Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:53: 5 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: ./Hf2Cd.save/ file Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D 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 138 41 12 3248 530 90 Max 139 42 13 3250 548 92 Sum 5001 1499 457 116967 19341 3275 bravais-lattice index = 14 lattice parameter (alat) = 12.0454 a.u. unit-cell volume = 428.6259 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 2 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 639.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.045436 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.868411 celldm(5)= -0.868411 celldm(6)= 0.736823 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.736823 0.676086 0.000000 ) a(3) = ( -0.868411 -0.338043 0.362751 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.089836 1.378354 ) b(2) = ( 0.000000 1.479102 1.378354 ) b(3) = ( 0.000000 0.000000 2.756709 ) PseudoPot. # 1 for Hf read from file: /users/gautes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1271 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Cd read from file: /users/gautes/Pseudo/Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1d41bce1441572f114805845d9d822b0 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1239 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 Hf 12.00 178.49000 Hf( 1.00) Cd 12.00 112.41100 Cd( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 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 C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 409 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 2) = ( 0.0000000 0.0000000 0.0202699), wk = 0.0024450 k( 3) = ( 0.0000000 0.0000000 0.0405398), wk = 0.0024450 k( 4) = ( 0.0000000 0.0000000 0.0608097), wk = 0.0024450 k( 5) = ( 0.0000000 0.0000000 0.0810797), wk = 0.0024450 k( 6) = ( 0.0000000 0.0000000 0.1013496), wk = 0.0024450 k( 7) = ( 0.0000000 0.0000000 0.1216195), wk = 0.0024450 k( 8) = ( 0.0000000 0.0000000 0.1418894), wk = 0.0024450 k( 9) = ( 0.0000000 0.0000000 0.1621594), wk = 0.0024450 k( 10) = ( 0.0000000 0.0000000 0.1824293), wk = 0.0024450 k( 11) = ( 0.0000000 0.0000000 0.2026992), wk = 0.0024450 k( 12) = ( 0.0000000 0.0000000 0.2229691), wk = 0.0024450 k( 13) = ( 0.0000000 0.0000000 0.2432390), wk = 0.0024450 k( 14) = ( 0.0000000 0.0000000 0.2635090), wk = 0.0024450 k( 15) = ( 0.0000000 0.0000000 0.2837789), wk = 0.0024450 k( 16) = ( 0.0000000 0.0000000 0.3040488), wk = 0.0024450 k( 17) = ( 0.0000000 0.0000000 0.3243187), wk = 0.0024450 k( 18) = ( 0.0000000 0.0000000 0.3445886), wk = 0.0024450 k( 19) = ( 0.0000000 0.0000000 0.3648585), wk = 0.0024450 k( 20) = ( 0.0000000 0.0000000 0.3851285), wk = 0.0024450 k( 21) = ( 0.0000000 0.0000000 0.4053984), wk = 0.0024450 k( 22) = ( 0.0000000 0.0000000 0.4256683), wk = 0.0024450 k( 23) = ( 0.0000000 0.0000000 0.4459382), wk = 0.0024450 k( 24) = ( 0.0000000 0.0000000 0.4662081), wk = 0.0024450 k( 25) = ( 0.0000000 0.0000000 0.4864781), wk = 0.0024450 k( 26) = ( 0.0000000 0.0000000 0.5067480), wk = 0.0024450 k( 27) = ( 0.0000000 0.0000000 0.5270179), wk = 0.0024450 k( 28) = ( 0.0000000 0.0000000 0.5472878), wk = 0.0024450 k( 29) = ( 0.0000000 0.0000000 0.5675577), wk = 0.0024450 k( 30) = ( 0.0000000 0.0000000 0.5878276), wk = 0.0024450 k( 31) = ( 0.0000000 0.0000000 0.6080976), wk = 0.0024450 k( 32) = ( 0.0000000 0.0000000 0.6283675), wk = 0.0024450 k( 33) = ( 0.0000000 0.0000000 0.6486374), wk = 0.0024450 k( 34) = ( 0.0000000 0.0000000 0.6689073), wk = 0.0024450 k( 35) = ( 0.0000000 0.0000000 0.6891772), wk = 0.0024450 k( 36) = ( 0.0000000 0.0000000 0.7094472), wk = 0.0024450 k( 37) = ( 0.0000000 0.0000000 0.7297171), wk = 0.0024450 k( 38) = ( 0.0000000 0.0000000 0.7499870), wk = 0.0024450 k( 39) = ( 0.0000000 0.0000000 0.7702569), wk = 0.0024450 k( 40) = ( 0.0000000 0.0000000 0.7905269), wk = 0.0024450 k( 41) = ( 0.0000000 0.0000000 0.8107968), wk = 0.0024450 k( 42) = ( 0.0000000 0.0000000 0.8310667), wk = 0.0024450 k( 43) = ( 0.0000000 0.0000000 0.8513366), wk = 0.0024450 k( 44) = ( 0.0000000 0.0000000 0.8716065), wk = 0.0024450 k( 45) = ( 0.0000000 0.0000000 0.8918764), wk = 0.0024450 k( 46) = ( 0.0000000 0.0000000 0.9121464), wk = 0.0024450 k( 47) = ( 0.0000000 0.0000000 0.9324163), wk = 0.0024450 k( 48) = ( 0.0000000 0.0000000 0.9526862), wk = 0.0024450 k( 49) = ( 0.0000000 0.0000000 0.9729561), wk = 0.0024450 k( 50) = ( 0.0000000 0.0000000 0.9932260), wk = 0.0024450 k( 51) = ( 0.0000000 0.0000000 1.0134960), wk = 0.0024450 k( 52) = ( 0.0000000 0.0000000 1.0337659), wk = 0.0024450 k( 53) = ( 0.0000000 0.0000000 1.0540358), wk = 0.0024450 k( 54) = ( 0.0000000 0.0000000 1.0743057), wk = 0.0024450 k( 55) = ( 0.0000000 0.0000000 1.0945756), wk = 0.0024450 k( 56) = ( 0.0000000 0.0000000 1.1148455), wk = 0.0024450 k( 57) = ( 0.0000000 0.0000000 1.1351155), wk = 0.0024450 k( 58) = ( 0.0000000 0.0000000 1.1553854), wk = 0.0024450 k( 59) = ( 0.0000000 0.0000000 1.1756553), wk = 0.0024450 k( 60) = ( 0.0000000 0.0000000 1.1959252), wk = 0.0024450 k( 61) = ( 0.0000000 0.0000000 1.2161951), wk = 0.0024450 k( 62) = ( 0.0000000 0.0000000 1.2364651), wk = 0.0024450 k( 63) = ( 0.0000000 0.0000000 1.2567350), wk = 0.0024450 k( 64) = ( 0.0000000 0.0000000 1.2770049), wk = 0.0024450 k( 65) = ( 0.0000000 0.0000000 1.2972748), wk = 0.0024450 k( 66) = ( 0.0000000 0.0000000 1.3175448), wk = 0.0024450 k( 67) = ( 0.0000000 0.0000000 1.3378147), wk = 0.0024450 k( 68) = ( 0.0000000 0.0000000 1.3580846), wk = 0.0024450 k( 69) = ( 0.0000000 0.0000000 1.3783545), wk = 0.0024450 k( 70) = ( 0.0000000 0.0000000 1.3783545), wk = 0.0024450 k( 71) = ( -0.0063137 0.0162194 1.3783545), wk = 0.0024450 k( 72) = ( -0.0126273 0.0324388 1.3783545), wk = 0.0024450 k( 73) = ( -0.0189410 0.0486582 1.3783545), wk = 0.0024450 k( 74) = ( -0.0252547 0.0648776 1.3783545), wk = 0.0024450 k( 75) = ( -0.0315683 0.0810970 1.3783545), wk = 0.0024450 k( 76) = ( -0.0378820 0.0973165 1.3783545), wk = 0.0024450 k( 77) = ( -0.0378820 0.0973165 1.3783545), wk = 0.0024450 k( 78) = ( -0.0430166 0.1105070 1.3641998), wk = 0.0024450 k( 79) = ( -0.0481513 0.1236976 1.3500451), wk = 0.0024450 k( 80) = ( -0.0532859 0.1368882 1.3358903), wk = 0.0024450 k( 81) = ( -0.0584206 0.1500788 1.3217356), wk = 0.0024450 k( 82) = ( -0.0635552 0.1632694 1.3075809), wk = 0.0024450 k( 83) = ( -0.0686898 0.1764600 1.2934262), wk = 0.0024450 k( 84) = ( -0.0738245 0.1896506 1.2792715), wk = 0.0024450 k( 85) = ( -0.0789591 0.2028411 1.2651167), wk = 0.0024450 k( 86) = ( -0.0840938 0.2160317 1.2509620), wk = 0.0024450 k( 87) = ( -0.0892284 0.2292223 1.2368073), wk = 0.0024450 k( 88) = ( -0.0943631 0.2424129 1.2226526), wk = 0.0024450 k( 89) = ( -0.0994977 0.2556035 1.2084978), wk = 0.0024450 k( 90) = ( -0.1046324 0.2687941 1.1943431), wk = 0.0024450 k( 91) = ( -0.1097670 0.2819847 1.1801884), wk = 0.0024450 k( 92) = ( -0.1149016 0.2951753 1.1660337), wk = 0.0024450 k( 93) = ( -0.1200363 0.3083658 1.1518789), wk = 0.0024450 k( 94) = ( -0.1251709 0.3215564 1.1377242), wk = 0.0024450 k( 95) = ( -0.1303056 0.3347470 1.1235695), wk = 0.0024450 k( 96) = ( -0.1354402 0.3479376 1.1094148), wk = 0.0024450 k( 97) = ( -0.1405749 0.3611282 1.0952601), wk = 0.0024450 k( 98) = ( -0.1457095 0.3743188 1.0811053), wk = 0.0024450 k( 99) = ( -0.1508442 0.3875094 1.0669506), wk = 0.0024450 k( 100) = ( -0.1559788 0.4006999 1.0527959), wk = 0.0024450 k( 101) = ( -0.1611134 0.4138905 1.0386412), wk = 0.0024450 k( 102) = ( -0.1662481 0.4270811 1.0244865), wk = 0.0024450 k( 103) = ( -0.1713827 0.4402717 1.0103318), wk = 0.0024450 k( 104) = ( -0.1765174 0.4534623 0.9961770), wk = 0.0024450 k( 105) = ( -0.1816520 0.4666529 0.9820223), wk = 0.0024450 k( 106) = ( -0.1867867 0.4798434 0.9678676), wk = 0.0024450 k( 107) = ( -0.1919213 0.4930340 0.9537129), wk = 0.0024450 k( 108) = ( -0.1970560 0.5062246 0.9395581), wk = 0.0024450 k( 109) = ( -0.2021906 0.5194152 0.9254034), wk = 0.0024450 k( 110) = ( -0.2073252 0.5326058 0.9112487), wk = 0.0024450 k( 111) = ( -0.2124599 0.5457964 0.8970940), wk = 0.0024450 k( 112) = ( -0.2175945 0.5589870 0.8829393), wk = 0.0024450 k( 113) = ( -0.2227292 0.5721776 0.8687845), wk = 0.0024450 k( 114) = ( -0.2278638 0.5853681 0.8546298), wk = 0.0024450 k( 115) = ( -0.2329985 0.5985587 0.8404751), wk = 0.0024450 k( 116) = ( -0.2381331 0.6117493 0.8263204), wk = 0.0024450 k( 117) = ( -0.2432678 0.6249399 0.8121656), wk = 0.0024450 k( 118) = ( -0.2484024 0.6381305 0.7980109), wk = 0.0024450 k( 119) = ( -0.2535370 0.6513211 0.7838562), wk = 0.0024450 k( 120) = ( -0.2586717 0.6645117 0.7697015), wk = 0.0024450 k( 121) = ( -0.2638063 0.6777022 0.7555468), wk = 0.0024450 k( 122) = ( -0.2689410 0.6908928 0.7413920), wk = 0.0024450 k( 123) = ( -0.2689410 0.6908928 0.7413920), wk = 0.0024450 k( 124) = ( -0.2637691 0.6776064 0.7271345), wk = 0.0024450 k( 125) = ( -0.2585971 0.6643200 0.7128770), wk = 0.0024450 k( 126) = ( -0.2534252 0.6510336 0.6986194), wk = 0.0024450 k( 127) = ( -0.2482532 0.6377472 0.6843619), wk = 0.0024450 k( 128) = ( -0.2430813 0.6244608 0.6701044), wk = 0.0024450 k( 129) = ( -0.2379093 0.6111744 0.6558468), wk = 0.0024450 k( 130) = ( -0.2327374 0.5978880 0.6415893), wk = 0.0024450 k( 131) = ( -0.2275655 0.5846016 0.6273317), wk = 0.0024450 k( 132) = ( -0.2223935 0.5713152 0.6130742), wk = 0.0024450 k( 133) = ( -0.2172216 0.5580288 0.5988167), wk = 0.0024450 k( 134) = ( -0.2120496 0.5447424 0.5845591), wk = 0.0024450 k( 135) = ( -0.2068777 0.5314560 0.5703016), wk = 0.0024450 k( 136) = ( -0.2017057 0.5181696 0.5560440), wk = 0.0024450 k( 137) = ( -0.1965338 0.5048832 0.5417865), wk = 0.0024450 k( 138) = ( -0.1913619 0.4915968 0.5275290), wk = 0.0024450 k( 139) = ( -0.1861899 0.4783104 0.5132714), wk = 0.0024450 k( 140) = ( -0.1810180 0.4650240 0.4990139), wk = 0.0024450 k( 141) = ( -0.1758460 0.4517376 0.4847563), wk = 0.0024450 k( 142) = ( -0.1706741 0.4384512 0.4704988), wk = 0.0024450 k( 143) = ( -0.1655021 0.4251648 0.4562413), wk = 0.0024450 k( 144) = ( -0.1603302 0.4118784 0.4419837), wk = 0.0024450 k( 145) = ( -0.1551583 0.3985920 0.4277262), wk = 0.0024450 k( 146) = ( -0.1499863 0.3853056 0.4134686), wk = 0.0024450 k( 147) = ( -0.1448144 0.3720192 0.3992111), wk = 0.0024450 k( 148) = ( -0.1396424 0.3587328 0.3849536), wk = 0.0024450 k( 149) = ( -0.1344705 0.3454464 0.3706960), wk = 0.0024450 k( 150) = ( -0.1292986 0.3321600 0.3564385), wk = 0.0024450 k( 151) = ( -0.1241266 0.3188736 0.3421809), wk = 0.0024450 k( 152) = ( -0.1189547 0.3055872 0.3279234), wk = 0.0024450 k( 153) = ( -0.1137827 0.2923008 0.3136659), wk = 0.0024450 k( 154) = ( -0.1086108 0.2790144 0.2994083), wk = 0.0024450 k( 155) = ( -0.1034388 0.2657280 0.2851508), wk = 0.0024450 k( 156) = ( -0.0982669 0.2524416 0.2708932), wk = 0.0024450 k( 157) = ( -0.0930950 0.2391552 0.2566357), wk = 0.0024450 k( 158) = ( -0.0879230 0.2258688 0.2423782), wk = 0.0024450 k( 159) = ( -0.0827511 0.2125824 0.2281206), wk = 0.0024450 k( 160) = ( -0.0775791 0.1992960 0.2138631), wk = 0.0024450 k( 161) = ( -0.0724072 0.1860096 0.1996056), wk = 0.0024450 k( 162) = ( -0.0672352 0.1727232 0.1853480), wk = 0.0024450 k( 163) = ( -0.0620633 0.1594368 0.1710905), wk = 0.0024450 k( 164) = ( -0.0568914 0.1461504 0.1568329), wk = 0.0024450 k( 165) = ( -0.0517194 0.1328640 0.1425754), wk = 0.0024450 k( 166) = ( -0.0465475 0.1195776 0.1283179), wk = 0.0024450 k( 167) = ( -0.0413755 0.1062912 0.1140603), wk = 0.0024450 k( 168) = ( -0.0362036 0.0930048 0.0998028), wk = 0.0024450 k( 169) = ( -0.0310317 0.0797184 0.0855452), wk = 0.0024450 k( 170) = ( -0.0258597 0.0664320 0.0712877), wk = 0.0024450 k( 171) = ( -0.0206878 0.0531456 0.0570302), wk = 0.0024450 k( 172) = ( -0.0155158 0.0398592 0.0427726), wk = 0.0024450 k( 173) = ( -0.0103439 0.0265728 0.0285151), wk = 0.0024450 k( 174) = ( -0.0051719 0.0132864 0.0142575), wk = 0.0024450 k( 175) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 177) = ( 0.0185185 0.0072086 0.0000000), wk = 0.0024450 k( 178) = ( 0.0370370 0.0144173 0.0000000), wk = 0.0024450 k( 179) = ( 0.0555556 0.0216259 0.0000000), wk = 0.0024450 k( 180) = ( 0.0740741 0.0288345 0.0000000), wk = 0.0024450 k( 181) = ( 0.0925926 0.0360431 0.0000000), wk = 0.0024450 k( 182) = ( 0.1111111 0.0432518 0.0000000), wk = 0.0024450 k( 183) = ( 0.1296296 0.0504604 0.0000000), wk = 0.0024450 k( 184) = ( 0.1481482 0.0576690 0.0000000), wk = 0.0024450 k( 185) = ( 0.1666667 0.0648776 0.0000000), wk = 0.0024450 k( 186) = ( 0.1851852 0.0720863 0.0000000), wk = 0.0024450 k( 187) = ( 0.2037037 0.0792949 0.0000000), wk = 0.0024450 k( 188) = ( 0.2222222 0.0865035 0.0000000), wk = 0.0024450 k( 189) = ( 0.2407407 0.0937121 0.0000000), wk = 0.0024450 k( 190) = ( 0.2592593 0.1009208 0.0000000), wk = 0.0024450 k( 191) = ( 0.2777778 0.1081294 0.0000000), wk = 0.0024450 k( 192) = ( 0.2962963 0.1153380 0.0000000), wk = 0.0024450 k( 193) = ( 0.3148148 0.1225467 0.0000000), wk = 0.0024450 k( 194) = ( 0.3333333 0.1297553 0.0000000), wk = 0.0024450 k( 195) = ( 0.3518519 0.1369639 0.0000000), wk = 0.0024450 k( 196) = ( 0.3703704 0.1441725 0.0000000), wk = 0.0024450 k( 197) = ( 0.3888889 0.1513812 0.0000000), wk = 0.0024450 k( 198) = ( 0.4074074 0.1585898 0.0000000), wk = 0.0024450 k( 199) = ( 0.4259259 0.1657984 0.0000000), wk = 0.0024450 k( 200) = ( 0.4444444 0.1730070 0.0000000), wk = 0.0024450 k( 201) = ( 0.4629630 0.1802157 0.0000000), wk = 0.0024450 k( 202) = ( 0.4814815 0.1874243 0.0000000), wk = 0.0024450 k( 203) = ( 0.5000000 0.1946329 0.0000000), wk = 0.0024450 k( 204) = ( 0.5000000 0.1946329 0.0000000), wk = 0.0024450 k( 205) = ( 0.4948654 0.2078235 0.0141547), wk = 0.0024450 k( 206) = ( 0.4897307 0.2210141 0.0283094), wk = 0.0024450 k( 207) = ( 0.4845961 0.2342047 0.0424642), wk = 0.0024450 k( 208) = ( 0.4794614 0.2473953 0.0566189), wk = 0.0024450 k( 209) = ( 0.4743268 0.2605858 0.0707736), wk = 0.0024450 k( 210) = ( 0.4691921 0.2737764 0.0849283), wk = 0.0024450 k( 211) = ( 0.4640575 0.2869670 0.0990830), wk = 0.0024450 k( 212) = ( 0.4589228 0.3001576 0.1132378), wk = 0.0024450 k( 213) = ( 0.4537882 0.3133482 0.1273925), wk = 0.0024450 k( 214) = ( 0.4486536 0.3265388 0.1415472), wk = 0.0024450 k( 215) = ( 0.4435189 0.3397294 0.1557019), wk = 0.0024450 k( 216) = ( 0.4383843 0.3529200 0.1698567), wk = 0.0024450 k( 217) = ( 0.4332496 0.3661105 0.1840114), wk = 0.0024450 k( 218) = ( 0.4281150 0.3793011 0.1981661), wk = 0.0024450 k( 219) = ( 0.4229803 0.3924917 0.2123208), wk = 0.0024450 k( 220) = ( 0.4178457 0.4056823 0.2264756), wk = 0.0024450 k( 221) = ( 0.4127110 0.4188729 0.2406303), wk = 0.0024450 k( 222) = ( 0.4075764 0.4320635 0.2547850), wk = 0.0024450 k( 223) = ( 0.4024417 0.4452541 0.2689397), wk = 0.0024450 k( 224) = ( 0.3973071 0.4584446 0.2830944), wk = 0.0024450 k( 225) = ( 0.3921725 0.4716352 0.2972491), wk = 0.0024450 k( 226) = ( 0.3870378 0.4848258 0.3114039), wk = 0.0024450 k( 227) = ( 0.3819032 0.4980164 0.3255586), wk = 0.0024450 k( 228) = ( 0.3767685 0.5112070 0.3397133), wk = 0.0024450 k( 229) = ( 0.3716339 0.5243976 0.3538680), wk = 0.0024450 k( 230) = ( 0.3664992 0.5375882 0.3680227), wk = 0.0024450 k( 231) = ( 0.3613646 0.5507788 0.3821775), wk = 0.0024450 k( 232) = ( 0.3562300 0.5639693 0.3963322), wk = 0.0024450 k( 233) = ( 0.3510953 0.5771599 0.4104869), wk = 0.0024450 k( 234) = ( 0.3459607 0.5903505 0.4246416), wk = 0.0024450 k( 235) = ( 0.3408260 0.6035411 0.4387964), wk = 0.0024450 k( 236) = ( 0.3356914 0.6167317 0.4529511), wk = 0.0024450 k( 237) = ( 0.3305567 0.6299223 0.4671058), wk = 0.0024450 k( 238) = ( 0.3254221 0.6431128 0.4812605), wk = 0.0024450 k( 239) = ( 0.3202874 0.6563034 0.4954152), wk = 0.0024450 k( 240) = ( 0.3151528 0.6694940 0.5095700), wk = 0.0024450 k( 241) = ( 0.3100181 0.6826846 0.5237247), wk = 0.0024450 k( 242) = ( 0.3048835 0.6958752 0.5378794), wk = 0.0024450 k( 243) = ( 0.2997489 0.7090658 0.5520341), wk = 0.0024450 k( 244) = ( 0.2946142 0.7222564 0.5661889), wk = 0.0024450 k( 245) = ( 0.2894796 0.7354469 0.5803436), wk = 0.0024450 k( 246) = ( 0.2843449 0.7486375 0.5944983), wk = 0.0024450 k( 247) = ( 0.2792103 0.7618281 0.6086530), wk = 0.0024450 k( 248) = ( 0.2740756 0.7750187 0.6228077), wk = 0.0024450 k( 249) = ( 0.2689410 0.7882093 0.6369625), wk = 0.0024450 k( 250) = ( 0.2689410 0.7882093 0.6369625), wk = 0.0024450 k( 251) = ( 0.2497309 0.7847337 0.6406921), wk = 0.0024450 k( 252) = ( 0.2305208 0.7812581 0.6444217), wk = 0.0024450 k( 253) = ( 0.2113108 0.7777825 0.6481513), wk = 0.0024450 k( 254) = ( 0.1921007 0.7743069 0.6518810), wk = 0.0024450 k( 255) = ( 0.1728906 0.7708314 0.6556106), wk = 0.0024450 k( 256) = ( 0.1536806 0.7673558 0.6593402), wk = 0.0024450 k( 257) = ( 0.1344705 0.7638802 0.6630699), wk = 0.0024450 k( 258) = ( 0.1152604 0.7604046 0.6667995), wk = 0.0024450 k( 259) = ( 0.0960504 0.7569290 0.6705291), wk = 0.0024450 k( 260) = ( 0.0768403 0.7534534 0.6742587), wk = 0.0024450 k( 261) = ( 0.0576302 0.7499778 0.6779884), wk = 0.0024450 k( 262) = ( 0.0384201 0.7465022 0.6817180), wk = 0.0024450 k( 263) = ( 0.0192101 0.7430267 0.6854476), wk = 0.0024450 k( 264) = ( 