1793 0.2660 ( 4432 PWs) bands (ev): -88.8668 -88.8668 -88.8525 -88.8525 -88.8440 -88.8440 -88.8440 -88.8440 2.5845 2.5845 2.8011 2.8011 5.5955 5.5955 5.9614 5.9614 6.4187 6.4187 6.4836 6.4836 6.5208 6.5208 6.9990 6.9990 7.0387 7.0387 7.0880 7.0880 7.5225 7.5225 7.6015 7.6015 8.4650 8.4650 9.1187 9.1187 9.4286 9.4286 12.6164 12.6164 12.7071 12.7071 14.5940 14.5940 15.5290 15.5290 k = 0.5417 0.1684 0.2722 ( 4434 PWs) bands (ev): -88.8667 -88.8667 -88.8526 -88.8526 -88.8440 -88.8440 -88.8440 -88.8440 2.6124 2.6124 2.8184 2.8184 5.5414 5.5414 5.9674 5.9674 6.3995 6.3995 6.4893 6.4893 6.5252 6.5252 6.9982 6.9982 7.0452 7.0452 7.1003 7.1003 7.5173 7.5173 7.6036 7.6036 8.4651 8.4651 9.0432 9.0432 9.3784 9.3784 12.6450 12.6450 12.7702 12.7702 14.6997 14.6997 15.4416 15.4416 k = 0.5455 0.1575 0.2784 ( 4439 PWs) bands (ev): -88.8665 -88.8665 -88.8528 -88.8528 -88.8440 -88.8440 -88.8440 -88.8440 2.6430 2.6430 2.8374 2.8374 5.4844 5.4844 5.9743 5.9743 6.3762 6.3762 6.4957 6.4957 6.5317 6.5317 6.9952 6.9952 7.0446 7.0446 7.1211 7.1211 7.5117 7.5117 7.6060 7.6060 8.4585 8.4585 8.9763 8.9763 9.3259 9.3259 12.6661 12.6661 12.8390 12.8390 14.7821 14.7821 15.3944 15.3944 k = 0.5492 0.1465 0.2845 ( 4435 PWs) bands (ev): -88.8663 -88.8663 -88.8529 -88.8529 -88.8440 -88.8440 -88.8440 -88.8440 2.6762 2.6762 2.8579 2.8579 5.4247 5.4247 5.9819 5.9819 6.3496 6.3496 6.5027 6.5027 6.5399 6.5399 6.9908 6.9908 7.0407 7.0407 7.1454 7.1454 7.5058 7.5058 7.6089 7.6089 8.4421 8.4421 8.9217 8.9217 9.2713 9.2713 12.6796 12.6796 12.9123 12.9123 14.8180 14.8180 15.4105 15.4105 k = 0.5530 0.1356 0.2907 ( 4433 PWs) bands (ev): -88.8662 -88.8662 -88.8531 -88.8531 -88.8440 -88.8440 -88.8440 -88.8440 2.7119 2.7119 2.8801 2.8801 5.3625 5.3625 5.9900 5.9900 6.3199 6.3199 6.5103 6.5103 6.5492 6.5492 6.9855 6.9855 7.0355 7.0355 7.1706 7.1706 7.4997 7.4997 7.6122 7.6122 8.4140 8.4140 8.8821 8.8821 9.2151 9.2151 12.6851 12.6851 12.9892 12.9892 14.8029 14.8029 15.4941 15.4941 k = 0.5568 0.1247 0.2969 ( 4432 PWs) bands (ev): -88.8660 -88.8660 -88.8533 -88.8533 -88.8440 -88.8440 -88.8440 -88.8440 2.7501 2.7501 2.9038 2.9038 5.2977 5.2977 5.9986 5.9986 6.2877 6.2877 6.5186 6.5186 6.5595 6.5595 6.9792 6.9792 7.0301 7.0301 7.1958 7.1958 7.4934 7.4934 7.6157 7.6157 8.3743 8.3743 8.8580 8.8580 9.1576 9.1576 12.6821 12.6821 13.0691 13.0691 14.7584 14.7584 15.6235 15.6235 k = 0.5606 0.1137 0.3031 ( 4430 PWs) bands (ev): -88.8658 -88.8658 -88.8535 -88.8535 -88.8440 -88.8440 -88.8440 -88.8440 2.7909 2.7909 2.9291 2.9291 5.2305 5.2305 6.0075 6.0075 6.2534 6.2534 6.5274 6.5274 6.5705 6.5705 6.9721 6.9721 7.0246 7.0246 7.2203 7.2203 7.4871 7.4871 7.6196 7.6196 8.3254 8.3254 8.8473 8.8473 9.0991 9.0991 12.6699 12.6699 13.1518 13.1518 14.7050 14.7050 15.7781 15.7781 k = 0.5644 0.1028 0.3093 ( 4431 PWs) bands (ev): -88.8656 -88.8656 -88.8537 -88.8537 -88.8440 -88.8440 -88.8440 -88.8440 2.8341 2.8341 2.9559 2.9559 5.1608 5.1608 6.0165 6.0165 6.2173 6.2173 6.5369 6.5369 6.5822 6.5822 6.9641 6.9641 7.0193 7.0193 7.2441 7.2441 7.4808 7.4808 7.6237 7.6237 8.2708 8.2708 8.8464 8.8464 9.0401 9.0401 12.6479 12.6479 13.2366 13.2366 14.6537 14.6537 15.9465 15.9465 k = 0.5682 0.0919 0.3155 ( 4429 PWs) bands (ev): -88.8654 -88.8654 -88.8539 -88.8539 -88.8440 -88.8440 -88.8440 -88.8440 2.8798 2.8798 2.9842 2.9842 5.0887 5.0887 6.0250 6.0250 6.1804 6.1804 6.5469 6.5469 6.5945 6.5945 6.9554 6.9554 7.0142 7.0142 7.2668 7.2668 7.4746 7.4746 7.6281 7.6281 8.2139 8.2139 8.8516 8.8516 8.9815 8.9815 12.6159 12.6159 13.3233 13.3233 14.6100 14.6100 16.1229 16.1229 k = 0.5720 0.0809 0.3217 ( 4423 PWs) bands (ev): -88.8652 -88.8652 -88.8541 -88.8541 -88.8440 -88.8440 -88.8440 -88.8440 2.9279 2.9279 3.0140 3.0140 5.0141 5.0141 6.0318 6.0318 6.1441 6.1441 6.5575 6.5575 6.6071 6.6071 6.9461 6.9461 7.0094 7.0094 7.2884 7.2884 7.4686 7.4686 7.6327 7.6327 8.1571 8.1571 8.8572 8.8572 8.9268 8.9268 12.5737 12.5737 13.4116 13.4116 14.5764 14.5764 16.3035 16.3035 k = 0.5758 0.0700 0.3278 ( 4427 PWs) bands (ev): -88.8649 -88.8649 -88.8543 -88.8543 -88.8440 -88.8440 -88.8440 -88.8440 2.9782 2.9782 3.0454 3.0454 4.9370 4.9370 6.0332 6.0332 6.1126 6.1126 6.5687 6.5687 6.6201 6.6201 6.9363 6.9363 7.0047 7.0047 7.3089 7.3089 7.4629 7.4629 7.6374 7.6374 8.1022 8.1022 8.8386 8.8386 8.8991 8.8991 12.5216 12.5216 13.5011 13.5011 14.5540 14.5540 16.4855 16.4855 k = 0.5795 0.0590 0.3340 ( 4423 PWs) bands (ev): -88.8647 -88.8647 -88.8546 -88.8546 -88.8440 -88.8440 -88.8440 -88.8440 3.0308 3.0308 3.0782 3.0782 4.8574 4.8574 6.0201 6.0201 6.0952 6.0952 6.5803 6.5803 6.6334 6.6334 6.9260 6.9260 7.0002 7.0002 7.3281 7.3281 7.4576 7.4576 7.6423 7.6423 8.0502 8.0502 8.7862 8.7862 8.9069 8.9069 12.4603 12.4603 13.5916 13.5916 14.5432 14.5432 16.6663 16.6663 k = 0.5833 0.0481 0.3402 ( 4430 PWs) bands (ev): -88.8645 -88.8645 -88.8548 -88.8548 -88.8440 -88.8440 -88.8440 -88.8440 3.0853 3.0853 3.1128 3.1128 4.7755 4.7755 5.9904 5.9904 6.0946 6.0946 6.5923 6.5923 6.6469 6.6469 6.9154 6.9154 6.9957 6.9957 7.3460 7.3460 7.4528 7.4528 7.6474 7.6474 8.0019 8.0019 8.7272 8.7272 8.9226 8.9226 12.3906 12.3906 13.6828 13.6828 14.5436 14.5436 16.7864 16.7864 k = 0.5871 0.0372 0.3464 ( 4429 PWs) bands (ev): -88.8642 -88.8642 -88.8550 -88.8550 -88.8440 -88.8440 -88.8440 -88.8440 3.1397 3.1397 3.1510 3.1510 4.6912 4.6912 5.9534 5.9534 6.1016 6.1016 6.6047 6.6047 6.6605 6.6605 6.9046 6.9046 6.9913 6.9913 7.3626 7.3626 7.4485 7.4485 7.6524 7.6524 7.9576 7.9576 8.6671 8.6671 8.9401 8.9401 12.3137 12.3137 13.7743 13.7743 14.5543 14.5543 16.7852 16.7852 k = 0.5909 0.0262 0.3526 ( 4434 PWs) bands (ev): -88.8640 -88.8640 -88.8553 -88.8553 -88.8440 -88.8440 -88.8440 -88.8440 3.1826 3.1826 3.2040 3.2040 4.6047 4.6047 5.9144 5.9144 6.1113 6.1113 6.6173 6.6173 6.6742 6.6742 6.8935 6.8935 6.9869 6.9869 7.3777 7.3777 7.4450 7.4450 7.6575 7.6575 7.9177 7.9177 8.6069 8.6069 8.9582 8.9582 12.2307 12.2307 13.8659 13.8659 14.5745 14.5745 16.7859 16.7859 k = 0.5947 0.0153 0.3588 ( 4436 PWs) bands (ev): -88.8637 -88.8637 -88.8556 -88.8556 -88.8440 -88.8440 -88.8440 -88.8440 3.2214 3.2214 3.2643 3.2643 4.5162 4.5162 5.8753 5.8753 6.1223 6.1223 6.6300 6.6300 6.6879 6.6879 6.8823 6.8823 6.9825 6.9825 7.3914 7.3914 7.4426 7.4426 7.6625 7.6625 7.8822 7.8822 8.5471 8.5471 8.9762 8.9762 12.1428 12.1428 13.9573 13.9573 14.6030 14.6030 16.7891 16.7891 k = 0.5985 0.0044 0.3649 ( 4439 PWs) bands (ev): -88.8635 -88.8635 -88.8558 -88.8558 -88.8440 -88.8440 -88.8440 -88.8440 3.2609 3.2609 3.3267 3.3267 4.4260 4.4260 5.8370 5.8370 6.1338 6.1338 6.6426 6.6426 6.7016 6.7016 6.8711 6.8711 6.9781 6.9781 7.4033 7.4033 7.4414 7.4414 7.6672 7.6672 7.8512 7.8512 8.4879 8.4879 8.9938 8.9938 12.0512 12.0512 14.0481 14.0481 14.6389 14.6389 16.7953 16.7953 k = 0.6023-0.0066 0.3711 ( 4437 PWs) bands (ev): -88.8632 -88.8632 -88.8561 -88.8561 -88.8440 -88.8440 -88.8440 -88.8440 3.3015 3.3015 3.3907 3.3907 4.3347 4.3347 5.8001 5.8001 6.1455 6.1455 6.6549 6.6549 6.7152 6.7152 6.8598 6.8598 6.9737 6.9737 7.4132 7.4132 7.4420 7.4420 7.6717 7.6717 7.8248 7.8248 8.4297 8.4297 9.0107 9.0107 11.9567 11.9567 14.1380 14.1380 14.6811 14.6811 16.8045 16.8045 k = 0.6061-0.0175 0.3773 ( 4439 PWs) bands (ev): -88.8630 -88.8630 -88.8563 -88.8563 -88.8440 -88.8440 -88.8440 -88.8440 3.3431 3.3431 3.4555 3.4555 4.2428 4.2428 5.7649 5.7649 6.1574 6.1574 6.6665 6.6665 6.7289 6.7289 6.8486 6.8486 6.9693 6.9693 7.4210 7.4210 7.4447 7.4447 7.6756 7.6756 7.8028 7.8028 8.3726 8.3726 9.0266 9.0266 11.8604 11.8604 14.2266 14.2266 14.7288 14.7288 16.8171 16.8171 k = 0.6098-0.0284 0.3835 ( 4429 PWs) bands (ev): -88.8627 -88.8627 -88.8566 -88.8566 -88.8440 -88.8440 -88.8440 -88.8440 3.3855 3.3855 3.5202 3.5202 4.1515 4.1515 5.7317 5.7317 6.1694 6.1694 6.6771 6.6771 6.7426 6.7426 6.8376 6.8376 6.9649 6.9649 7.4267 7.4267 7.4496 7.4496 7.6789 7.6789 7.7852 7.7852 8.3171 8.3171 9.0415 9.0415 11.7630 11.7630 14.3137 14.3137 14.7811 14.7811 16.8333 16.8333 k = 0.6136-0.0394 0.3897 ( 4423 PWs) bands (ev): -88.8625 -88.8625 -88.8568 -88.8568 -88.8440 -88.8440 -88.8440 -88.8440 3.4285 3.4285 3.5827 3.5827 4.0634 4.0634 5.7007 5.7007 6.1812 6.1812 6.6865 6.6865 6.7560 6.7560 6.8270 6.8270 6.9607 6.9607 7.4316 7.4316 7.4559 7.4559 7.6811 7.6811 7.7716 7.7716 8.2635 8.2635 9.0551 9.0551 11.6652 11.6652 14.3989 14.3989 14.8371 14.8371 16.8531 16.8531 k = 0.6174-0.0503 0.3959 ( 4423 PWs) bands (ev): -88.8623 -88.8623 -88.8570 -88.8570 -88.8440 -88.8440 -88.8440 -88.8440 3.4714 3.4714 3.6377 3.6377 3.9845 3.9845 5.6721 5.6721 6.1930 6.1930 6.6943 6.6943 6.7687 6.7687 6.8172 6.8172 6.9568 6.9568 7.4364 7.4364 7.4628 7.4628 7.6822 7.6822 7.7618 7.7618 8.2124 8.2124 9.0673 9.0673 11.5676 11.5676 14.4819 14.4819 14.8963 14.8963 16.8768 16.8768 k = 0.6212-0.0612 0.4021 ( 4424 PWs) bands (ev): -88.8621 -88.8621 -88.8572 -88.8572 -88.8440 -88.8440 -88.8440 -88.8440 3.5124 3.5124 3.6706 3.6706 3.9312 3.9312 5.6460 5.6460 6.2046 6.2046 6.7003 6.7003 6.7790 6.7790 6.8097 6.8097 6.9536 6.9536 7.4417 7.4417 7.4702 7.4702 7.6820 7.6820 7.7550 7.7550 8.1645 8.1645 9.0780 9.0780 11.4708 11.4708 14.5623 14.5623 14.9580 14.9580 16.9044 16.9044 k = 0.6250-0.0722 0.4082 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.6250-0.0722 0.4082 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.6184-0.0684 0.4190 ( 4426 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5439 3.5439 3.6651 3.6651 3.9302 3.9302 5.6164 5.6164 6.2182 6.2182 6.7041 6.7041 6.7792 6.7792 6.8083 6.8083 6.9551 6.9551 7.4479 7.4479 7.4786 7.4786 7.6798 7.6798 7.7500 7.7500 8.1133 8.1133 9.0995 9.0995 11.3734 11.3734 14.6363 14.6363 15.0143 15.0143 16.9436 16.9436 k = 0.6118-0.0646 0.4297 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5461 3.5461 3.6675 3.6675 3.9343 3.9343 5.5977 5.5977 6.2249 6.2249 6.7027 6.7027 6.7716 6.7716 6.8063 6.8063 6.9657 6.9657 7.4496 7.4496 7.4787 7.4787 7.6786 7.6786 7.7487 7.7487 8.0924 8.0924 9.1351 9.1351 11.3683 11.3683 14.6261 14.6261 14.9931 14.9931 16.9663 16.9663 k = 0.6053-0.0608 0.4405 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.5496 3.5496 3.6715 3.6715 3.9411 3.9411 5.5675 5.5675 6.2352 6.2352 6.7001 6.7001 6.7609 6.7609 6.8033 6.8033 6.9814 6.9814 7.4525 7.4525 7.4790 7.4790 7.6768 7.6768 7.7466 7.7466 8.0609 8.0609 9.1909 9.1909 11.3598 11.3598 14.6096 14.6096 14.9592 14.9592 17.0027 17.0027 k = 0.5987-0.0570 0.4512 ( 4420 PWs) bands (ev): -88.8618 -88.8618 -88.8575 -88.8575 -88.8440 -88.8440 -88.8440 -88.8440 3.5546 3.5546 3.6770 3.6770 3.9505 3.9505 5.5269 5.5269 6.2484 6.2484 6.6959 6.6959 6.7491 6.7491 6.7994 6.7994 7.0008 7.0008 7.4565 7.4565 7.4794 7.4794 7.6742 7.6742 7.7436 7.7436 8.0224 8.0224 9.2629 9.2629 11.3478 11.3478 14.5875 14.5875 14.9144 14.9144 17.0510 17.0510 k = 0.5921-0.0532 0.4620 ( 4422 PWs) bands (ev): -88.8618 -88.8618 -88.8575 -88.8575 -88.8440 -88.8440 -88.8440 -88.8440 3.5610 3.5610 3.6840 3.6840 3.9627 3.9627 5.4770 5.4770 6.2635 6.2635 6.6891 6.6891 6.7381 6.7381 6.7948 6.7948 7.0227 7.0227 7.4612 7.4612 7.4799 7.4799 7.6708 7.6708 7.7398 7.7398 7.9800 7.9800 9.3475 9.3475 11.3323 11.3323 14.5606 14.5606 14.8609 14.8609 17.1092 17.1092 k = 0.5855-0.0494 0.4727 ( 4421 PWs) bands (ev): -88.8617 -88.8617 -88.8576 -88.8576 -88.8440 -88.8440 -88.8440 -88.8440 3.5688 3.5688 3.6925 3.6925 3.9775 3.9775 5.4190 5.4190 6.2799 6.2799 6.6793 6.6793 6.7292 6.7292 6.7898 6.7898 7.0464 7.0464 7.4667 7.4667 7.4805 7.4805 7.6667 7.6667 7.7352 7.7352 7.9363 7.9363 9.4415 9.4415 11.3133 11.3133 14.5299 14.5299 14.8007 14.8007 17.1751 17.1751 k = 0.5789-0.0456 0.4835 ( 4421 PWs) bands (ev): -88.8616 -88.8616 -88.8577 -88.8577 -88.8440 -88.8440 -88.8440 -88.8440 3.5779 3.5779 3.7024 3.7024 3.9950 3.9950 5.3539 5.3539 6.2970 6.2970 6.6666 6.6666 6.7227 6.7227 6.7845 6.7845 7.0714 7.0714 7.4725 7.4725 7.4815 7.4815 7.6617 7.6617 7.7297 7.7297 7.8931 7.8931 9.5425 9.5425 11.2906 11.2906 14.4964 14.4964 14.7361 14.7361 17.2470 17.2470 k = 0.5724-0.0418 0.4942 ( 4423 PWs) bands (ev): -88.8615 -88.8615 -88.8578 -88.8578 -88.8440 -88.8440 -88.8440 -88.8440 3.5885 3.5885 3.7135 3.7135 4.0152 4.0152 5.2827 5.2827 6.3145 6.3145 6.6520 6.6520 6.7179 6.7179 6.7792 6.7792 7.0974 7.0974 7.4774 7.4774 7.4838 7.4838 7.6559 7.6559 7.7232 7.7232 7.8518 7.8518 9.6485 9.6485 11.2643 11.2643 14.4612 14.4612 14.6688 14.6688 17.3230 17.3230 k = 0.5658-0.0380 0.5049 ( 4419 PWs) bands (ev): -88.8614 -88.8614 -88.8579 -88.8579 -88.8440 -88.8440 -88.8440 -88.8440 3.6004 3.6004 3.7258 3.7258 4.0380 4.0380 5.2064 5.2064 6.3321 6.3321 6.6365 6.6365 6.7141 6.7141 6.7739 6.7739 7.1240 7.1240 7.4795 7.4795 7.4891 7.4891 7.6491 7.6491 7.7156 7.7156 7.8134 7.8134 9.7577 9.7577 11.2342 11.2342 14.4252 14.4252 14.6007 14.6007 17.4018 17.4018 k = 0.5592-0.0342 0.5157 ( 4423 PWs) bands (ev): -88.8613 -88.8613 -88.8580 -88.8580 -88.8440 -88.8440 -88.8440 -88.8440 3.6137 3.6137 3.7390 3.7390 4.0635 4.0635 5.1257 5.1257 6.3495 6.3495 6.6206 6.6206 6.7109 6.7109 6.7689 6.7689 7.1512 7.1512 7.4801 7.4801 7.4961 7.4961 7.6412 7.6412 7.7064 7.7064 7.7793 7.7793 9.8687 9.8687 11.2004 11.2004 14.3895 14.3895 14.5334 14.5334 17.4821 17.4821 k = 0.5526-0.0304 0.5264 ( 4425 PWs) bands (ev): -88.8611 -88.8611 -88.8581 -88.8581 -88.8440 -88.8440 -88.8440 -88.8440 3.6283 3.6283 3.7529 3.7529 4.0915 4.0915 5.0417 5.0417 6.3667 6.3667 6.6048 6.6048 6.7080 6.7080 6.7643 6.7643 7.1787 7.1787 7.4799 7.4799 7.5035 7.5035 7.6320 7.6320 7.6946 7.6946 7.7510 7.7510 9.9802 9.9802 11.1628 11.1628 14.3549 14.3549 14.4682 14.4682 17.5630 17.5630 k = 0.5461-0.0266 0.5372 ( 4425 PWs) bands (ev): -88.8610 -88.8610 -88.8583 -88.8583 -88.8440 -88.8440 -88.8440 -88.8440 3.6443 3.6443 3.7671 3.7671 4.1221 4.1221 4.9552 4.9552 6.3835 6.3835 6.5892 6.5892 6.7055 6.7055 6.7600 6.7600 7.2061 7.2061 7.4790 7.4790 7.5112 7.5112 7.6214 7.6214 7.6792 7.6792 7.7302 7.7302 10.0908 10.0908 11.1215 11.1215 14.3221 14.3221 14.4067 14.4067 17.6436 17.6436 k = 0.5395-0.0228 0.5479 ( 4422 PWs) bands (ev): -88.8608 -88.8608 -88.8584 -88.8584 -88.8440 -88.8440 -88.8440 -88.8440 3.6616 3.6616 3.7812 3.7812 4.1552 4.1552 4.8672 4.8672 6.3999 6.3999 6.5740 6.5740 6.7033 6.7033 6.7561 6.7561 7.2333 7.2333 7.4772 7.4772 7.5190 7.5190 7.6094 7.6094 7.6613 7.6613 7.7163 7.7163 10.1994 10.1994 11.0765 11.0765 14.2918 14.2918 14.3502 14.3502 17.7234 17.7234 k = 0.5329-0.0190 0.5587 ( 4424 PWs) bands (ev): -88.8606 -88.8606 -88.8586 -88.8586 -88.8440 -88.8440 -88.8440 -88.8440 3.6801 3.6801 3.7945 3.7945 4.1909 4.1909 4.7791 4.7791 6.4157 6.4157 6.5595 6.5595 6.7014 6.7014 6.7527 6.7527 7.2598 7.2598 7.4744 7.4744 7.5268 7.5268 7.5965 7.5965 7.6435 7.6435 7.7069 7.7069 10.3046 10.3046 11.0280 11.0280 14.2643 14.2643 14.3001 14.3001 17.8019 17.8019 k = 0.5263-0.0152 0.5694 ( 4425 PWs) bands (ev): -88.8605 -88.8605 -88.8588 -88.8588 -88.8440 -88.8440 -88.8440 -88.8440 3.7000 3.7000 3.8058 3.8058 4.2290 4.2290 4.6922 4.6922 6.4308 6.4308 6.5456 6.5456 6.6998 6.6998 6.7497 6.7497 7.2849 7.2849 7.4703 7.4703 7.5346 7.5346 7.5839 7.5839 7.6269 7.6269 7.7001 7.7001 10.4052 10.4052 10.9759 10.9759 14.2401 14.2401 14.2577 14.2577 17.8787 17.8787 k = 0.5197-0.0114 0.5801 ( 4419 PWs) bands (ev): -88.8603 -88.8603 -88.8590 -88.8590 -88.8440 -88.8440 -88.8440 -88.8440 3.7210 3.7210 3.8138 3.8138 4.2695 4.2695 4.6086 4.6086 6.4448 6.4448 6.5327 6.5327 6.6987 6.6987 6.7472 6.7472 7.3075 7.3075 7.4654 7.4654 7.5423 7.5423 7.5731 7.5731 7.6118 7.6118 7.6951 7.6951 10.4998 10.4998 10.9207 10.9207 14.2180 14.2180 14.2257 14.2257 17.9536 17.9536 k = 0.5132-0.0076 0.5909 ( 4412 PWs) bands (ev): -88.8601 -88.8601 -88.8592 -88.8592 -88.8440 -88.8440 -88.8440 -88.8440 3.7433 3.7433 3.8163 3.8163 4.3124 4.3124 4.5306 4.5306 6.4571 6.4571 6.5212 6.5212 6.6979 6.6979 6.7453 6.7453 7.3260 7.3260 7.4606 7.4606 7.5493 7.5493 7.5660 7.5660 7.5977 7.5977 7.6917 7.6917 10.5873 10.5873 10.8624 10.8624 14.1972 14.1972 14.2065 14.2065 18.0264 18.0264 k = 0.5066-0.0038 0.6016 ( 4416 PWs) bands (ev): -88.8599 -88.8599 -88.8594 -88.8594 -88.8440 -88.8440 -88.8440 -88.8440 3.7667 3.7667 3.8103 3.8103 4.3575 4.3575 4.4618 4.4618 6.4666 6.4666 6.5125 6.5125 6.6976 6.6976 6.7440 6.7440 7.3381 7.3381 7.4576 7.4576 7.5525 7.5525 7.5662 7.5662 7.5849 7.5849 7.6896 7.6896 10.6663 10.6663 10.8014 10.8014 14.1845 14.1845 14.1945 14.1945 18.0969 18.0969 k = 0.5000-0.0000 0.6124 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7878 3.7878 3.7958 3.7958 4.3999 4.3999 4.4107 4.4107 6.4703 6.4703 6.5089 6.5090 6.6975 6.6975 6.7435 6.7435 7.3422 7.3422 7.4569 7.4569 7.5522 7.5522 7.5734 7.5734 7.5745 7.5745 7.6890 7.6890 10.7277 10.7277 10.7462 10.7462 14.1816 14.1816 14.1889 14.1889 18.1604 18.1604 k = 0.5000-0.0000 0.6124 ( 4420 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.7878 3.7878 3.7958 3.7958 4.3999 4.3999 4.4107 4.4107 6.4703 6.4703 6.5089 6.5090 6.6975 6.6975 6.7435 6.7435 7.3422 7.3422 7.4569 7.4569 7.5522 7.5522 7.5734 7.5734 7.5745 7.5745 7.6890 7.6890 10.7277 10.7277 10.7462 10.7462 14.1816 14.1816 14.1889 14.1889 18.1604 18.1604 k = 0.5000 0.0076 0.6016 ( 4418 PWs) bands (ev): -88.8600 -88.8600 -88.8593 -88.8593 -88.8440 -88.8440 -88.8440 -88.8440 3.7528 3.7528 3.8233 3.8233 4.3418 4.3418 4.4783 4.4783 6.4636 6.4636 6.5149 6.5149 6.6973 6.6973 6.7441 6.7441 7.3351 7.3351 7.4583 7.4583 7.5539 7.5539 7.5626 7.5626 7.5901 7.5901 7.6903 7.6903 10.6452 10.6452 10.8300 10.8300 14.1763 14.1763 14.1932 14.1932 18.0679 18.0679 k = 0.5000 0.0152 0.5909 ( 4408 PWs) bands (ev): -88.8603 -88.8603 -88.8590 -88.8590 -88.8440 -88.8440 -88.8440 -88.8440 3.7100 3.7100 3.8418 3.8418 4.2936 4.2936 4.5571 4.5571 6.4494 6.4494 6.5266 6.5266 6.6970 6.6970 6.7459 6.7459 7.3167 7.3167 7.4607 7.4607 7.5518 7.5518 7.5617 7.5617 7.6111 7.6111 7.6946 7.6946 10.5557 10.5557 10.9236 10.9236 14.1680 14.1680 14.1984 14.1984 17.9672 17.9672 k = 0.5000 0.0228 0.5801 ( 4410 PWs) bands (ev): -88.8606 -88.8606 -88.8587 -88.8587 -88.8440 -88.8440 -88.8440 -88.8440 3.6650 3.6650 3.8412 3.8412 4.2668 4.2668 4.6398 4.6398 6.4329 6.4329 6.5390 6.5390 6.6967 6.6967 6.7488 6.7488 7.2918 7.2918 7.4615 7.4615 7.5448 7.5448 7.5698 7.5698 7.6356 7.6356 7.7036 7.7036 10.4677 10.4677 11.0182 11.0182 14.1593 14.1593 14.2018 14.2018 17.8646 17.8646 k = 0.5000 0.0304 0.5694 ( 4420 PWs) bands (ev): -88.8609 -88.8609 -88.8583 -88.8583 -88.8440 -88.8440 -88.8440 -88.8440 3.6189 3.6189 3.8181 3.8181 4.2648 4.2648 4.7253 4.7253 6.4154 6.4154 6.5503 6.5503 6.6969 6.6969 6.7526 6.7526 7.2639 7.2639 7.4604 7.4604 7.5380 7.5380 7.5797 7.5797 7.6595 7.6595 7.7204 7.7204 10.3815 10.3815 11.1136 11.1136 14.1510 14.1510 14.2027 14.2027 17.7619 17.7619 k = 0.5000 0.0380 0.5587 ( 4420 PWs) bands (ev): -88.8612 -88.8612 -88.8580 -88.8580 -88.8440 -88.8440 -88.8440 -88.8440 3.5726 3.5726 3.7759 3.7759 4.2844 4.2844 4.8125 4.8125 6.3975 6.3975 6.5598 6.5598 6.6978 6.6978 6.7572 6.7572 7.2351 7.2351 7.4579 7.4579 7.5311 7.5311 7.5898 7.5898 7.6795 7.6795 7.7478 7.7478 10.2973 10.2973 11.2095 11.2095 14.1436 14.1436 14.2004 14.2004 17.6605 17.6605 k = 0.5000 0.0456 0.5479 ( 4416 PWs) bands (ev): -88.8615 -88.8615 -88.8577 -88.8577 -88.8440 -88.8440 -88.8440 -88.8440 3.5264 3.5264 3.7212 3.7212 4.3190 4.3190 4.9006 4.9006 6.3795 6.3795 6.5668 6.5668 6.6995 6.6995 6.7626 6.7626 7.2066 7.2066 7.4546 7.4546 7.5239 7.5239 7.5993 7.5993 7.6971 7.6971 7.7838 7.7838 10.2152 10.2152 11.3055 11.3055 14.1374 14.1374 14.1943 14.1943 17.5617 17.5617 k = 0.5000 0.0532 0.5372 ( 4426 PWs) bands (ev): -88.8619 -88.8619 -88.8574 -88.8574 -88.8440 -88.8440 -88.8440 -88.8440 3.4807 3.4807 3.6595 3.6595 4.3631 4.3631 4.9893 4.9893 6.3616 6.3616 6.5714 6.5714 6.7016 6.7016 6.7692 6.7692 7.1790 7.1790 7.4508 7.4508 7.5164 7.5164 7.6073 7.6073 7.7157 7.7157 7.8249 7.8249 10.1353 10.1353 11.4014 11.4014 14.1329 14.1329 14.1839 14.1839 17.4666 17.4666 k = 0.5000 0.0608 0.5264 ( 4426 PWs) bands (ev): -88.8622 -88.8622 -88.8571 -88.8571 -88.8440 -88.8440 -88.8440 -88.8440 3.4357 3.4357 3.5945 3.5945 4.4130 4.4130 5.0778 5.0778 6.3439 6.3439 6.5735 6.5735 6.7036 6.7036 6.7770 6.7770 7.1530 7.1530 7.4465 7.4465 7.5085 7.5085 7.6136 7.6136 7.7372 7.7372 7.8689 7.8689 10.0579 10.0579 11.4968 11.4968 14.1306 14.1306 14.1686 14.1686 17.3764 17.3764 k = 0.5000 0.0684 0.5157 ( 4422 PWs) bands (ev): -88.8625 -88.8625 -88.8568 -88.8568 -88.8440 -88.8440 -88.8440 -88.8440 3.3915 3.3915 3.5281 3.5281 4.4668 4.4668 