0.0000000 0.7395511 0.6891772), wk = 0.0024450 k( 265) = ( 0.0000000 0.7395511 0.6891772), wk = 0.0024450 k( 266) = ( 0.0051020 0.7264442 0.7032421), wk = 0.0024450 k( 267) = ( 0.0102041 0.7133374 0.7173069), wk = 0.0024450 k( 268) = ( 0.0153061 0.7002306 0.7313718), wk = 0.0024450 k( 269) = ( 0.0204082 0.6871238 0.7454366), wk = 0.0024450 k( 270) = ( 0.0255102 0.6740169 0.7595014), wk = 0.0024450 k( 271) = ( 0.0306122 0.6609101 0.7735663), wk = 0.0024450 k( 272) = ( 0.0357143 0.6478033 0.7876312), wk = 0.0024450 k( 273) = ( 0.0408163 0.6346964 0.8016960), wk = 0.0024450 k( 274) = ( 0.0459184 0.6215896 0.8157608), wk = 0.0024450 k( 275) = ( 0.0510204 0.6084828 0.8298257), wk = 0.0024450 k( 276) = ( 0.0561224 0.5953759 0.8438905), wk = 0.0024450 k( 277) = ( 0.0612245 0.5822691 0.8579554), wk = 0.0024450 k( 278) = ( 0.0663265 0.5691623 0.8720202), wk = 0.0024450 k( 279) = ( 0.0714286 0.5560555 0.8860850), wk = 0.0024450 k( 280) = ( 0.0765306 0.5429486 0.9001499), wk = 0.0024450 k( 281) = ( 0.0816327 0.5298418 0.9142147), wk = 0.0024450 k( 282) = ( 0.0867347 0.5167350 0.9282795), wk = 0.0024450 k( 283) = ( 0.0918367 0.5036282 0.9423444), wk = 0.0024450 k( 284) = ( 0.0969388 0.4905213 0.9564093), wk = 0.0024450 k( 285) = ( 0.1020408 0.4774145 0.9704741), wk = 0.0024450 k( 286) = ( 0.1071429 0.4643077 0.9845389), wk = 0.0024450 k( 287) = ( 0.1122449 0.4512008 0.9986038), wk = 0.0024450 k( 288) = ( 0.1173469 0.4380940 1.0126686), wk = 0.0024450 k( 289) = ( 0.1224490 0.4249872 1.0267335), wk = 0.0024450 k( 290) = ( 0.1275510 0.4118804 1.0407983), wk = 0.0024450 k( 291) = ( 0.1326531 0.3987735 1.0548631), wk = 0.0024450 k( 292) = ( 0.1377551 0.3856667 1.0689280), wk = 0.0024450 k( 293) = ( 0.1428571 0.3725599 1.0829928), wk = 0.0024450 k( 294) = ( 0.1479592 0.3594530 1.0970577), wk = 0.0024450 k( 295) = ( 0.1530612 0.3463462 1.1111225), wk = 0.0024450 k( 296) = ( 0.1581633 0.3332394 1.1251874), wk = 0.0024450 k( 297) = ( 0.1632653 0.3201325 1.1392522), wk = 0.0024450 k( 298) = ( 0.1683673 0.3070257 1.1533170), wk = 0.0024450 k( 299) = ( 0.1734694 0.2939189 1.1673819), wk = 0.0024450 k( 300) = ( 0.1785714 0.2808121 1.1814467), wk = 0.0024450 k( 301) = ( 0.1836735 0.2677052 1.1955116), wk = 0.0024450 k( 302) = ( 0.1887755 0.2545984 1.2095764), wk = 0.0024450 k( 303) = ( 0.1938776 0.2414916 1.2236412), wk = 0.0024450 k( 304) = ( 0.1989796 0.2283848 1.2377061), wk = 0.0024450 k( 305) = ( 0.2040816 0.2152779 1.2517709), wk = 0.0024450 k( 306) = ( 0.2091837 0.2021711 1.2658358), wk = 0.0024450 k( 307) = ( 0.2142857 0.1890643 1.2799006), wk = 0.0024450 k( 308) = ( 0.2193878 0.1759574 1.2939655), wk = 0.0024450 k( 309) = ( 0.2244898 0.1628506 1.3080303), wk = 0.0024450 k( 310) = ( 0.2295918 0.1497438 1.3220951), wk = 0.0024450 k( 311) = ( 0.2346939 0.1366369 1.3361600), wk = 0.0024450 k( 312) = ( 0.2397959 0.1235301 1.3502248), wk = 0.0024450 k( 313) = ( 0.2448980 0.1104233 1.3642897), wk = 0.0024450 k( 314) = ( 0.2500000 0.0973165 1.3783545), wk = 0.0024450 k( 315) = ( 0.2500000 0.0973165 1.3783545), wk = 0.0024450 k( 316) = ( 0.2666667 0.1038042 1.3713925), wk = 0.0024450 k( 317) = ( 0.2833333 0.1102920 1.3644306), wk = 0.0024450 k( 318) = ( 0.3000000 0.1167798 1.3574686), wk = 0.0024450 k( 319) = ( 0.3166667 0.1232675 1.3505066), wk = 0.0024450 k( 320) = ( 0.3333333 0.1297553 1.3435446), wk = 0.0024450 k( 321) = ( 0.3500000 0.1362430 1.3365827), wk = 0.0024450 k( 322) = ( 0.3666667 0.1427308 1.3296207), wk = 0.0024450 k( 323) = ( 0.3833333 0.1492186 1.3226587), wk = 0.0024450 k( 324) = ( 0.4000000 0.1557063 1.3156967), wk = 0.0024450 k( 325) = ( 0.4166667 0.1621941 1.3087348), wk = 0.0024450 k( 326) = ( 0.4333333 0.1686819 1.3017728), wk = 0.0024450 k( 327) = ( 0.4500000 0.1751696 1.2948108), wk = 0.0024450 k( 328) = ( 0.4666667 0.1816574 1.2878489), wk = 0.0024450 k( 329) = ( 0.4833333 0.1881452 1.2808869), wk = 0.0024450 k( 330) = ( 0.5000000 0.1946329 1.2739249), wk = 0.0024450 k( 331) = ( 0.5000000 0.1946329 1.2739249), wk = 0.0024450 k( 332) = ( 0.5000000 0.1946329 1.2537039), wk = 0.0024450 k( 333) = ( 0.5000000 0.1946329 1.2334829), wk = 0.0024450 k( 334) = ( 0.5000000 0.1946329 1.2132618), wk = 0.0024450 k( 335) = ( 0.5000000 0.1946329 1.1930408), wk = 0.0024450 k( 336) = ( 0.5000000 0.1946329 1.1728198), wk = 0.0024450 k( 337) = ( 0.5000000 0.1946329 1.1525987), wk = 0.0024450 k( 338) = ( 0.5000000 0.1946329 1.1323777), wk = 0.0024450 k( 339) = ( 0.5000000 0.1946329 1.1121567), wk = 0.0024450 k( 340) = ( 0.5000000 0.1946329 1.0919356), wk = 0.0024450 k( 341) = ( 0.5000000 0.1946329 1.0717146), wk = 0.0024450 k( 342) = ( 0.5000000 0.1946329 1.0514936), wk = 0.0024450 k( 343) = ( 0.5000000 0.1946329 1.0312725), wk = 0.0024450 k( 344) = ( 0.5000000 0.1946329 1.0110515), wk = 0.0024450 k( 345) = ( 0.5000000 0.1946329 0.9908305), wk = 0.0024450 k( 346) = ( 0.5000000 0.1946329 0.9706095), wk = 0.0024450 k( 347) = ( 0.5000000 0.1946329 0.9503884), wk = 0.0024450 k( 348) = ( 0.5000000 0.1946329 0.9301674), wk = 0.0024450 k( 349) = ( 0.5000000 0.1946329 0.9099464), wk = 0.0024450 k( 350) = ( 0.5000000 0.1946329 0.8897253), wk = 0.0024450 k( 351) = ( 0.5000000 0.1946329 0.8695043), wk = 0.0024450 k( 352) = ( 0.5000000 0.1946329 0.8492833), wk = 0.0024450 k( 353) = ( 0.5000000 0.1946329 0.8290623), wk = 0.0024450 k( 354) = ( 0.5000000 0.1946329 0.8088412), wk = 0.0024450 k( 355) = ( 0.5000000 0.1946329 0.7886202), wk = 0.0024450 k( 356) = ( 0.5000000 0.1946329 0.7683992), wk = 0.0024450 k( 357) = ( 0.5000000 0.1946329 0.7481781), wk = 0.0024450 k( 358) = ( 0.5000000 0.1946329 0.7279571), wk = 0.0024450 k( 359) = ( 0.5000000 0.1946329 0.7077361), wk = 0.0024450 k( 360) = ( 0.5000000 0.1946329 0.6875150), wk = 0.0024450 k( 361) = ( 0.5000000 0.1946329 0.6672940), wk = 0.0024450 k( 362) = ( 0.5000000 0.1946329 0.6470730), wk = 0.0024450 k( 363) = ( 0.5000000 0.1946329 0.6268519), wk = 0.0024450 k( 364) = ( 0.5000000 0.1946329 0.6066309), wk = 0.0024450 k( 365) = ( 0.5000000 0.1946329 0.5864099), wk = 0.0024450 k( 366) = ( 0.5000000 0.1946329 0.5661889), wk = 0.0024450 k( 367) = ( 0.5000000 0.1946329 0.5459678), wk = 0.0024450 k( 368) = ( 0.5000000 0.1946329 0.5257468), wk = 0.0024450 k( 369) = ( 0.5000000 0.1946329 0.5055258), wk = 0.0024450 k( 370) = ( 0.5000000 0.1946329 0.4853047), wk = 0.0024450 k( 371) = ( 0.5000000 0.1946329 0.4650837), wk = 0.0024450 k( 372) = ( 0.5000000 0.1946329 0.4448627), wk = 0.0024450 k( 373) = ( 0.5000000 0.1946329 0.4246416), wk = 0.0024450 k( 374) = ( 0.5000000 0.1946329 0.4044206), wk = 0.0024450 k( 375) = ( 0.5000000 0.1946329 0.3841996), wk = 0.0024450 k( 376) = ( 0.5000000 0.1946329 0.3639785), wk = 0.0024450 k( 377) = ( 0.5000000 0.1946329 0.3437575), wk = 0.0024450 k( 378) = ( 0.5000000 0.1946329 0.3235365), wk = 0.0024450 k( 379) = ( 0.5000000 0.1946329 0.3033155), wk = 0.0024450 k( 380) = ( 0.5000000 0.1946329 0.2830944), wk = 0.0024450 k( 381) = ( 0.5000000 0.1946329 0.2628734), wk = 0.0024450 k( 382) = ( 0.5000000 0.1946329 0.2426524), wk = 0.0024450 k( 383) = ( 0.5000000 0.1946329 0.2224313), wk = 0.0024450 k( 384) = ( 0.5000000 0.1946329 0.2022103), wk = 0.0024450 k( 385) = ( 0.5000000 0.1946329 0.1819893), wk = 0.0024450 k( 386) = ( 0.5000000 0.1946329 0.1617682), wk = 0.0024450 k( 387) = ( 0.5000000 0.1946329 0.1415472), wk = 0.0024450 k( 388) = ( 0.5000000 0.1946329 0.1213262), wk = 0.0024450 k( 389) = ( 0.5000000 0.1946329 0.1011051), wk = 0.0024450 k( 390) = ( 0.5000000 0.1946329 0.0808841), wk = 0.0024450 k( 391) = ( 0.5000000 0.1946329 0.0606631), wk = 0.0024450 k( 392) = ( 0.5000000 0.1946329 0.0404421), wk = 0.0024450 k( 393) = ( 0.5000000 0.1946329 0.0202210), wk = 0.0024450 k( 394) = ( 0.5000000 0.1946329 0.0000000), wk = 0.0024450 k( 395) = ( 0.0000000 0.0000000 1.3783545), wk = 0.0024450 k( 396) = ( 0.0178571 0.0069512 1.3783545), wk = 0.0024450 k( 397) = ( 0.0357143 0.0139024 1.3783545), wk = 0.0024450 k( 398) = ( 0.0535714 0.0208535 1.3783545), wk = 0.0024450 k( 399) = ( 0.0714286 0.0278047 1.3783545), wk = 0.0024450 k( 400) = ( 0.0892857 0.0347559 1.3783545), wk = 0.0024450 k( 401) = ( 0.1071429 0.0417071 1.3783545), wk = 0.0024450 k( 402) = ( 0.1250000 0.0486582 1.3783545), wk = 0.0024450 k( 403) = ( 0.1428571 0.0556094 1.3783545), wk = 0.0024450 k( 404) = ( 0.1607143 0.0625606 1.3783545), wk = 0.0024450 k( 405) = ( 0.1785714 0.0695118 1.3783545), wk = 0.0024450 k( 406) = ( 0.1964286 0.0764629 1.3783545), wk = 0.0024450 k( 407) = ( 0.2142857 0.0834141 1.3783545), wk = 0.0024450 k( 408) = ( 0.2321429 0.0903653 1.3783545), wk = 0.0024450 k( 409) = ( 0.2500000 0.0973165 1.3783545), wk = 0.0024450 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 2) = ( 0.0000000 0.0000000 0.0073529), wk = 0.0024450 k( 3) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0024450 k( 4) = ( 0.0000000 0.0000000 0.0220588), wk = 0.0024450 k( 5) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0024450 k( 6) = ( 0.0000000 0.0000000 0.0367647), wk = 0.0024450 k( 7) = ( 0.0000000 0.0000000 0.0441177), wk = 0.0024450 k( 8) = ( 0.0000000 0.0000000 0.0514706), wk = 0.0024450 k( 9) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0024450 k( 10) = ( 0.0000000 0.0000000 0.0661765), wk = 0.0024450 k( 11) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0024450 k( 12) = ( 0.0000000 0.0000000 0.0808824), wk = 0.0024450 k( 13) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0024450 k( 14) = ( 0.0000000 0.0000000 0.0955882), wk = 0.0024450 k( 15) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0024450 k( 16) = ( 0.0000000 0.0000000 0.1102941), wk = 0.0024450 k( 17) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0024450 k( 18) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0024450 k( 19) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0024450 k( 20) = ( 0.0000000 0.0000000 0.1397059), wk = 0.0024450 k( 21) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0024450 k( 22) = ( 0.0000000 0.0000000 0.1544118), wk = 0.0024450 k( 23) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0024450 k( 24) = ( 0.0000000 0.0000000 0.1691177), wk = 0.0024450 k( 25) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0024450 k( 26) = ( 0.0000000 0.0000000 0.1838235), wk = 0.0024450 k( 27) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0024450 k( 28) = ( 0.0000000 0.0000000 0.1985294), wk = 0.0024450 k( 29) = ( 0.0000000 0.0000000 0.2058824), wk = 0.0024450 k( 30) = ( 0.0000000 0.0000000 0.2132353), wk = 0.0024450 k( 31) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0024450 k( 32) = ( 0.0000000 0.0000000 0.2279412), wk = 0.0024450 k( 33) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0024450 k( 34) = ( 0.0000000 0.0000000 0.2426471), wk = 0.0024450 k( 35) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0024450 k( 36) = ( 0.0000000 0.0000000 0.2573529), wk = 0.0024450 k( 37) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0024450 k( 38) = ( 0.0000000 0.0000000 0.2720588), wk = 0.0024450 k( 39) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0024450 k( 40) = ( 0.0000000 0.0000000 0.2867647), wk = 0.0024450 k( 41) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0024450 k( 42) = ( 0.0000000 0.0000000 0.3014706), wk = 0.0024450 k( 43) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0024450 k( 44) = ( 0.0000000 0.0000000 0.3161765), wk = 0.0024450 k( 45) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0024450 k( 46) = ( 0.0000000 0.0000000 0.3308824), wk = 0.0024450 k( 47) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0024450 k( 48) = ( 0.0000000 0.0000000 0.3455882), wk = 0.0024450 k( 49) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0024450 k( 50) = ( 0.0000000 0.0000000 0.3602941), wk = 0.0024450 k( 51) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0024450 k( 52) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0024450 k( 53) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0024450 k( 54) = ( 0.0000000 0.0000000 0.3897059), wk = 0.0024450 k( 55) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0024450 k( 56) = ( 0.0000000 0.0000000 0.4044118), wk = 0.0024450 k( 57) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0024450 k( 58) = ( 0.0000000 0.0000000 0.4191177), wk = 0.0024450 k( 59) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0024450 k( 60) = ( 0.0000000 0.0000000 0.4338235), wk = 0.0024450 k( 61) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0024450 k( 62) = ( 0.0000000 0.0000000 0.4485294), wk = 0.0024450 k( 63) = ( 0.0000000 0.0000000 0.4558824), wk = 0.0024450 k( 64) = ( 0.0000000 0.0000000 0.4632353), wk = 0.0024450 k( 65) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0024450 k( 66) = ( 0.0000000 0.0000000 0.4779412), wk = 0.0024450 k( 67) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0024450 k( 68) = ( 0.0000000 0.0000000 0.4926471), wk = 0.0024450 k( 69) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024450 k( 70) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024450 k( 71) = ( -0.0063137 0.0063137 0.5000000), wk = 0.0024450 k( 72) = ( -0.0126273 0.0126273 0.5000000), wk = 0.0024450 k( 73) = ( -0.0189410 0.0189410 0.5000000), wk = 0.0024450 k( 74) = ( -0.0252547 0.0252547 0.5000000), wk = 0.0024450 k( 75) = ( -0.0315683 0.0315683 0.5000000), wk = 0.0024450 k( 76) = ( -0.0378820 0.0378820 0.5000000), wk = 0.0024450 k( 77) = ( -0.0378820 0.0378820 0.5000000), wk = 0.0024450 k( 78) = ( -0.0430166 0.0430166 0.4948654), wk = 0.0024450 k( 79) = ( -0.0481513 0.0481513 0.4897307), wk = 0.0024450 k( 80) = ( -0.0532859 0.0532859 0.4845961), wk = 0.0024450 k( 81) = ( -0.0584206 0.0584206 0.4794614), wk = 0.0024450 k( 82) = ( -0.0635552 0.0635552 0.4743268), wk = 0.0024450 k( 83) = ( -0.0686898 0.0686898 0.4691921), wk = 0.0024450 k( 84) = ( -0.0738245 0.0738245 0.4640575), wk = 0.0024450 k( 85) = ( -0.0789591 0.0789591 0.4589228), wk = 0.0024450 k( 86) = ( -0.0840938 0.0840938 0.4537882), wk = 0.0024450 k( 87) = ( -0.0892284 0.0892284 0.4486536), wk = 0.0024450 k( 88) = ( -0.0943631 0.0943631 0.4435189), wk = 0.0024450 k( 89) = ( -0.0994977 0.0994977 0.4383843), wk = 0.0024450 k( 90) = ( -0.1046324 0.1046324 0.4332496), wk = 0.0024450 k( 91) = ( -0.1097670 0.1097670 0.4281150), wk = 0.0024450 k( 92) = ( -0.1149016 0.1149017 0.4229803), wk = 0.0024450 k( 93) = ( -0.1200363 0.1200363 0.4178457), wk = 0.0024450 k( 94) = ( -0.1251709 0.1251709 0.4127110), wk = 0.0024450 k( 95) = ( -0.1303056 0.1303056 0.4075764), wk = 0.0024450 k( 96) = ( -0.1354402 0.1354402 0.4024417), wk = 0.0024450 k( 97) = ( -0.1405749 0.1405749 0.3973071), wk = 0.0024450 k( 98) = ( -0.1457095 0.1457095 0.3921725), wk = 0.0024450 k( 99) = ( -0.1508442 0.1508442 0.3870378), wk = 0.0024450 k( 100) = ( -0.1559788 0.1559788 0.3819032), wk = 0.0024450 k( 101) = ( -0.1611134 0.1611134 0.3767685), wk = 0.0024450 k( 102) = ( -0.1662481 0.1662481 0.3716339), wk = 0.0024450 k( 103) = ( -0.1713827 0.1713827 0.3664992), wk = 0.0024450 k( 104) = ( -0.1765174 0.1765174 0.3613646), wk = 0.0024450 k( 105) = ( -0.1816520 0.1816520 0.3562300), wk = 0.0024450 k( 106) = ( -0.1867867 0.1867867 0.3510953), wk = 0.0024450 k( 107) = ( -0.1919213 0.1919213 0.3459607), wk = 0.0024450 k( 108) = ( -0.1970560 0.1970560 0.3408260), wk = 0.0024450 k( 109) = ( -0.2021906 0.2021906 0.3356914), wk = 0.0024450 k( 110) = ( -0.2073252 0.2073252 0.3305567), wk = 0.0024450 k( 111) = ( -0.2124599 0.2124599 0.3254221), wk = 0.0024450 k( 112) = ( -0.2175945 0.2175945 0.3202874), wk = 0.0024450 k( 113) = ( -0.2227292 0.2227292 0.3151528), wk = 0.0024450 k( 114) = ( -0.2278638 0.2278638 0.3100181), wk = 0.0024450 k( 115) = ( -0.2329985 0.2329985 0.3048835), wk = 0.0024450 k( 116) = ( -0.2381331 0.2381331 0.2997489), wk = 0.0024450 k( 117) = ( -0.2432678 0.2432678 0.2946142), wk = 0.0024450 k( 118) = ( -0.2484024 0.2484024 0.2894796), wk = 0.0024450 k( 119) = ( -0.2535370 0.2535370 0.2843449), wk = 0.0024450 k( 120) = ( -0.2586717 0.2586717 0.2792103), wk = 0.0024450 k( 121) = ( -0.2638063 0.2638063 0.2740756), wk = 0.0024450 k( 122) = ( -0.2689410 0.2689410 0.2689410), wk = 0.0024450 k( 123) = ( -0.2689410 0.2689410 0.2689410), wk = 0.0024450 k( 124) = ( -0.2637691 0.2637691 0.2637691), wk = 0.0024450 k( 125) = ( -0.2585971 0.2585971 0.2585971), wk = 0.0024450 k( 126) = ( -0.2534252 0.2534252 0.2534252), wk = 0.0024450 k( 127) = ( -0.2482532 0.2482532 0.2482532), wk = 0.0024450 k( 128) = ( -0.2430813 0.2430813 0.2430813), wk = 0.0024450 k( 129) = ( -0.2379093 0.2379093 0.2379093), wk = 0.0024450 k( 130) = ( -0.2327374 0.2327374 0.2327374), wk = 0.0024450 k( 131) = ( -0.2275655 0.2275655 0.2275655), wk = 0.0024450 k( 132) = ( -0.2223935 0.2223935 0.2223935), wk = 0.0024450 k( 133) = ( -0.2172216 0.2172216 0.2172216), wk = 0.0024450 k( 134) = ( -0.2120496 0.2120496 0.2120496), wk = 0.0024450 k( 135) = ( -0.2068777 0.2068777 0.2068777), wk = 0.0024450 k( 136) = ( -0.2017057 0.2017057 0.2017057), wk = 0.0024450 k( 137) = ( -0.1965338 0.1965338 0.1965338), wk = 0.0024450 k( 138) = ( -0.1913619 0.1913619 0.1913619), wk = 0.0024450 k( 139) = ( -0.1861899 0.1861899 0.1861899), wk = 0.0024450 k( 140) = ( -0.1810180 0.1810180 0.1810180), wk = 0.0024450 k( 141) = ( -0.1758460 0.1758460 0.1758460), wk = 0.0024450 k( 142) = ( -0.1706741 0.1706741 0.1706741), wk = 0.0024450 k( 143) = ( -0.1655021 0.1655021 0.1655021), wk = 0.0024450 k( 144) = ( -0.1603302 0.1603302 0.1603302), wk = 0.0024450 k( 145) = ( -0.1551583 0.1551583 0.1551583), wk = 0.0024450 k( 146) = ( -0.1499863 0.1499863 0.1499863), wk = 0.0024450 k( 147) = ( -0.1448144 0.1448144 0.1448144), wk = 0.0024450 k( 148) = ( -0.1396424 0.1396424 0.1396424), wk = 0.0024450 k( 149) = ( -0.1344705 0.1344705 0.1344705), wk = 0.0024450 k( 150) = ( -0.1292986 0.1292986 0.1292985), wk = 0.0024450 k( 151) = ( -0.1241266 0.1241266 0.1241266), wk = 0.0024450 k( 152) = ( -0.1189547 0.1189547 0.1189547), wk = 0.0024450 k( 153) = ( -0.1137827 0.1137827 0.1137827), wk = 0.0024450 k( 154) = ( -0.1086108 0.1086108 0.1086108), wk = 0.0024450 k( 155) = ( -0.1034388 0.1034388 0.1034388), wk = 0.0024450 k( 156) = ( -0.0982669 0.0982669 0.0982669), wk = 0.0024450 k( 157) = ( -0.0930950 0.0930950 0.0930950), wk = 0.0024450 k( 158) = ( -0.0879230 0.0879230 0.0879230), wk = 0.0024450 k( 159) = ( -0.0827511 0.0827511 0.0827511), wk = 0.0024450 k( 160) = ( -0.0775791 0.0775791 0.0775791), wk = 0.0024450 k( 161) = ( -0.0724072 0.0724072 0.0724072), wk = 0.0024450 k( 162) = ( -0.0672352 0.0672352 0.0672352), wk = 0.0024450 k( 163) = ( -0.0620633 0.0620633 0.0620633), wk = 0.0024450 k( 164) = ( -0.0568914 0.0568914 0.0568914), wk = 0.0024450 k( 165) = ( -0.0517194 0.0517194 0.0517194), wk = 0.0024450 k( 166) = ( -0.0465475 0.0465475 0.0465475), wk = 0.0024450 k( 167) = ( -0.0413755 0.0413755 0.0413755), wk = 0.0024450 k( 168) = ( -0.0362036 0.0362036 0.0362036), wk = 0.0024450 k( 169) = ( -0.0310317 0.0310317 0.0310316), wk = 0.0024450 k( 170) = ( -0.0258597 0.0258597 0.0258597), wk = 0.0024450 k( 171) = ( -0.0206878 0.0206878 0.0206878), wk = 0.0024450 k( 172) = ( -0.0155158 0.0155158 0.0155158), wk = 0.0024450 k( 173) = ( -0.0103439 0.0103439 0.0103439), wk = 0.0024450 k( 174) = ( -0.0051719 0.0051719 0.0051719), wk = 0.0024450 k( 175) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0024450 k( 177) = ( 0.0185185 0.0185185 -0.0185185), wk = 0.0024450 k( 178) = ( 0.0370370 0.0370370 -0.0370370), wk = 0.0024450 k( 179) = ( 0.0555556 0.0555556 -0.0555556), wk = 0.0024450 k( 180) = ( 0.0740741 0.0740741 -0.0740741), wk = 0.0024450 k( 181) = ( 0.0925926 0.0925926 -0.0925926), wk = 0.0024450 k( 182) = ( 0.1111111 0.1111111 -0.1111111), wk = 0.0024450 k( 183) = ( 0.1296296 0.1296296 -0.1296296), wk = 0.0024450 k( 184) = ( 0.1481482 0.1481482 -0.1481482), wk = 0.0024450 k( 185) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0024450 k( 186) = ( 0.1851852 0.1851852 -0.1851852), wk = 0.0024450 k( 187) = ( 0.2037037 0.2037037 -0.2037037), wk = 0.0024450 k( 188) = ( 0.2222222 0.2222222 -0.2222222), wk = 0.0024450 k( 189) = ( 0.2407407 0.2407407 -0.2407407), wk = 0.0024450 k( 190) = ( 0.2592593 0.2592593 -0.2592593), wk = 0.0024450 k( 191) = ( 0.2777778 0.2777778 -0.2777778), wk = 0.0024450 k( 192) = ( 0.2962963 0.2962963 -0.2962963), wk = 0.0024450 k( 193) = ( 0.3148148 0.3148148 -0.3148148), wk = 0.0024450 k( 194) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0024450 k( 195) = ( 0.3518519 0.3518519 -0.3518519), wk = 0.0024450 k( 196) = ( 0.3703704 0.3703704 -0.3703704), wk = 0.0024450 k( 197) = ( 0.3888889 0.3888889 -0.3888889), wk = 0.0024450 k( 198) = ( 0.4074074 0.4074074 -0.4074074), wk = 0.0024450 k( 199) = ( 0.4259259 0.4259259 -0.4259259), wk = 0.0024450 k( 200) = ( 0.4444444 0.4444444 -0.4444444), wk = 0.0024450 k( 201) = ( 0.4629630 0.4629630 -0.4629630), wk = 0.0024450 k( 202) = ( 0.4814815 0.4814815 -0.4814815), wk = 0.0024450 k( 203) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0024450 k( 204) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0024450 k( 205) = ( 0.4948654 0.5051346 -0.4948654), wk = 0.0024450 k( 206) = ( 0.4897307 0.5102693 -0.4897307), wk = 0.0024450 k( 207) = ( 0.4845961 0.5154039 -0.4845961), wk = 0.0024450 k( 208) = ( 0.4794614 0.5205386 -0.4794614), wk = 0.0024450 k( 209) = ( 0.4743268 0.5256732 -0.4743268), wk = 0.0024450 k( 210) = ( 0.4691921 0.5308079 -0.4691921), wk = 0.0024450 k( 211) = ( 0.4640575 0.5359425 -0.4640575), wk = 0.0024450 k( 212) = ( 0.4589228 0.5410772 -0.4589228), wk = 0.0024450 k( 213) = ( 0.4537882 0.5462118 -0.4537882), wk = 0.0024450 k( 214) = ( 0.4486536 0.5513465 -0.4486535), wk = 0.0024450 k( 215) = ( 0.4435189 0.5564811 -0.4435189), wk = 0.0024450 k( 216) = ( 0.4383843 0.5616157 -0.4383843), wk = 0.0024450 k( 217) = ( 0.4332496 0.5667504 -0.4332496), wk = 0.0024450 k( 218) = ( 0.4281150 0.5718850 -0.4281150), wk = 0.0024450 k( 219) = ( 0.4229803 0.5770197 -0.4229803), wk = 0.0024450 k( 220) = ( 0.4178457 0.5821543 -0.4178457), wk = 0.0024450 k( 221) = ( 0.4127110 0.5872890 -0.4127110), wk = 0.0024450 k( 222) = ( 0.4075764 0.5924236 -0.4075764), wk = 0.0024450 k( 223) = ( 0.4024417 0.5975582 -0.4024418), wk = 0.0024450 k( 224) = ( 0.3973071 0.6026929 -0.3973071), wk = 0.0024450 k( 225) = ( 0.3921725 0.6078275 -0.3921725), wk = 0.0024450 k( 226) = ( 0.3870378 0.6129622 -0.3870378), wk = 0.0024450 k( 227) = ( 0.3819032 0.6180968 -0.3819032), wk = 0.0024450 k( 228) = ( 0.3767685 0.6232315 -0.3767685), wk = 0.0024450 k( 229) = ( 0.3716339 0.6283661 -0.3716339), wk = 0.0024450 k( 230) = ( 0.3664992 0.6335008 -0.3664992), wk = 0.0024450 k( 231) = ( 0.3613646 0.6386354 -0.3613646), wk = 0.0024450 k( 232) = ( 0.3562300 0.6437700 -0.3562299), wk = 0.0024450 k( 233) = ( 0.3510953 0.6489047 -0.3510953), wk = 0.0024450 k( 234) = ( 0.3459607 0.6540393 -0.3459607), wk = 0.0024450 k( 235) = ( 0.3408260 0.6591740 -0.3408260), wk = 0.0024450 k( 236) = ( 0.3356914 0.6643086 -0.3356914), wk = 0.0024450 k( 237) = ( 0.3305567 0.6694433 -0.3305567), wk = 0.0024450 k( 238) = ( 0.3254221 0.6745779 -0.3254221), wk = 0.0024450 k( 239) = ( 0.3202874 0.6797126 -0.3202874), wk = 0.0024450 k( 240) = ( 0.3151528 0.6848472 -0.3151528), wk = 0.0024450 k( 241) = ( 0.3100181 0.6899819 -0.3100181), wk = 0.0024450 k( 242) = ( 0.3048835 0.6951165 -0.3048835), wk = 0.0024450 k( 243) = ( 0.2997489 0.7002511 -0.2997489), wk = 0.0024450 k( 244) = ( 0.2946142 0.7053858 -0.2946142), wk = 0.0024450 k( 245) = ( 0.2894796 0.7105204 -0.2894796), wk = 0.0024450 k( 246) = ( 0.2843449 0.7156551 -0.2843449), wk = 0.0024450 k( 247) = ( 0.2792103 0.7207897 -0.2792103), wk = 0.0024450 k( 248) = ( 0.2740756 0.7259244 -0.2740756), wk = 0.0024450 k( 249) = ( 0.2689410 0.7310590 -0.2689410), wk = 0.0024450 k( 250) = ( 0.2689410 0.7310590 -0.2689410), wk = 0.0024450 k( 251) = ( 0.2497309 0.7145548 -0.2497309), wk = 0.0024450 k( 252) = ( 0.2305208 0.6980506 -0.2305208), wk = 0.0024450 k( 253) = ( 0.2113108 0.6815464 -0.2113108), wk = 0.0024450 k( 254) = ( 0.1921007 0.6650421 -0.1921007), wk = 0.0024450 k( 255) = ( 0.1728906 0.6485379 -0.1728906), wk = 0.0024450 k( 256) = ( 0.1536806 0.6320337 -0.1536806), wk = 0.0024450 k( 257) = ( 0.1344705 0.6155295 -0.1344705), wk = 0.0024450 k( 258) = ( 0.1152604 0.5990253 -0.1152604), wk = 0.0024450 k( 259) = ( 0.0960504 0.5825211 -0.0960503), wk = 0.0024450 k( 260) = ( 0.0768403 0.5660169 -0.0768403), wk = 0.0024450 k( 261) = ( 0.0576302 0.5495127 -0.0576302), wk = 0.0024450 k( 262) = ( 0.0384201 0.5330084 -0.0384201), wk = 0.0024450 k( 263) = ( 0.0192101 0.5165042 -0.0192101), wk = 0.0024450 k( 264) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0024450 k( 265) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0024450 k( 266) = ( 0.0051020 0.4948980 0.0051020), wk = 0.0024450 k( 267) = ( 0.0102041 0.4897959 0.0102041), wk = 0.0024450 k( 268) = ( 0.0153061 0.4846939 0.0153061), wk = 0.0024450 k( 269) = ( 0.0204082 0.4795918 0.0204082), wk = 0.0024450 k( 270) = ( 0.0255102 0.4744898 0.0255102), wk = 0.0024450 k( 271) = ( 0.0306122 0.4693878 0.0306122), wk = 0.0024450 k( 272) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0024450 k( 273) = ( 0.0408163 0.4591837 0.0408163), wk = 0.0024450 k( 274) = ( 0.0459184 0.4540816 0.0459184), wk = 0.0024450 k( 275) = ( 0.0510204 0.4489796 0.0510204), wk = 0.0024450 k( 276) = ( 0.0561224 0.4438776 0.0561225), wk = 0.0024450 k( 277) = ( 0.0612245 0.4387755 0.0612245), wk = 0.0024450 k( 278) = ( 0.0663265 0.4336735 0.0663265), wk = 0.0024450 k( 279) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0024450 k( 280) = ( 0.0765306 0.4234694 0.0765306), wk = 0.0024450 k( 281) = ( 0.0816327 0.4183674 0.0816327), wk = 