5.1658 5.1658 6.3266 6.3266 6.5735 6.5735 6.7047 6.7047 6.7863 6.7863 7.1288 7.1288 7.4416 7.4416 7.5007 7.5007 7.6183 7.6183 7.7625 7.7625 7.9148 7.9148 9.9831 9.9831 11.5912 11.5912 14.1302 14.1302 14.1488 14.1488 17.2919 17.2919 k = 0.5000 0.0760 0.5049 ( 4420 PWs) bands (ev): -88.8628 -88.8628 -88.8565 -88.8565 -88.8440 -88.8440 -88.8440 -88.8440 3.3484 3.3484 3.4616 3.4616 4.5233 4.5233 5.2527 5.2527 6.3097 6.3097 6.5719 6.5719 6.7044 6.7044 6.7972 6.7972 7.1070 7.1070 7.4359 7.4359 7.4932 7.4932 7.6216 7.6216 7.7919 7.7919 7.9618 7.9618 9.9110 9.9110 11.6842 11.6842 14.1178 14.1178 14.1382 14.1382 17.2140 17.2140 k = 0.5000 0.0836 0.4942 ( 4428 PWs) bands (ev): -88.8631 -88.8631 -88.8562 -88.8562 -88.8440 -88.8440 -88.8440 -88.8440 3.3063 3.3063 3.3959 3.3959 4.5816 4.5816 5.3379 5.3379 6.2936 6.2936 6.5689 6.5689 6.7022 6.7022 6.8095 6.8095 7.0875 7.0875 7.4287 7.4287 7.4865 7.4865 7.6237 7.6237 7.8254 7.8254 8.0095 8.0095 9.8420 9.8420 11.7752 11.7752 14.0856 14.0856 14.1449 14.1449 17.1433 17.1433 k = 0.5000 0.0912 0.4835 ( 4428 PWs) bands (ev): -88.8633 -88.8633 -88.8559 -88.8559 -88.8440 -88.8440 -88.8440 -88.8440 3.2653 3.2653 3.3312 3.3312 4.6413 4.6413 5.4210 5.4210 6.2782 6.2783 6.5649 6.5649 6.6979 6.6979 6.8228 6.8228 7.0707 7.0707 7.4196 7.4196 7.4813 7.4813 7.6249 7.6249 7.8631 7.8631 8.0575 8.0575 9.7762 9.7762 11.8636 11.8636 14.0458 14.0458 14.1571 14.1571 17.0804 17.0804 k = 0.5000 0.0988 0.4727 ( 4430 PWs) bands (ev): -88.8636 -88.8636 -88.8556 -88.8556 -88.8440 -88.8440 -88.8440 -88.8440 3.2255 3.2255 3.2682 3.2682 4.7020 4.7020 5.5012 5.5012 6.2640 6.2640 6.5602 6.5602 6.6916 6.6916 6.8370 6.8370 7.0566 7.0566 7.4084 7.4084 7.4776 7.4776 7.6253 7.6253 7.9051 7.9051 8.1055 8.1055 9.7140 9.7140 11.9488 11.9488 13.9991 13.9991 14.1746 14.1746 17.0254 17.0254 k = 0.5000 0.1064 0.4620 ( 4426 PWs) bands (ev): -88.8639 -88.8639 -88.8554 -88.8554 -88.8440 -88.8440 -88.8440 -88.8440 3.1869 3.1869 3.2069 3.2069 4.7634 4.7634 5.5780 5.5780 6.2512 6.2512 6.5551 6.5551 6.6834 6.6834 6.8517 6.8517 7.0450 7.0450 7.3951 7.3951 7.4756 7.4756 7.6252 7.6252 7.9515 7.9515 8.1529 8.1529 9.6556 9.6556 12.0302 12.0302 13.9456 13.9456 14.1979 14.1979 16.9785 16.9785 k = 0.5000 0.1140 0.4512 ( 4426 PWs) bands (ev): -88.8642 -88.8642 -88.8551 -88.8551 -88.8440 -88.8440 -88.8440 -88.8440 3.1458 3.1458 3.1515 3.1515 4.8253 4.8253 5.6505 5.6505 6.2401 6.2401 6.5495 6.5495 6.6734 6.6735 6.8667 6.8667 7.0360 7.0360 7.3798 7.3798 7.4749 7.4749 7.6246 7.6246 8.0026 8.0026 8.1995 8.1995 9.6014 9.6014 12.1069 12.1069 13.8856 13.8856 14.2276 14.2276 16.9395 16.9395 k = 0.5000 0.1215 0.4405 ( 4426 PWs) bands (ev): -88.8644 -88.8644 -88.8548 -88.8548 -88.8440 -88.8440 -88.8440 -88.8440 3.0895 3.0895 3.1146 3.1146 4.8875 4.8875 5.7178 5.7178 6.2315 6.2315 6.5438 6.5438 6.6622 6.6622 6.8816 6.8816 7.0292 7.0292 7.3628 7.3628 7.4754 7.4754 7.6236 7.6236 8.0583 8.0583 8.2448 8.2448 9.5519 9.5519 12.1784 12.1784 13.8195 13.8195 14.2641 14.2641 16.9074 16.9074 k = 0.5000 0.1291 0.4297 ( 4426 PWs) bands (ev): -88.8647 -88.8647 -88.8546 -88.8546 -88.8440 -88.8440 -88.8440 -88.8440 3.0343 3.0343 3.0801 3.0801 4.9499 4.9499 5.7788 5.7788 6.2260 6.2260 6.5379 6.5379 6.6498 6.6498 6.8965 6.8965 7.0244 7.0244 7.3442 7.3442 7.4768 7.4768 7.6223 7.6223 8.1187 8.1187 8.2883 8.2883 9.5075 9.5075 12.2440 12.2440 13.7478 13.7478 14.3078 14.3078 16.7468 16.7468 k = 0.5000 0.1367 0.4190 ( 4426 PWs) bands (ev): -88.8649 -88.8649 -88.8543 -88.8543 -88.8440 -88.8440 -88.8440 -88.8440 2.9813 2.9813 3.0472 3.0472 5.0122 5.0122 5.8324 5.8324 6.2246 6.2246 6.5320 6.5320 6.6367 6.6367 6.9109 6.9109 7.0215 7.0215 7.3241 7.3241 7.4791 7.4791 7.6207 7.6207 8.1836 8.1836 8.3296 8.3296 9.4689 9.4689 12.3033 12.3033 13.6711 13.6711 14.3589 14.3589 16.5483 16.5483 k = 0.5000 0.1443 0.4082 ( 4414 PWs) bands (ev): -88.8652 -88.8652 -88.8541 -88.8541 -88.8440 -88.8440 -88.8440 -88.8440 2.9306 2.9306 3.0157 3.0157 5.0744 5.0744 5.8772 5.8772 6.2285 6.2285 6.5260 6.5260 6.6231 6.6231 6.9249 6.9249 7.0201 7.0201 7.3028 7.3028 7.4820 7.4820 7.6189 7.6189 8.2524 8.2524 8.3685 8.3685 9.4367 9.4367 12.3557 12.3557 13.5902 13.5902 14.4173 14.4173 16.3527 16.3527 k = 0.5000 0.1519 0.3975 ( 4436 PWs) bands (ev): -88.8654 -88.8654 -88.8539 -88.8539 -88.8440 -88.8440 -88.8440 -88.8440 2.8822 2.8822 2.9857 2.9857 5.1363 5.1363 5.9121 5.9121 6.2386 6.2386 6.5202 6.5202 6.6094 6.6094 6.9382 6.9382 7.0201 7.0201 7.2802 7.2802 7.4856 7.4856 7.6169 7.6169 8.3232 8.3232 8.4063 8.4063 9.4115 9.4115 12.4011 12.4011 13.5059 13.5059 14.4824 14.4824 16.1617 16.1617 k = 0.5000 0.1595 0.3868 ( 4434 PWs) bands (ev): -88.8656 -88.8656 -88.8537 -88.8537 -88.8440 -88.8440 -88.8440 -88.8440 2.8363 2.8363 2.9572 2.9572 5.1978 5.1978 5.9370 5.9370 6.2549 6.2549 6.5145 6.5145 6.5957 6.5957 6.9506 6.9506 7.0212 7.0212 7.2565 7.2565 7.4896 7.4896 7.6147 7.6147 8.3877 8.3877 8.4501 8.4501 9.3939 9.3939 12.4392 12.4392 13.4189 13.4189 14.5530 14.5530 15.9772 15.9772 k = 0.5000 0.1671 0.3760 ( 4432 PWs) bands (ev): -88.8658 -88.8658 -88.8535 -88.8535 -88.8440 -88.8440 -88.8440 -88.8440 2.7928 2.7928 2.9302 2.9302 5.2586 5.2586 5.9529 5.9529 6.2765 6.2765 6.5089 6.5089 6.5824 6.5824 6.9619 6.9619 7.0234 7.0234 7.2318 7.2318 7.4940 7.4940 7.6125 7.6125 8.4293 8.4293 8.5158 8.5158 9.3842 9.3842 12.4703 12.4703 13.3301 13.3301 14.6267 14.6267 15.8025 15.8025 k = 0.5000 0.1747 0.3653 ( 4436 PWs) bands (ev): -88.8660 -88.8660 -88.8533 -88.8533 -88.8440 -88.8440 -88.8440 -88.8440 2.7518 2.7518 2.9048 2.9048 5.3186 5.3186 5.9616 5.9616 6.3015 6.3015 6.5036 6.5036 6.5696 6.5696 6.9719 6.9719 7.0266 7.0266 7.2064 7.2064 7.4987 7.4987 7.6103 7.6103 8.4526 8.4526 8.5982 8.5982 9.3826 9.3826 12.4942 12.4942 13.2403 13.2403 14.6987 14.6987 15.6426 15.6426 k = 0.5000 0.1823 0.3545 ( 4434 PWs) bands (ev): -88.8662 -88.8662 -88.8531 -88.8531 -88.8440 -88.8440 -88.8440 -88.8440 2.7133 2.7133 2.8810 2.8810 5.3775 5.3775 5.9652 5.9652 6.3279 6.3279 6.4985 6.4985 6.5575 6.5575 6.9805 6.9805 7.0305 7.0305 7.1805 7.1805 7.5036 7.5036 7.6081 7.6081 8.4665 8.4665 8.6877 8.6877 9.3889 9.3889 12.5113 12.5113 13.1504 13.1504 14.7592 14.7592 15.5080 15.5080 k = 0.5000 0.1899 0.3438 ( 4434 PWs) bands (ev): -88.8663 -88.8663 -88.8529 -88.8529 -88.8440 -88.8440 -88.8440 -88.8440 2.6774 2.6774 2.8587 2.8587 5.4353 5.4353 5.9654 5.9654 6.3541 6.3541 6.4937 6.4937 6.5464 6.5464 6.9876 6.9876 7.0346 7.0346 7.1546 7.1546 7.5087 7.5087 7.6059 7.6059 8.4739 8.4739 8.7811 8.7811 9.4025 9.4025 12.5217 12.5217 13.0611 13.0611 14.7893 14.7893 15.4178 15.4178 k = 0.5000 0.1975 0.3330 ( 4436 PWs) bands (ev): -88.8665 -88.8665 -88.8528 -88.8528 -88.8440 -88.8440 -88.8440 -88.8440 2.6441 2.6441 2.8381 2.8381 5.4915 5.4915 5.9635 5.9635 6.3788 6.3788 6.4892 6.4892 