0.0024450 k( 282) = ( 0.0867347 0.4132653 0.0867347), wk = 0.0024450 k( 283) = ( 0.0918367 0.4081633 0.0918367), wk = 0.0024450 k( 284) = ( 0.0969388 0.4030612 0.0969388), wk = 0.0024450 k( 285) = ( 0.1020408 0.3979592 0.1020408), wk = 0.0024450 k( 286) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0024450 k( 287) = ( 0.1122449 0.3877551 0.1122449), wk = 0.0024450 k( 288) = ( 0.1173469 0.3826531 0.1173469), wk = 0.0024450 k( 289) = ( 0.1224490 0.3775510 0.1224490), wk = 0.0024450 k( 290) = ( 0.1275510 0.3724490 0.1275510), wk = 0.0024450 k( 291) = ( 0.1326531 0.3673469 0.1326531), wk = 0.0024450 k( 292) = ( 0.1377551 0.3622449 0.1377551), wk = 0.0024450 k( 293) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0024450 k( 294) = ( 0.1479592 0.3520408 0.1479592), wk = 0.0024450 k( 295) = ( 0.1530612 0.3469388 0.1530612), wk = 0.0024450 k( 296) = ( 0.1581633 0.3418367 0.1581633), wk = 0.0024450 k( 297) = ( 0.1632653 0.3367347 0.1632653), wk = 0.0024450 k( 298) = ( 0.1683673 0.3316326 0.1683673), wk = 0.0024450 k( 299) = ( 0.1734694 0.3265306 0.1734694), wk = 0.0024450 k( 300) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0024450 k( 301) = ( 0.1836735 0.3163265 0.1836735), wk = 0.0024450 k( 302) = ( 0.1887755 0.3112245 0.1887755), wk = 0.0024450 k( 303) = ( 0.1938776 0.3061224 0.1938776), wk = 0.0024450 k( 304) = ( 0.1989796 0.3010204 0.1989796), wk = 0.0024450 k( 305) = ( 0.2040816 0.2959184 0.2040816), wk = 0.0024450 k( 306) = ( 0.2091837 0.2908163 0.2091837), wk = 0.0024450 k( 307) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0024450 k( 308) = ( 0.2193878 0.2806122 0.2193878), wk = 0.0024450 k( 309) = ( 0.2244898 0.2755102 0.2244898), wk = 0.0024450 k( 310) = ( 0.2295918 0.2704082 0.2295918), wk = 0.0024450 k( 311) = ( 0.2346939 0.2653061 0.2346939), wk = 0.0024450 k( 312) = ( 0.2397959 0.2602041 0.2397959), wk = 0.0024450 k( 313) = ( 0.2448980 0.2551020 0.2448980), wk = 0.0024450 k( 314) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0024450 k( 315) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0024450 k( 316) = ( 0.2666667 0.2666667 0.2308079), wk = 0.0024450 k( 317) = ( 0.2833333 0.2833333 0.2116157), wk = 0.0024450 k( 318) = ( 0.3000000 0.3000000 0.1924236), wk = 0.0024450 k( 319) = ( 0.3166667 0.3166667 0.1732315), wk = 0.0024450 k( 320) = ( 0.3333333 0.3333333 0.1540393), wk = 0.0024450 k( 321) = ( 0.3500000 0.3500000 0.1348472), wk = 0.0024450 k( 322) = ( 0.3666667 0.3666667 0.1156551), wk = 0.0024450 k( 323) = ( 0.3833333 0.3833333 0.0964629), wk = 0.0024450 k( 324) = ( 0.4000000 0.4000000 0.0772708), wk = 0.0024450 k( 325) = ( 0.4166667 0.4166667 0.0580787), wk = 0.0024450 k( 326) = ( 0.4333333 0.4333333 0.0388866), wk = 0.0024450 k( 327) = ( 0.4500000 0.4500000 0.0196944), wk = 0.0024450 k( 328) = ( 0.4666667 0.4666667 0.0005023), wk = 0.0024450 k( 329) = ( 0.4833333 0.4833333 -0.0186898), wk = 0.0024450 k( 330) = ( 0.5000000 0.5000000 -0.0378820), wk = 0.0024450 k( 331) = ( 0.5000000 0.5000000 -0.0378820), wk = 0.0024450 k( 332) = ( 0.5000000 0.5000000 -0.0452172), wk = 0.0024450 k( 333) = ( 0.5000000 0.5000000 -0.0525524), wk = 0.0024450 k( 334) = ( 0.5000000 0.5000000 -0.0598876), wk = 0.0024450 k( 335) = ( 0.5000000 0.5000000 -0.0672228), wk = 0.0024450 k( 336) = ( 0.5000000 0.5000000 -0.0745580), wk = 0.0024450 k( 337) = ( 0.5000000 0.5000000 -0.0818932), wk = 0.0024450 k( 338) = ( 0.5000000 0.5000000 -0.0892284), wk = 0.0024450 k( 339) = ( 0.5000000 0.5000000 -0.0965636), wk = 0.0024450 k( 340) = ( 0.5000000 0.5000000 -0.1038988), wk = 0.0024450 k( 341) = ( 0.5000000 0.5000000 -0.1112340), wk = 0.0024450 k( 342) = ( 0.5000000 0.5000000 -0.1185693), wk = 0.0024450 k( 343) = ( 0.5000000 0.5000000 -0.1259045), wk = 0.0024450 k( 344) = ( 0.5000000 0.5000000 -0.1332397), wk = 0.0024450 k( 345) = ( 0.5000000 0.5000000 -0.1405749), wk = 0.0024450 k( 346) = ( 0.5000000 0.5000000 -0.1479101), wk = 0.0024450 k( 347) = ( 0.5000000 0.5000000 -0.1552453), wk = 0.0024450 k( 348) = ( 0.5000000 0.5000000 -0.1625805), wk = 0.0024450 k( 349) = ( 0.5000000 0.5000000 -0.1699157), wk = 0.0024450 k( 350) = ( 0.5000000 0.5000000 -0.1772509), wk = 0.0024450 k( 351) = ( 0.5000000 0.5000000 -0.1845861), wk = 0.0024450 k( 352) = ( 0.5000000 0.5000000 -0.1919213), wk = 0.0024450 k( 353) = ( 0.5000000 0.5000000 -0.1992565), wk = 0.0024450 k( 354) = ( 0.5000000 0.5000000 -0.2065917), wk = 0.0024450 k( 355) = ( 0.5000000 0.5000000 -0.2139269), wk = 0.0024450 k( 356) = ( 0.5000000 0.5000000 -0.2212621), wk = 0.0024450 k( 357) = ( 0.5000000 0.5000000 -0.2285974), wk = 0.0024450 k( 358) = ( 0.5000000 0.5000000 -0.2359326), wk = 0.0024450 k( 359) = ( 0.5000000 0.5000000 -0.2432678), wk = 0.0024450 k( 360) = ( 0.5000000 0.5000000 -0.2506030), wk = 0.0024450 k( 361) = ( 0.5000000 0.5000000 -0.2579382), wk = 0.0024450 k( 362) = ( 0.5000000 0.5000000 -0.2652734), wk = 0.0024450 k( 363) = ( 0.5000000 0.5000000 -0.2726086), wk = 0.0024450 k( 364) = ( 0.5000000 0.5000000 -0.2799438), wk = 0.0024450 k( 365) = ( 0.5000000 0.5000000 -0.2872790), wk = 0.0024450 k( 366) = ( 0.5000000 0.5000000 -0.2946142), wk = 0.0024450 k( 367) = ( 0.5000000 0.5000000 -0.3019494), wk = 0.0024450 k( 368) = ( 0.5000000 0.5000000 -0.3092846), wk = 0.0024450 k( 369) = ( 0.5000000 0.5000000 -0.3166198), wk = 0.0024450 k( 370) = ( 0.5000000 0.5000000 -0.3239550), wk = 0.0024450 k( 371) = ( 0.5000000 0.5000000 -0.3312903), wk = 0.0024450 k( 372) = ( 0.5000000 0.5000000 -0.3386254), wk = 0.0024450 k( 373) = ( 0.5000000 0.5000000 -0.3459607), wk = 0.0024450 k( 374) = ( 0.5000000 0.5000000 -0.3532959), wk = 0.0024450 k( 375) = ( 0.5000000 0.5000000 -0.3606311), wk = 0.0024450 k( 376) = ( 0.5000000 0.5000000 -0.3679663), wk = 0.0024450 k( 377) = ( 0.5000000 0.5000000 -0.3753015), wk = 0.0024450 k( 378) = ( 0.5000000 0.5000000 -0.3826367), wk = 0.0024450 k( 379) = ( 0.5000000 0.5000000 -0.3899719), wk = 0.0024450 k( 380) = ( 0.5000000 0.5000000 -0.3973071), wk = 0.0024450 k( 381) = ( 0.5000000 0.5000000 -0.4046423), wk = 0.0024450 k( 382) = ( 0.5000000 0.5000000 -0.4119775), wk = 0.0024450 k( 383) = ( 0.5000000 0.5000000 -0.4193127), wk = 0.0024450 k( 384) = ( 0.5000000 0.5000000 -0.4266479), wk = 0.0024450 k( 385) = ( 0.5000000 0.5000000 -0.4339831), wk = 0.0024450 k( 386) = ( 0.5000000 0.5000000 -0.4413184), wk = 0.0024450 k( 387) = ( 0.5000000 0.5000000 -0.4486536), wk = 0.0024450 k( 388) = ( 0.5000000 0.5000000 -0.4559888), wk = 0.0024450 k( 389) = ( 0.5000000 0.5000000 -0.4633240), wk = 0.0024450 k( 390) = ( 0.5000000 0.5000000 -0.4706592), wk = 0.0024450 k( 391) = ( 0.5000000 0.5000000 -0.4779944), wk = 0.0024450 k( 392) = ( 0.5000000 0.5000000 -0.4853296), wk = 0.0024450 k( 393) = ( 0.5000000 0.5000000 -0.4926648), wk = 0.0024450 k( 394) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0024450 k( 395) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0024450 k( 396) = ( 0.0178571 0.0178571 0.4821429), wk = 0.0024450 k( 397) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0024450 k( 398) = ( 0.0535714 0.0535714 0.4464286), wk = 0.0024450 k( 399) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0024450 k( 400) = ( 0.0892857 0.0892857 0.4107143), wk = 0.0024450 k( 401) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0024450 k( 402) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0024450 k( 403) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0024450 k( 404) = ( 0.1607143 0.1607143 0.3392857), wk = 0.0024450 k( 405) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0024450 k( 406) = ( 0.1964286 0.1964286 0.3035714), wk = 0.0024450 k( 407) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0024450 k( 408) = ( 0.2321429 0.2321429 0.2678571), wk = 0.0024450 k( 409) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0024450 Dense grid: 116967 G-vectors FFT dimensions: ( 100, 100, 100) Smooth grid: 19341 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.09 Mb ( 138, 44) NL pseudopotentials 0.11 Mb ( 69, 102) Each V/rho on FFT grid 0.46 Mb ( 30000) Each G-vector array 0.02 Mb ( 3250) G-vector shells 0.01 Mb ( 1462) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.37 Mb ( 138, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.14 Mb ( 102, 2, 44) The potential is recalculated from file : ./Hf2Cd.save/charge-density.dat Starting wfc are 58 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.6 secs Computing kpt #: 2 total cpu time spent up to now is 5.1 secs Computing kpt #: 3 total cpu time spent up to now is 5.6 secs Computing kpt #: 4 total cpu time spent up to now is 6.1 secs Computing kpt #: 5 total cpu time spent up to now is 6.5 secs Computing kpt #: 6 total cpu time spent up to now is 7.0 secs Computing kpt #: 7 total cpu time spent up to now is 7.5 secs Computing kpt #: 8 total cpu time spent up to now is 8.0 secs Computing kpt #: 9 total cpu time spent up to now is 8.5 secs Computing kpt #: 10 total cpu time spent up to now is 9.0 secs Computing kpt #: 11 total cpu time spent up to now is 9.5 secs Computing kpt #: 12 total cpu time spent up to now is 10.0 secs Computing kpt #: 13 total cpu time spent up to now is 10.5 secs Computing kpt #: 14 total cpu time spent up to now is 11.0 secs Computing kpt #: 15 total cpu time spent up to now is 11.5 secs Computing kpt #: 16 total cpu time spent up to now is 12.0 secs Computing kpt #: 17 total cpu time spent up to now is 12.4 secs Computing kpt #: 18 total cpu time spent up to now is 12.9 secs Computing kpt #: 19 total cpu time spent up to now is 13.4 secs Computing kpt #: 20 total cpu time spent up to now is 13.9 secs Computing kpt #: 21 total cpu time spent up to now is 14.3 secs Computing kpt #: 22 total cpu time spent up to now is 14.8 secs Computing kpt #: 23 total cpu time spent up to now is 15.3 secs Computing kpt #: 24 total cpu time spent up to now is 15.7 secs Computing kpt #: 25 total cpu time spent up to now is 16.2 secs Computing kpt #: 26 total cpu time spent up to now is 16.7 secs Computing kpt #: 27 total cpu time spent up to now is 17.1 secs Computing kpt #: 28 total cpu time spent up to now is 17.6 secs Computing kpt #: 29 total cpu time spent up to now is 18.1 secs Computing kpt #: 30 total cpu time spent up to now is 18.6 secs Computing kpt #: 31 total cpu time spent up to now is 19.0 secs Computing kpt #: 32 total cpu time spent up to now is 19.5 secs Computing kpt #: 33 total cpu time spent up to now is 19.9 secs Computing kpt #: 34 total cpu time spent up to now is 20.4 secs Computing kpt #: 35 total cpu time spent up to now is 20.8 secs Computing kpt #: 36 total cpu time spent up to now is 21.3 secs Computing kpt #: 37 total cpu time spent up to now is 21.7 secs Computing kpt #: 38 total cpu time spent up to now is 22.1 secs Computing kpt #: 39 total cpu time spent up to now is 22.6 secs Computing kpt #: 40 total cpu time spent up to now is 23.0 secs Computing kpt #: 41 total cpu time spent up to now is 23.5 secs Computing kpt #: 42 total cpu time spent up to now is 23.9 secs Computing kpt #: 43 total cpu time spent up to now is 24.4 secs Computing kpt #: 44 total cpu time spent up to now is 24.9 secs Computing kpt #: 45 total cpu time spent up to now is 25.3 secs Computing kpt #: 46 total cpu time spent up to now is 25.8 secs Computing kpt #: 47 total cpu time spent up to now is 26.3 secs Computing kpt #: 48 total cpu time spent up to now is 26.7 secs Computing kpt #: 49 total cpu time spent up to now is 27.2 secs Computing kpt #: 50 total cpu time spent up to now is 27.7 secs Computing kpt #: 51 total cpu time spent up to now is 28.2 secs Computing kpt #: 52 total cpu time spent up to now is 28.7 secs Computing kpt #: 53 total cpu time spent up to now is 29.2 secs Computing kpt #: 54 total cpu time spent up to now is 29.7 secs Computing kpt #: 55 total cpu time spent up to now is 30.2 secs Computing kpt #: 56 total cpu time spent up to now is 30.7 secs Computing kpt #: 57 total cpu time spent up to now is 31.2 secs Computing kpt #: 58 total cpu time spent up to now is 31.8 secs Computing kpt #: 59 total cpu time spent up to now is 32.4 secs Computing kpt #: 60 total cpu time spent up to now is 33.0 secs Computing kpt #: 61 total cpu time spent up to now is 33.6 secs Computing kpt #: 62 total cpu time spent up to now is 34.2 secs Computing kpt #: 63 total cpu time spent up to now is 34.8 secs Computing kpt #: 64 total cpu time spent up to now is 35.4 secs Computing kpt #: 65 total cpu time spent up to now is 35.9 secs Computing kpt #: 66 total cpu time spent up to now is 36.5 secs Computing kpt #: 67 total cpu time spent up to now is 37.1 secs Computing kpt #: 68 total cpu time spent up to now is 37.7 secs Computing kpt #: 69 total cpu time spent up to now is 38.3 secs Computing kpt #: 70 total cpu time spent up to now is 38.9 secs Computing kpt #: 71 total cpu time spent up to now is 39.4 secs Computing kpt #: 72 total cpu time spent up to now is 40.0 secs Computing kpt #: 73 total cpu time spent up to now is 40.6 secs Computing kpt #: 74 total cpu time spent up to now is 41.2 secs Computing kpt #: 75 total cpu time spent up to now is 41.8 secs Computing kpt #: 76 total cpu time spent up to now is 42.3 secs Computing kpt #: 77 total cpu time spent up to now is 42.9 secs Computing kpt #: 78 total cpu time spent up to now is 43.5 secs Computing kpt #: 79 total cpu time spent up to now is 44.0 secs Computing kpt #: 80 total cpu time spent up to now is 44.6 secs Computing kpt #: 81 total cpu time spent up to now is 45.2 secs Computing kpt #: 82 total cpu time spent up to now is 45.7 secs Computing kpt #: 83 total cpu time spent up to now is 46.2 secs Computing kpt #: 84 total cpu time spent up to now is 46.7 secs Computing kpt #: 85 total cpu time spent up to now is 47.3 secs Computing kpt #: 86 total cpu time spent up to now is 47.8 secs Computing kpt #: 87 total cpu time spent up to now is 48.3 secs Computing kpt #: 88 total cpu time spent up to now is 48.8 secs Computing kpt #: 89 total cpu time spent up to now is 49.3 secs Computing kpt #: 90 total cpu time spent up to now is 49.8 secs Computing kpt #: 91 total cpu time spent up to now is 50.3 secs Computing kpt #: 92 total cpu time spent up to now is 50.8 secs Computing kpt #: 93 total cpu time spent up to now is 51.3 secs Computing kpt #: 94 total cpu time spent up to now is 51.8 secs Computing kpt #: 95 total cpu time spent up to now is 52.3 secs Computing kpt #: 96 total cpu time spent up to now is 52.8 secs Computing kpt #: 97 total cpu time spent up to now is 53.3 secs Computing kpt #: 98 total cpu time spent up to now is 53.7 secs Computing kpt #: 99 total cpu time spent up to now is 54.2 secs Computing kpt #: 100 total cpu time spent up to now is 54.7 secs Computing kpt #: 101 total cpu time spent up to now is 55.2 secs Computing kpt #: 102 total cpu time spent up to now is 55.7 secs Computing kpt #: 103 total cpu time spent up to now is 56.1 secs Computing kpt #: 104 total cpu time spent up to now is 56.6 secs Computing kpt #: 105 total cpu time spent up to now is 57.1 secs Computing kpt #: 106 total cpu time spent up to now is 57.5 secs Computing kpt #: 107 total cpu time spent up to now is 58.0 secs Computing kpt #: 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up to now is 65.4 secs Computing kpt #: 124 total cpu time spent up to now is 65.8 secs Computing kpt #: 125 total cpu time spent up to now is 66.3 secs Computing kpt #: 126 total cpu time spent up to now is 66.7 secs Computing kpt #: 127 total cpu time spent up to now is 67.2 secs Computing kpt #: 128 total cpu time spent up to now is 67.6 secs Computing kpt #: 129 total cpu time spent up to now is 68.0 secs Computing kpt #: 130 total cpu time spent up to now is 68.5 secs Computing kpt #: 131 total cpu time spent up to now is 68.9 secs Computing kpt #: 132 total cpu time spent up to now is 69.3 secs Computing kpt #: 133 total cpu time spent up to now is 69.7 secs Computing kpt #: 134 total cpu time spent up to now is 70.2 secs Computing kpt #: 135 total cpu time spent up to now is 70.6 secs Computing kpt #: 136 total cpu time spent up to now is 71.0 secs Computing kpt #: 137 total cpu time spent up to now is 71.5 secs Computing kpt #: 138 total cpu time spent up to now is 71.9 secs Computing kpt #: 139 total cpu time spent up to now is 72.3 secs Computing kpt #: 140 total cpu time spent up to now is 72.8 secs Computing kpt #: 141 total cpu time spent up to now is 73.2 secs Computing kpt #: 142 total cpu time spent up to now is 73.6 secs Computing kpt #: 143 total cpu time spent up to now is 74.1 secs Computing kpt #: 144 total cpu time spent up to now is 74.5 secs Computing kpt #: 145 total cpu time spent up to now is 75.0 secs Computing kpt #: 146 total cpu time spent up to now is 75.4 secs Computing kpt #: 147 total cpu time spent up to now is 75.9 secs Computing kpt #: 148 total cpu time spent up to now is 76.3 secs Computing kpt #: 149 total cpu time spent up to now is 76.8 secs Computing kpt #: 150 total cpu time spent up to now is 77.2 secs Computing kpt #: 151 total cpu time spent up to now is 77.7 