6.5365 6.5365 6.9930 6.9930 7.0382 7.0382 7.1297 7.1297 7.5137 7.5137 7.6040 7.6040 8.4762 8.4762 8.8770 8.8770 9.4224 9.4224 12.5257 12.5257 12.9735 12.9735 14.7670 14.7670 15.3946 15.3946 k = 0.5000 0.2051 0.3223 ( 4434 PWs) bands (ev): -88.8666 -88.8666 -88.8526 -88.8526 -88.8440 -88.8440 -88.8440 -88.8440 2.6133 2.6133 2.8190 2.8190 5.5459 5.5459 5.9605 5.9605 6.4009 6.4009 6.4850 6.4850 6.5284 6.5284 6.9967 6.9967 7.0393 7.0393 7.1079 7.1079 7.5186 7.5186 7.6022 7.6022 8.4744 8.4744 8.9742 8.9742 9.4474 9.4474 12.5235 12.5235 12.8883 12.8883 14.6933 14.6933 15.4377 15.4377 k = 0.5000 0.2127 0.3116 ( 4434 PWs) bands (ev): -88.8668 -88.8668 -88.8525 -88.8525 -88.8440 -88.8440 -88.8440 -88.8440 2.5852 2.5852 2.8016 2.8016 5.5982 5.5982 5.9570 5.9570 6.4193 6.4193 6.4812 6.4812 6.5226 6.5226 6.9978 6.9978 7.0349 7.0349 7.0931 7.0931 7.5233 7.5233 7.6006 7.6006 8.4696 8.4696 9.0714 9.0714 9.4763 9.4763 12.5154 12.5154 12.8064 12.8064 14.5920 14.5920 15.5241 15.5241 k = 0.5000 0.2203 0.3008 ( 4436 PWs) bands (ev): -88.8669 -88.8669 -88.8524 -88.8524 -88.8440 -88.8440 -88.8440 -88.8440 2.5597 2.5597 2.7858 2.7858 5.6478 5.6478 5.9536 5.9536 6.4332 6.4332 6.4774 6.4774 6.5203 6.5203 6.9931 6.9931 7.0263 7.0263 7.0878 7.0878 7.5277 7.5277 7.5994 7.5994 8.4628 8.4628 9.1675 9.1675 9.5076 9.5076 12.5016 12.5016 12.7289 12.7289 14.4826 14.4826 15.6346 15.6346 k = 0.5000 0.2279 0.2901 ( 4434 PWs) bands (ev): -88.8670 -88.8670 -88.8523 -88.8523 -88.8440 -88.8440 -88.8440 -88.8440 2.5369 2.5369 2.7716 2.7716 5.6942 5.6942 5.9508 5.9508 6.4421 6.4421 6.4735 6.4735 6.5220 6.5220 6.9782 6.9782 7.0213 7.0213 7.0885 7.0885 7.5316 7.5316 7.5985 7.5985 8.4547 8.4547 9.2611 9.2611 9.5402 9.5402 12.4824 12.4824 12.6569 12.6569 14.3755 14.3755 15.7596 15.7596 k = 0.5000 0.2355 0.2793 ( 4434 PWs) bands (ev): -88.8671 -88.8671 -88.8522 -88.8522 -88.8440 -88.8440 -88.8440 -88.8440 2.5167 2.5167 2.7591 2.7591 5.7366 5.7366 5.9490 5.9490 6.4465 6.4465 6.4694 6.4694 6.5274 6.5274 6.9568 6.9568 7.0206 7.0206 7.0916 7.0916 7.5350 7.5350 7.5981 7.5981 8.4461 8.4461 9.3504 9.3504 9.5726 9.5726 12.4585 12.4585 12.5915 12.5915 14.2761 14.2761 15.8940 15.8940 k = 0.5000 0.2431 0.2686 ( 4434 PWs) bands (ev): -88.8672 -88.8672 -88.8521 -88.8521 -88.8440 -88.8440 -88.8440 -88.8440 2.4992 2.4992 2.7482 2.7482 5.7741 5.7741 5.9487 5.9487 6.4478 6.4478 6.4652 6.4652 6.5348 6.5348 6.9338 6.9338 7.0212 7.0212 7.0953 7.0953 7.5378 7.5378 7.5979 7.5979 8.4376 8.4376 9.4339 9.4339 9.6037 9.6037 12.4306 12.4306 12.5339 12.5339 14.1873 14.1873 16.0354 16.0354 k = 0.5000 0.2507 0.2578 ( 4436 PWs) bands (ev): -88.8673 -88.8673 -88.8520 -88.8520 -88.8440 -88.8440 -88.8440 -88.8440 2.4843 2.4843 2.7390 2.7390 5.8057 5.8057 5.9504 5.9504 6.4475 6.4475 6.4614 6.4614 6.5426 6.5426 6.9116 6.9116 7.0222 7.0222 7.0989 7.0989 7.5401 7.5401 7.5981 7.5981 8.4297 8.4297 9.5094 9.5094 9.6325 9.6325 12.4000 12.4000 12.4851 12.4851 14.1109 14.1109 16.1821 16.1821 k = 0.5000 0.2583 0.2471 ( 4436 PWs) bands (ev): -88.8673 -88.8673 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4722 2.4722 2.7315 2.7315 5.8303 5.8303 5.9545 5.9545 6.4465 6.4465 6.4580 6.4580 6.5498 6.5498 6.8915 6.8915 7.0232 7.0232 7.1021 7.1021 7.5417 7.5417 7.5984 7.5984 8.4227 8.4227 9.5748 9.5748 9.6580 9.6580 12.3691 12.3691 12.4455 12.4455 14.0478 14.0478 16.3329 16.3329 k = 0.5000 0.2659 0.2364 ( 4440 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4627 2.4627 2.7256 2.7256 5.8476 5.8476 5.9607 5.9607 6.4452 6.4452 6.4554 6.4554 6.5558 6.5558 6.8747 6.8747 7.0240 7.0240 7.1047 7.1047 7.5430 7.5430 7.5989 7.5989 8.4170 8.4170 9.6277 9.6277 9.6797 9.6797 12.3412 12.3412 12.4146 12.4146 13.9987 13.9987 16.4872 16.4872 k = 0.5000 0.2735 0.2256 ( 4442 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4560 2.4560 2.7214 2.7214 5.8584 5.8584 5.9674 5.9674 6.4441 6.4441 6.4534 6.4534 6.5603 6.5603 6.8619 6.8619 7.0246 7.0246 7.1066 7.1066 7.5438 7.5438 7.5993 7.5993 8.4128 8.4128 9.6654 9.6654 9.6976 9.6976 12.3193 12.3193 12.3921 12.3921 13.9636 13.9636 16.6439 16.6439 k = 0.5000 0.2811 0.2149 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4519 2.4519 2.7189 2.7189 5.8640 5.8640 5.9725 5.9725 6.4433 6.4433 6.4523 6.4523 6.5631 6.5631 6.8540 6.8540 7.0250 7.0250 7.1078 7.1078 7.5442 7.5442 7.5996 7.5996 8.4102 8.4102 9.6860 9.6860 9.7113 9.7113 12.3053 12.3053 12.3784 12.3784 13.9426 13.9426 16.8017 16.8017 k = 0.5000 0.2887 0.2041 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4505 2.4505 2.7181 2.7181 5.8658 5.8658 5.9744 5.9744 6.4430 6.4430 6.4519 6.4519 6.5640 6.5640 6.8513 6.8513 7.0251 7.0251 7.1082 7.1082 7.5444 7.5444 7.5997 7.5997 8.4093 8.4093 9.6920 9.6920 9.7169 9.7169 12.3005 12.3005 12.3738 12.3738 13.9356 13.9356 16.9327 16.9327 k = 0.5000 0.2887 0.2041 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4505 2.4505 2.7181 2.7181 5.8658 5.8658 5.9744 5.9744 6.4430 6.4430 6.4519 6.4519 6.5640 6.5640 6.8513 6.8513 7.0251 7.0251 7.1082 7.1082 7.5444 7.5444 7.5997 7.5997 8.4093 8.4093 9.6920 9.6920 9.7169 9.7169 12.3005 12.3005 12.3738 12.3738 13.9356 13.9356 16.9327 16.9327 k = 0.4962 0.2865 0.2165 ( 4446 PWs) bands (ev): -88.8674 -88.8674 -88.8518 -88.8518 -88.8440 -88.8440 -88.8440 -88.8440 2.4519 2.4519 2.7189 2.7189 5.8640 5.8640 5.9725 5.9725 6.4433 6.4433 6.4523 6.4523 6.5631 6.5631 6.8540 6.8540 7.0250 7.0250 7.1078 7.1078 7.5442 7.5442 7.5996 7.5996 8.4102 8.4102 9.6860 9.6860 9.7113 9.7113 12.3053 12.3053 12.3784 12.3784 13.9425 13.9425 16.8021 16.8021 k = 0.4924 0.2843 0.2289 ( 4444 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4559 2.4559 2.7214 2.7214 5.8584 5.8584 5.9674 5.9674 6.4441 6.4441 6.4534 6.4534 6.5603 6.5603 6.8619 6.8619 7.0246 7.0246 7.1066 7.1066 7.5438 7.5438 7.5993 7.5993 8.4128 8.4128 9.6656 9.6656 9.6977 9.6977 12.3192 12.3192 12.3920 12.3920 13.9634 13.9634 16.6447 16.6447 k = 0.4886 0.2821 0.2412 ( 4438 PWs) bands (ev): -88.8674 -88.8674 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4626 2.4626 2.7256 2.7256 5.8477 5.8477 5.9608 5.9608 6.4452 6.4452 6.4553 6.4553 6.5559 6.5559 6.8746 6.8746 7.0240 7.0240 7.1047 7.1047 7.5430 7.5430 7.5989 7.5989 8.4170 8.4170 9.6285 9.6285 9.6795 9.6795 12.3414 12.3414 12.4139 12.4139 13.9983 13.9983 16.4884 16.4884 k = 0.4848 0.2799 0.2536 ( 4438 PWs) bands (ev): -88.8673 -88.8673 -88.8519 -88.8519 -88.8440 -88.8440 -88.8440 -88.8440 2.4720 2.4720 2.7314 2.7314 5.8305 5.8305 5.9547 5.9547 6.4465 6.4465 6.4580 6.4580 6.5499 6.5499 6.8913 6.8913 7.0232 7.0232 7.1021 7.1021 7.5418 7.5418 7.5984 7.5984 8.4226 8.4226 9.5767 9.5767 9.6570 9.6570 12.3709 12.3709 12.4430 12.4430 14.0473 14.0473 16.3347 16.3347 k = 0.4811 0.2777 0.2660 ( 4438 PWs) bands (ev): -88.8673 -88.8673 -88.8520 -88.8520 -88.8440 -88.8440 -88.8440 -88.8440 2.4841 2.4841 2.7389 2.7389 5.8059 5.8059 5.9506 5.9506 6.4476 6.4477 6.4612 6.4612 6.5427 6.5427 6.9113 6.9113 7.0222 7.0222 7.0989 7.0989 7.5401 7.5401 7.5981 7.5981 8.4295 8.4295 9.5134 9.5134 9.6296 9.6296 12.4066 12.4066 12.4777 12.4777 14.1100 14.1100 16.1842 16.1842 k = 0.4773 0.2756 0.2784 ( 4434 PWs) bands (ev): -88.8672 -88.8672 -88.8521 -88.8521 -88.8440 -88.8440 -88.8440 -88.8440 2.4989 2.4989 2.7480 2.7480 5.7743 5.7743 5.9491 5.9491 6.4480 6.4480 6.4650 6.4650 6.5349 6.5349 6.9335 6.9335 7.0212 7.0212 7.0952 7.0952 7.5378 7.5378 7.5980 7.5980 8.4373 8.4373 9.4414 9.4414 9.5975 9.5975 12.4473 12.4473 12.5162 12.5162 14.1862 14.1862 16.0381 16.0381 k = 0.4735 0.2734 0.2907 ( 4428 PWs) bands (ev): -88.8671 -88.8671 -88.8522 -88.8522 -88.8440 -88.8440 -88.8440 -88.8440 2.5163 2.5163 2.7588 2.7588 5.7365 5.7365 5.9498 5.9498 6.4468 6.4468 6.4691 6.4691 6.5275 6.5275 6.9567 6.9567 7.0206 7.0206 7.0913 7.0913 7.5349 7.5349 7.5982 7.5982 8.4456 8.4456 9.3633 9.3633 9.5609 9.5609 12.4917 12.4917 12.5574 12.5574 14.2749 14.2749 15.8973 15.8973 k = 0.4697 0.2712 0.3031 ( 4430 PWs) bands (ev): -88.8670 -88.8670 -88.8523 -88.8523 -88.8440 -88.8440 -88.8440 -88.8440 2.5364 2.5364 2.7713 2.7713 5.6936 5.6936 5.9523 5.9523 6.4423 6.4423 6.4735 6.4735 6.5219 6.5219 6.9786 6.9786 7.0215 7.0215 7.0876 7.0876 7.5314 7.5314 7.5988 7.5988 8.4536 8.4536 9.2816 9.2816 9.5203 9.5203 12.5372 12.5372 12.6017 12.6017 14.3746 14.3746 15.7635 15.7635 k = 0.4659 0.2690 0.3155 ( 4430 PWs) bands (ev): -88.8669 -88.8669 -88.8524 -88.8524 -88.8440 -88.8440 -88.8440 -88.8440 2.5591 2.5591 2.7854 2.7854 5.6464 5.6464 5.9563 5.9563 6.4331 6.4331 6.4783 6.4783 6.5195 6.5195 6.9940 6.9940 7.0274 7.0274 7.0854 7.0854 7.5272 7.5272 7.5999 7.5999 8.4605 8.4605 9.1992 9.1992 9.4760 9.4760 12.5800 12.5800 12.6508 12.6508 14.4825 14.4825 15.6392 15.6392 k = 0.4621 0.2668 0.3278 ( 4432 PWs) bands (ev): -88.8668 -88.8668 -88.8525 -88.8525 -88.8440 -88.8440 -88.8440 -88.8440 2.5845 2.5845 2.8011 2.8011 5.5955 5.5955 5.9614 5.9614 6.4187 6.4187 6.4836 6.4836 6.5208 6.5208 6.9990 6.9990 7.0387 7.0387 7.0880 7.0880 7.5225 7.5225 7.6015 7.6015 8.4650 8.4650 9.1187 9.1187 9.4286 9.4286 12.6164 12.6164 12.7071 12.7071 14.5940 14.5940 15.5290 15.5290 k = 0.4583 0.2646 0.3402 ( 4434 PWs) bands (ev): -88.8667 -88.8667 -88.8526 -88.8526 -88.8440 -88.8440 -88.8440 -88.8440 2.6124 2.6124 2.8184 2.8184 5.5414 5.5414 5.9674 5.9674 6.3995 6.3995 6.4893 6.4893 6.5252 6.5252 6.9982 6.9982 7.0452 7.0452 7.1003 7.1003 7.5173 7.5173 7.6036 7.6036 8.4651 8.4651 9.0432 9.0432 9.3784 9.3784 12.6450 12.6450 12.7702 12.7702 14.6997 14.6997 15.4416 15.4416 k = 0.4545 0.2624 0.3526 ( 4439 PWs) bands (ev): -88.8665 -88.8665 -88.8528 -88.8528 -88.8440 -88.8440 -88.8440 -88.8440 2.6430 2.6430 2.8374 2.8374 5.4844 5.4844 5.9743 5.9743 6.3762 6.3762 6.4957 6.4957 6.5317 6.5317 6.9952 6.9952 7.0446 7.0446 7.1211 7.1211 7.5117 7.5117 7.6060 7.6060 8.4585 8.4585 8.9763 8.9763 9.3259 9.3259 12.6661 12.6661 12.8390 12.8390 14.7821 14.7821 15.3944 15.3944 k = 0.4508 0.2602 0.3649 ( 4435 PWs) bands (ev): -88.8663 -88.8663 -88.8529 -88.8529 -88.8440 -88.8440 -88.8440 -88.8440 2.6762 2.6762 2.8579 2.8579 5.4247 5.4247 5.9819 5.9819 6.3496 6.3496 6.5027 6.5027 6.5399 6.5399 6.9908 6.9908 7.0407 7.0407 7.1454 7.1454 7.5058 7.5058 7.6089 7.6089 8.4421 8.4421 8.9217 8.9217 9.2713 9.2713 12.6796 12.6796 12.9123 12.9123 14.8180 14.8180 15.4105 15.4105 k = 0.4470 0.2581 0.3773 ( 4433 PWs) bands (ev): -88.8662 -88.8662 -88.8531 -88.8531 -88.8440 -88.8440 -88.8440 -88.8440 2.7119 2.7119 2.8801 2.8801 5.3625 5.3625 5.9900 5.9900 6.3199 6.3199 6.5103 6.5103 6.5492 6.5492 6.9855 6.9855 7.0355 7.0355 7.1706 7.1706 7.4997 7.4997 7.6122 7.6122 8.4140 8.4140 8.8821 8.8821 9.2151 9.2151 12.6851 12.6851 12.9892 12.9892 14.8029 14.8029 15.4941 15.4941 k = 0.4432 0.2559 0.3897 ( 4432 PWs) bands (ev): -88.8660 -88.8660 -88.8533 -88.8533 -88.8440 -88.8440 -88.8440 -88.8440 2.7501 2.7501 2.9038 2.9038 5.2977 5.2977 5.9986 5.9986 6.2877 6.2877 6.5186 6.5186 6.5595 6.5595 6.9792 6.9792 7.0301 7.0301 7.1958 7.1958 7.4934 7.4934 7.6157 7.6157 8.3743 8.3743 8.8580 8.8580 9.1576 9.1576 12.6821 12.6821 13.0691 13.0691 14.7584 14.7584 15.6235 15.6235 k = 0.4394 0.2537 0.4021 ( 4430 PWs) bands (ev): -88.8658 -88.8658 -88.8535 -88.8535 -88.8440 -88.8440 -88.8440 -88.8440 2.7909 2.7909 2.9291 2.9291 5.2305 5.2305 6.0075 6.0075 6.2534 6.2534 6.5274 6.5274 6.5705 6.5705 6.9721 6.9721 7.0246 7.0246 7.2203 7.2203 7.4871 7.4871 7.6196 7.6196 8.3254 8.3254 8.8473 8.8473 9.0991 9.0991 12.6699 12.6699 13.1518 13.1518 14.7050 14.7050 15.7781 15.7781 k = 0.4356 0.2515 0.4144 ( 4431 PWs) bands (ev): -88.8656 -88.8656 -88.8537 -88.8537 -88.8440 -88.8440 -88.8440 -88.8440 2.8341 2.8341 2.9559 2.9559 5.1608 5.1608 6.0165 6.0165 6.2173 6.2173 6.5369 6.5369 6.5822 6.5822 6.9641 6.9641 7.0193 7.0193 7.2441 7.2441 7.4808 7.4808 7.6237 7.6237 8.2708 8.2708 8.8464 8.8464 9.0401 9.0401 12.6479 12.6479 13.2366 13.2366 14.6537 14.6537 15.9465 15.9465 k = 0.4318 0.2493 0.4268 ( 4429 PWs) bands (ev): -88.8654 -88.8654 -88.8539 -88.8539 -88.8440 -88.8440 -88.8440 -88.8440 2.8798 2.8798 2.9842 2.9842 5.0887 5.0887 6.0250 6.0250 6.1804 6.1804 6.5469 6.5469 6.5945 6.5945 6.9554 6.9554 7.0142 7.0142 7.2668 7.2668 7.4746 7.4746 7.6281 7.6281 8.2139 8.2139 8.8516 8.8516 8.9815 8.9815 12.6159 12.6159 13.3233 13.3233 14.6100 14.6100 16.1229 16.1229 k = 0.4280 0.2471 0.4392 ( 4423 PWs) bands (ev): -88.8652 -88.8652 -88.8541 -88.8541 -88.8440 -88.8440 -88.8440 -88.8440 2.9279 2.9279 3.0140 3.0140 5.0141 5.0141 6.0318 6.0318 6.1441 6.1441 6.5575 6.5575 6.6071 6.6071 6.9461 6.9461 7.0094 7.0094 7.2884 7.2884 7.4686 7.4686 7.6327 7.6327 8.1571 8.1571 8.8572 8.8572 8.9268 8.9268 12.5737 12.5737 13.4116 13.4116 14.5764 14.5764 16.3035 16.3035 k = 0.4242 0.2449 0.4515 ( 4427 PWs) bands (ev): -88.8649 -88.8649 -88.8543 -88.8543 -88.8440 -88.8440 -88.8440 -88.8440 2.9782 2.9782 3.0454 3.0454 4.9370 4.9370 6.0332 6.0332 6.1126 6.1126 6.5687 6.5687 6.6201 6.6201 6.9363 6.9363 7.0047 7.0047 7.3089 7.3089 7.4629 7.4629 7.6374 7.6374 8.1022 8.1022 8.8386 8.8386 8.8991 8.8991 12.5216 12.5216 13.5011 13.5011 14.5540 14.5540 16.4855 16.4855 k = 0.4205 0.2427 0.4639 ( 4423 PWs) bands (ev): -88.8647 -88.8647 -88.8546 -88.8546 -88.8440 -88.8440 -88.8440 -88.8440 3.0308 3.0308 3.0782 3.0782 4.8574 4.8574 6.0201 6.0201 6.0952 6.0952 6.5803 6.5803 6.6334 6.6334 6.9260 6.9260 7.0002 7.0002 7.3281 7.3281 7.4576 7.4576 7.6423 7.6423 8.0502 8.0502 8.7862 8.7862 8.9069 8.9069 12.4603 12.4603 13.5916 13.5916 14.5432 14.5432 16.6663 16.6663 k = 0.4167 0.2406 0.4763 ( 4430 PWs) bands (ev): -88.8645 -88.8645 -88.8548 -88.8548 -88.8440 -88.8440 -88.8440 -88.8440 3.0853 3.0853 3.1128 3.1128 4.7755 4.7755 5.9904 5.9904 6.0946 6.0946 6.5923 6.5923 6.6469 6.6469 6.9154 6.9154 6.9957 6.9957 7.3460 7.3460 7.4528 7.4528 7.6474 7.6474 8.0019 8.0019 8.7272 8.7272 8.9226 8.9226 12.3906 12.3906 13.6828 13.6828 14.5436 14.5436 16.7864 16.7864 k = 0.4129 0.2384 0.4887 ( 4429 PWs) bands (ev): -88.8642 -88.8642 -88.8550 -88.8550 -88.8440 -88.8440 -88.8440 -88.8440 3.1397 3.1397 3.1510 3.1510 4.6912 4.6912 5.9534 5.9534 6.1016 6.1016 6.6047 6.6047 6.6605 6.6605 6.9046 6.9046 6.9913 6.9913 7.3626 7.3626 7.4485 7.4485 7.6524 7.6524 7.9576 7.9576 8.6671 8.6671 8.9401 8.9401 12.3137 12.3137 13.7743 13.7743 14.5543 14.5543 16.7852 16.7852 k = 0.4091 0.2362 0.5010 ( 4434 PWs) bands (ev): -88.8640 -88.8640 -88.8553 -88.8553 -88.8440 -88.8440 -88.8440 -88.8440 3.1826 3.1826 3.2040 3.2040 4.6047 4.6047 5.9144 5.9144 6.1113 6.1113 6.6173 6.6173 6.6742 6.6742 6.8935 6.8935 6.9869 6.9869 7.3777 7.3777 7.4450 7.4450 7.6575 7.6575 7.9177 7.9177 8.6069 8.6069 8.9582 8.9582 12.2307 12.2307 13.8659 13.8659 14.5745 14.5745 16.7859 16.7859 k = 0.4053 0.2340 0.5134 ( 4436 PWs) bands (ev): -88.8637 -88.8637 -88.8556 -88.8556 -88.8440 -88.8440 -88.8440 -88.8440 3.2214 3.2214 3.2643 3.2643 4.5162 4.5162 5.8753 5.8753 6.1223 6.1223 6.6300 6.6300 6.6879 6.6879 6.8823 6.8823 6.9825 6.9825 7.3914 7.3914 7.4426 7.4426 7.6625 7.6625 7.8822 7.8822 8.5471 8.5471 8.9762 8.9762 12.1428 12.1428 13.9573 13.9573 14.6030 14.6030 16.7891 16.7891 k = 0.4015 0.2318 0.5258 ( 4439 PWs) bands (ev): -88.8635 -88.8635 -88.8558 -88.8558 -88.8440 -88.8440 -88.8440 -88.8440 3.2609 3.2609 3.3267 3.3267 4.4260 4.4260 5.8370 5.8370 6.1338 6.1338 6.6426 6.6426 6.7016 6.7016 6.8711 6.8711 6.9781 6.9781 7.4033 7.4033 7.4414 7.4414 7.6672 7.6672 7.8512 7.8512 8.4879 8.4879 8.9938 8.9938 12.0512 12.0512 14.0481 14.0481 14.6389 14.6389 16.7953 16.7953 k = 0.3977 0.2296 0.5381 ( 4437 PWs) bands (ev): -88.8632 -88.8632 -88.8561 -88.8561 -88.8440 -88.8440 -88.8440 -88.8440 3.3015 3.3015 3.3907 3.3907 4.3347 4.3347 5.8001 5.8001 6.1455 6.1455 6.6549 6.6549 6.7152 6.7152 6.8598 6.8598 6.9737 6.9737 7.4132 7.4132 7.4420 7.4420 7.6717 7.6717 7.8248 7.8248 8.4297 8.4297 9.0107 9.0107 11.9567 11.9567 14.1380 14.1380 14.6811 14.6811 16.8045 16.8045 k = 0.3939 0.2274 0.5505 ( 4439 PWs) bands (ev): -88.8630 -88.8630 -88.8563 -88.8563 -88.8440 -88.8440 -88.8440 -88.8440 3.3431 3.3431 3.4555 3.4555 4.2428 4.2428 5.7649 5.7649 6.1574 6.1574 6.6665 6.6665 6.7289 6.7289 6.8486 6.8486 6.9693 6.9693 7.4210 7.4210 7.4447 7.4447 7.6756 7.6756 7.8028 7.8028 8.3726 8.3726 9.0266 9.0266 11.8604 11.8604 14.2266 14.2266 14.7288 14.7288 16.8171 16.8171 k = 0.3902 0.2253 0.5629 ( 4429 PWs) bands (ev): -88.8627 -88.8627 -88.8566 -88.8566 -88.8440 -88.8440 -88.8440 -88.8440 3.3855 3.3855 3.5202 3.5202 4.1515 4.1515 5.7317 5.7317 6.1694 6.1694 6.6771 6.6771 6.7426 6.7426 6.8376 6.8376 6.9649 6.9649 7.4267 7.4267 7.4496 7.4496 7.6789 7.6789 7.7852 7.7852 8.3171 8.3171 9.0415 9.0415 11.7630 11.7630 14.3137 14.3137 14.7811 14.7811 16.8333 16.8333 k = 0.3864 0.2231 0.5753 ( 4423 PWs) bands (ev): -88.8625 -88.8625 -88.8568 -88.8568 -88.8440 -88.8440 -88.8440 -88.8440 3.4285 3.4285 3.5827 3.5827 4.0634 4.0634 5.7007 5.7007 6.1812 6.1812 6.6865 6.6865 6.7560 6.7560 6.8270 6.8270 6.9607 6.9607 7.4316 7.4316 7.4559 7.4559 7.6811 7.6811 7.7716 7.7716 8.2635 8.2635 9.0551 9.0551 11.6652 11.6652 14.3989 14.3989 14.8371 14.8371 16.8531 16.8531 k = 0.3826 0.2209 0.5876 ( 4423 PWs) bands (ev): -88.8623 -88.8623 -88.8570 -88.8570 -88.8440 -88.8440 -88.8440 -88.8440 3.4714 3.4714 3.6377 3.6377 3.9845 3.9845 5.6721 5.6721 6.1930 6.1930 6.6943 6.6943 6.7687 6.7687 6.8172 6.8172 6.9568 6.9568 7.4364 7.4364 7.4628 7.4628 7.6822 7.6822 7.7618 7.7618 8.2124 8.2124 9.0673 9.0673 11.5676 11.5676 14.4819 14.4819 14.8963 14.8963 16.8768 16.8768 k = 0.3788 0.2187 0.6000 ( 4424 PWs) bands (ev): -88.8621 -88.8621 -88.8572 -88.8572 -88.8440 -88.8440 -88.8440 -88.8440 3.5124 3.5124 3.6706 3.6706 3.9312 3.9312 5.6460 5.6460 6.2046 6.2046 6.7003 6.7003 6.7790 6.7790 6.8097 6.8097 6.9536 6.9536 7.4417 7.4417 7.4702 7.4702 7.6820 7.6820 7.7550 7.7550 8.1645 8.1645 9.0780 9.0780 11.4708 11.4708 14.5623 14.5623 14.9580 14.9580 16.9044 16.9044 k = 0.3750 0.2165 0.6124 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.6250-0.0722 0.4082 ( 4420 PWs) bands (ev): -88.8619 -88.8619 -88.8573 -88.8573 -88.8440 -88.8440 -88.8440 -88.8440 3.5432 3.5432 3.6643 3.6643 3.9289 3.9289 5.6227 5.6227 6.2159 6.2159 6.7045 6.7045 6.7819 6.7819 6.8090 6.8090 6.9514 6.9514 7.4473 7.4473 7.4785 7.4785 7.6801 7.6801 7.7504 7.7504 8.1207 8.1207 9.0872 9.0872 11.3751 11.3751 14.6398 14.6398 15.0215 15.0215 16.9359 16.9359 k = 0.6184-0.0836 0.4082 ( 4420 PWs) bands (ev): -88.8617 -88.8617 -88.8576 -88.8576 -88.8440 -88.8440 -88.8440 -88.8440 3.5608 3.5608 3.6312 3.6312 3.9859 3.9859 5.5853 5.5853 6.2358 6.2358 6.7087 6.7087 6.7783 6.7783 6.8161 6.8161 6.9504 6.9504 7.4567 7.4567 7.4940 7.4940 7.6753 7.6753 7.7444 7.7444 8.0498 8.0498 9.1010 9.1010 11.2106 11.2106 14.7726 14.7726 15.1349 15.1349 16.9935 16.9935 k = 0.6118-0.0950 0.4082 ( 4416 PWs) bands (ev): -88.8615 -88.8615 -88.8578 -88.8578 -88.8440 -88.8440 -88.8440 -88.8440 3.5587 3.5587 3.5997 3.5997 4.0637 4.0637 5.5491 5.5491 6.2563 6.2563 6.7094 6.7094 6.7757 6.7757 6.8240 6.8240 6.9524 6.9524 7.4658 7.4658 7.5093 7.5093 7.6706 7.6706 7.7389 7.7389 7.9809 7.9809 9.1138 9.1138 11.0475 11.0475 14.9072 14.9072 15.2516 15.2516 17.0501 17.0501 k = 0.6053-0.1064 0.4082 ( 4408 PWs) bands (ev): -88.8613 -88.8613 -88.8580 -88.8580 -88.8440 -88.8440 -88.8440 -88.8440 3.5457 3.5457 3.5698 3.5698 4.1533 4.1533 5.5145 5.5145 6.2773 6.2773 6.7054 6.7054 6.7760 6.7760 6.8329 6.8329 6.9567 6.9567 7.4748 7.4748 7.5236 7.5236 7.6658 7.6658 7.7338 7.7338 7.9144 7.9144 9.1253 9.1253 10.8861 10.8861 15.0435 15.0435 15.3715 15.3715 17.1054 17.1054 k = 0.5987-0.1177 0.4082 ( 4400 PWs) bands (ev): -88.8611 -88.8611 -88.8582 -88.8582 -88.8440 -88.8440 -88.8440 -88.8440 3.5274 3.5274 3.5417 3.5417 4.2487 4.2487 5.4816 5.4816 6.2988 6.2988 6.6970 6.6970 6.7796 6.7796 6.8428 6.8428 6.9626 6.9626 7.4837 7.4837 7.5366 7.5366 7.6607 7.6607 7.7291 7.7291 7.8508 7.8508 9.1359 9.1359 10.7271 10.7271 15.1813 15.1813 15.4944 15.4944 17.1593 17.1593 k = 0.5921-0.1291 0.4082 ( 4412 PWs) bands (ev): -88.8609 -88.8609 -88.8584 -88.8584 -88.8440 -88.8440 -88.8440 -88.8440 3.5068 3.5068 3.5152 3.5152 4.3464 4.3464 5.4503 5.4503 6.3206 6.3206 6.6855 6.6855 6.7856 6.7856 6.8540 6.8540 6.9698 6.9698 7.4926 7.4926 7.5480 7.5480 7.6541 7.6541 7.7246 7.7246 7.7915 7.7915 9.1454 9.1454 10.5710 10.5710 15.3206 15.3206 15.6200 15.6200 17.2115 17.2115 k = 0.5855-0.1405 0.4082 ( 4412 PWs) bands (ev): -88.8607 -88.8607 -88.8585 -88.8585 -88.8440 -88.8440 -88.8440 -88.8440 3.4856 3.4856 3.4904 3.4904 4.4443 4.4443 5.4209 5.4209 6.3427 6.3427 6.6721 6.6721 6.7933 6.7933 6.8664 6.8664 6.9780 6.9780 7.5013 7.5013 7.5576 7.5576 7.6424 7.6424 7.7188 7.7188 7.7418 7.7418 9.1539 9.1539 10.4185 10.4185 15.4612 15.4612 15.7482 15.7482 17.2617 17.2617 k = 0.5789-0.1519 0.4082 ( 4404 PWs) bands (ev): -88.8606 -88.8606 -88.8587 -88.8587 -88.8440 -88.8440 -88.8440 -88.8440 3.4647 3.4647 3.4675 3.4675 4.5408 4.5408 5.3934 5.3934 6.3648 6.3648 6.6578 6.6578 6.8020 6.8020 6.8801 6.8801 6.9870 6.9870 7.5096 7.5096 7.5653 7.5653 7.6165 7.6165 7.7012 7.7012 7.7215 7.7215 9.1616 9.1616 10.2701 10.2701 15.6031 15.6031 15.8785 15.8785 17.3098 17.3098 k = 0.5724-0.1633 0.4082 ( 4412 PWs) bands (ev): -88.8604 -88.8604 -88.8588 -88.8588 -88.8440 -88.8440 -88.8440 -88.8440 3.4445 3.4445 3.4463 3.4463 4.6349 4.6349 5.3679 5.3679 6.3867 6.3867 6.6432 6.6432 6.8116 6.8116 6.8948 6.8948 6.9968 6.9968 7.5175 7.5175 7.5691 7.5691 7.5754 7.5754 7.6881 7.6881 7.7171 7.7171 9.1684 9.1684 10.1267 10.1267 15.7460 15.7460 16.0105 16.0105 17.3554 17.3554 k = 0.5658-0.1747 0.4082 ( 4408 PWs) bands (ev): -88.8603 -88.8603 -88.8590 -88.8590 -88.8440 -88.8440 -88.8440 -88.8440 3.4255 3.4255 3.4270 3.4270 4.7254 4.7254 5.3445 5.3445 6.4083 6.4083 6.6287 6.6287 6.8220 6.8220 6.9102 6.9102 7.0074 7.0074 7.5223 7.5223 7.5254 7.5254 7.5752 7.5752 7.6841 7.6841 7.7142 7.7142 9.1744 9.1744 9.9891 9.9891 15.8899 15.8899 16.1439 16.1439 17.3982 17.3982 k = 0.5592-0.1861 0.4082 ( 4408 PWs) bands (ev): -88.8602 -88.8602 -88.8591 -88.8591 -88.8440 -88.8440 -88.8440 -88.8440 3.4080 3.4080 3.4094 3.4094 4.8114 4.8114 5.3231 5.3231 6.4293 6.4293 6.6146 6.6146 6.8334 6.8334 6.9258 6.9258 7.0191 7.0191 7.4712 7.4712 7.5316 7.5316 7.5772 7.5772 7.6842 7.6842 7.7119 7.7119 9.1797 9.1797 9.8582 9.8582 16.0345 16.0345 16.2778 16.2778 17.4381 17.4381 k = 0.5526-0.1975 0.4082 ( 4408 PWs) bands (ev): -88.8601 -88.8601 -88.8592 -88.8592 -88.8440 -88.8440 -88.8440 -88.8440 3.3922 3.3922 3.3935 3.3935 4.8919 4.8919 5.3039 5.3039 6.4492 6.4492 6.6011 6.6011 6.8459 6.8459 6.9409 6.9409 7.0321 7.0321 7.4203 7.4203 7.5376 7.5376 7.5780 7.5780 7.6860 7.6860 7.7100 7.7100 9.1842 9.1842 9.7351 9.7351 16.1796 16.1796 16.4116 16.4116 17.4746 17.4746 k = 0.5461-0.2089 0.4082 ( 4404 PWs) bands (ev): -88.8600 -88.8600 -88.8593 -88.8593 -88.8440 -88.8440 -88.8440 -88.8440 3.3782 3.3782 3.3794 3.3794 4.9660 4.9660 5.2869 5.2869 6.4680 6.4680 6.5884 6.5884 6.8599 6.8599 6.9548 6.9548 7.0468 7.0468 7.3710 7.3710 7.5429 7.5429 7.5777 7.5777 7.6887 7.6887 7.7085 7.7085 9.1882 9.1882 9.6211 9.6211 16.3248 16.3248 16.5439 16.5439 17.5076 17.5076 k = 0.5395-0.2203 0.4082 ( 4406 PWs) bands (ev): -88.8599 -88.8599 -88.8594 -88.8594 -88.8440 -88.8440 -88.8440 -88.8440 3.3660 3.3660 3.3670 3.3670 5.0327 5.0327 5.2721 5.2721 6.4850 6.4850 6.5767 6.5767 6.8754 6.8754 6.9666 6.9666 7.0630 7.0630 7.3238 7.3238 7.5474 7.5474 7.5766 7.5766 7.6917 7.6917 7.7073 7.7073 9.1915 9.1915 9.5174 9.5174 16.4696 16.4696 16.6732 16.6732 17.5368 17.5368 k = 0.5329-0.2317 0.4082 ( 4406 PWs) bands (ev): -88.8598 -88.8598 -88.8595 -88.8595 -88.8440 -88.8440 -88.8440 -88.8440 3.3557 3.3557 3.3565 3.3565 5.0910 5.0910 5.2595 5.2595 6.5001 6.5001 6.5664 6.5664 6.8924 6.8924 6.9762 6.9762 7.0802 7.0802 7.2794 7.2794 7.5512 7.5512 7.5749 7.5749 7.6947 7.6947 7.7064 7.7064 9.1942 9.1942 9.4257 9.4257 16.6135 16.6135 16.7972 16.7972 17.5620 17.5620 k = 0.5263-0.2431 0.4082 ( 4418 PWs) bands (ev): -88.8597 -88.8597 -88.8595 -88.8595 -88.8440 -88.8440 -88.8440 -88.8440 3.3472 3.3472 3.3478 3.3478 5.1401 5.1401 5.2492 5.2492 6.5129 6.5129 6.5574 6.5574 6.9110 6.9110 6.9833 6.9833 7.0972 7.0972 7.2382 7.2382 7.5543 7.5543 7.5728 7.5728 7.6974 7.6974 7.7057 7.7057 9.1964 9.1964 9.3476 9.3476 16.7552 16.7552 16.9125 16.9125 17.5829 17.5829 k = 0.5197-0.2545 0.4082 ( 4418 PWs) bands (ev): -88.8597 -88.8597 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3406 3.3406 3.3410 3.3410 5.1792 5.1792 5.2411 5.2411 6.5231 6.5231 6.5502 6.5502 6.9305 6.9305 6.9880 6.9880 7.1126 7.1126 7.2014 7.2014 7.5570 7.5570 7.5704 7.5704 7.6996 7.6996 7.7052 7.7052 9.1981 9.1981 9.2846 9.2846 16.8925 16.8925 17.0142 17.0142 17.5993 17.5993 k = 0.5132-0.2659 0.4082 ( 4426 PWs) bands (ev): -88.8597 -88.8597 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3359 3.3359 3.3361 3.3361 5.2077 5.2077 5.2354 5.2354 6.5307 6.5307 6.5447 6.5447 6.9500 6.9500 6.9898 6.9898 7.1251 7.1251 7.1707 7.1707 7.5593 7.5593 7.5681 7.5681 7.7014 7.7014 7.7047 7.7047 9.1993 9.1993 9.2383 9.2383 17.0201 17.0201 17.0960 17.0960 17.6112 17.6112 k = 0.5066-0.2773 0.4082 ( 4442 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3331 3.3331 3.3332 3.3332 5.2250 5.2250 5.2319 5.2319 6.5356 6.5356 6.5411 6.5411 6.9675 6.9675 6.9878 6.9878 7.1335 7.1335 7.1491 7.1491 7.5614 7.5614 7.5657 7.5657 7.7027 7.7027 7.7042 7.7042 9.2000 9.2000 9.2099 9.2099 17.1239 17.1239 17.1499 17.1499 17.6183 17.6183 k = 0.5000-0.2887 0.4082 ( 4432 PWs) bands (ev): -88.8596 -88.8596 -88.8596 -88.8596 -88.8440 -88.8440 -88.8440 -88.8440 3.3322 3.3322 3.3322 3.3322 5.2308 5.2308 5.2308 5.2308 6.5386 6.5386 6.5386 6.5386 6.9806 6.9806 6.9806 6.9806 7.1388 7.1388 7.1388 7.1388 7.5635 7.5635 7.5635 7.5635 7.7036 7.7036 7.7036 7.7036 9.2003 9.2003 9.2003 9.2003 17.1688 17.1688 17.1688 17.1688 17.6208 17.6208 Writing output data file Be2Cu.save init_run : 0.35s CPU 0.52s WALL ( 1 calls) electrons : 159.96s CPU 162.23s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 159.95s CPU 162.22s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 353 calls) cegterg : 142.13s CPU 143.79s WALL ( 472 calls) Called by sum_band: Called by *egterg: h_psi : 96.02s CPU 97.66s WALL ( 7703 calls) s_psi : 3.70s CPU 3.76s WALL ( 7703 calls) g_psi : 0.26s CPU 0.23s WALL ( 6878 calls) cdiaghg : 43.18s CPU 43.75s WALL ( 7231 calls) cegterg:over : 4.93s CPU 5.02s WALL ( 6878 calls) cegterg:upda : 4.94s CPU 4.76s WALL ( 6878 calls) cegterg:last : 2.07s CPU 2.11s WALL ( 1178 calls) cdiaghg:chol : 2.52s CPU 2.49s WALL ( 7231 calls) cdiaghg:inve : 1.46s CPU 1.62s WALL ( 7231 calls) cdiaghg:para : 2.36s CPU 2.44s WALL ( 14462 calls) Called by h_psi: h_psi:vloc : 86.34s CPU 87.85s WALL ( 7703 calls) h_psi:vnl : 9.46s CPU 9.60s WALL ( 7703 calls) add_vuspsi : 4.62s CPU 4.52s WALL ( 7703 calls) General routines calbec : 4.82s CPU 5.06s WALL ( 7703 calls) fft : 0.01s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 77.79s CPU 78.77s WALL ( 735664 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.22s WALL ( 706 calls) Parallel routines fft_scatter : 25.54s CPU 25.90s WALL ( 735687 calls) PWSCF : 2m56.24s CPU 3m11.08s WALL This run was terminated on: 14:26:48 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=