secs Computing kpt #: 152 total cpu time spent up to now is 78.1 secs Computing kpt #: 153 total cpu time spent up to now is 78.5 secs Computing kpt #: 154 total cpu time spent up to now is 79.0 secs Computing kpt #: 155 total cpu time spent up to now is 79.4 secs Computing kpt #: 156 total cpu time spent up to now is 79.9 secs Computing kpt #: 157 total cpu time spent up to now is 80.3 secs Computing kpt #: 158 total cpu time spent up to now is 80.8 secs Computing kpt #: 159 total cpu time spent up to now is 81.2 secs Computing kpt #: 160 total cpu time spent up to now is 81.7 secs Computing kpt #: 161 total cpu time spent up to now is 82.2 secs Computing kpt #: 162 total cpu time spent up to now is 82.6 secs Computing kpt #: 163 total cpu time spent up to now is 83.1 secs Computing kpt #: 164 total cpu time spent up to now is 83.5 secs Computing kpt #: 165 total cpu time spent up to now is 84.0 secs Computing kpt #: 166 total cpu time spent up to now is 84.5 secs Computing kpt #: 167 total cpu time spent up to now is 85.0 secs Computing kpt #: 168 total cpu time spent up to now is 85.5 secs Computing kpt #: 169 total cpu time spent up 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Computing kpt #: 185 total cpu time spent up to now is 93.7 secs Computing kpt #: 186 total cpu time spent up to now is 94.2 secs Computing kpt #: 187 total cpu time spent up to now is 94.8 secs Computing kpt #: 188 total cpu time spent up to now is 95.3 secs Computing kpt #: 189 total cpu time spent up to now is 95.8 secs Computing kpt #: 190 total cpu time spent up to now is 96.3 secs Computing kpt #: 191 total cpu time spent up to now is 96.9 secs Computing kpt #: 192 total cpu time spent up to now is 97.4 secs Computing kpt #: 193 total cpu time spent up to now is 98.0 secs Computing kpt #: 194 total cpu time spent up to now is 98.6 secs Computing kpt #: 195 total cpu time spent up to now is 99.2 secs Computing kpt #: 196 total cpu time spent up to now is 99.8 secs Computing kpt #: 197 total cpu time spent up to now is 100.4 secs Computing kpt #: 198 total cpu time spent up to now is 100.9 secs Computing kpt #: 199 total cpu time spent up to now is 101.3 secs Computing kpt #: 200 total cpu time spent up to now is 101.8 secs Computing kpt #: 201 total cpu time spent up to now is 102.3 secs Computing kpt #: 202 total cpu time spent up to now is 102.7 secs Computing kpt #: 203 total cpu time spent up to now is 103.2 secs Computing kpt #: 204 total cpu time spent up to now is 103.6 secs Computing kpt #: 205 total cpu time spent up to now is 104.1 secs Computing kpt #: 206 total cpu time spent up to now is 104.5 secs Computing kpt #: 207 total cpu time spent up to now is 105.1 secs Computing kpt #: 208 total cpu time spent up to now is 105.6 secs Computing kpt #: 209 total cpu time spent up to now is 106.1 secs Computing kpt #: 210 total cpu time spent up to now is 106.7 secs Computing kpt #: 211 total cpu time spent up to now is 107.2 secs Computing kpt #: 212 total cpu time spent up to now is 107.6 secs Computing kpt #: 213 total cpu time spent up to now is 108.1 secs Computing kpt #: 214 total cpu time spent up to now is 108.6 secs Computing kpt #: 215 total cpu time spent up to now is 109.0 secs Computing kpt #: 216 total cpu time spent up to now is 109.5 secs Computing kpt #: 217 total cpu time spent up to now is 110.0 secs Computing kpt #: 218 total cpu time spent up to now is 110.4 secs Computing kpt #: 219 total cpu time spent up to now is 110.9 secs Computing kpt #: 220 total cpu time spent up to now is 111.4 secs Computing kpt #: 221 total cpu time spent up to now is 111.8 secs Computing kpt #: 222 total cpu time spent up to now is 112.3 secs Computing kpt #: 223 total cpu time spent up to now is 112.7 secs Computing kpt #: 224 total cpu time spent up to now is 113.2 secs Computing kpt #: 225 total cpu time spent up to now is 113.6 secs Computing kpt #: 226 total cpu time spent up to now is 114.1 secs Computing kpt #: 227 total cpu time spent up to now is 114.6 secs Computing kpt #: 228 total cpu time spent up to now is 115.0 secs Computing kpt #: 229 total cpu time spent up to now is 115.5 secs Computing kpt #: 230 total cpu time spent up to now is 115.9 secs Computing kpt #: 231 total cpu time spent up to now is 116.4 secs Computing kpt #: 232 total cpu time spent up to now is 116.9 secs Computing kpt #: 233 total cpu time spent up to now is 117.3 secs Computing kpt #: 234 total cpu time spent up to now is 117.8 secs Computing kpt #: 235 total cpu time spent up to now is 118.2 secs Computing kpt #: 236 total cpu time spent up to now is 118.7 secs Computing kpt #: 237 total cpu time spent up to now is 119.1 secs Computing kpt #: 238 total cpu time spent up to now is 119.6 secs Computing kpt #: 239 total cpu time spent up to now is 120.0 secs Computing kpt #: 240 total cpu time spent up to now is 120.5 secs Computing kpt #: 241 total cpu time spent up to now is 120.9 secs Computing kpt #: 242 total cpu time spent up to now is 121.4 secs Computing kpt #: 243 total cpu time spent up to now is 121.8 secs Computing kpt #: 244 total cpu time spent up to now is 122.3 secs Computing kpt #: 245 total cpu time spent up to now is 122.7 secs Computing kpt #: 246 total cpu time spent up to now is 123.2 secs Computing kpt #: 247 total cpu time spent up to now is 123.6 secs Computing kpt #: 248 total cpu time spent up to now is 124.1 secs Computing kpt #: 249 total cpu time spent up to now is 124.5 secs Computing kpt #: 250 total cpu time spent up to now is 125.0 secs Computing kpt #: 251 total cpu time spent up to now is 125.4 secs Computing kpt #: 252 total cpu time spent up to now is 125.9 secs Computing kpt #: 253 total cpu time spent up to now is 126.3 secs Computing kpt #: 254 total cpu time spent up to now is 126.8 secs Computing kpt #: 255 total cpu time spent up to now is 127.2 secs Computing kpt #: 256 total cpu time spent up to now is 127.7 secs Computing kpt #: 257 total cpu time spent up to now is 128.1 secs Computing kpt #: 258 total cpu time spent up to now is 128.6 secs Computing kpt #: 259 total cpu time spent up to now is 129.0 secs Computing kpt #: 260 total cpu time spent up to now is 129.5 secs Computing kpt #: 261 total cpu time spent up to now is 129.9 secs Computing kpt #: 262 total cpu time spent up to now is 130.4 secs Computing kpt #: 263 total cpu time spent up to now is 130.9 secs Computing kpt #: 264 total cpu time spent up to now is 131.3 secs Computing kpt #: 265 total cpu time spent up to now is 131.7 secs Computing kpt #: 266 total cpu time spent up to now is 132.2 secs Computing kpt #: 267 total cpu time spent up to now is 132.6 secs Computing kpt #: 268 total cpu time spent up to now is 133.1 secs Computing kpt #: 269 total cpu time spent up to now is 133.6 secs Computing kpt #: 270 total cpu time spent up to now is 134.0 secs Computing kpt #: 271 total cpu time spent up to now is 134.5 secs Computing kpt #: 272 total cpu time spent up to now is 134.9 secs Computing kpt #: 273 total cpu time spent up to now is 135.4 secs Computing kpt #: 274 total cpu time spent up to now is 135.9 secs Computing kpt #: 275 total cpu time spent up to now is 136.3 secs Computing kpt #: 276 total cpu time spent up to now is 136.8 secs Computing kpt #: 277 total cpu time spent up to now is 137.3 secs Computing kpt #: 278 total cpu time spent up to now is 137.7 secs Computing kpt #: 279 total cpu time spent up to now is 138.2 secs Computing kpt #: 280 total cpu time spent up to now is 138.7 secs Computing kpt #: 281 total cpu time spent up to now is 139.1 secs Computing kpt #: 282 total cpu time spent up to now is 139.6 secs Computing kpt #: 283 total cpu time spent up to now is 140.3 secs Computing kpt #: 284 total cpu time spent up to now is 140.8 secs Computing kpt #: 285 total cpu time spent up to now is 141.3 secs Computing kpt #: 286 total cpu time spent up to now is 141.8 secs Computing kpt #: 287 total cpu time spent up to now is 142.2 secs Computing kpt #: 288 total cpu time spent up to now is 142.7 secs Computing kpt #: 289 total cpu time spent up to now is 143.2 secs Computing kpt #: 290 total cpu time spent up to now is 143.7 secs Computing kpt #: 291 total cpu time spent up to now is 144.1 secs Computing kpt #: 292 total cpu time spent up to now is 144.6 secs Computing kpt #: 293 total cpu time spent up to now is 145.1 secs Computing kpt #: 294 total cpu time spent up to now is 145.6 secs Computing kpt #: 295 total cpu time spent up to now is 146.1 secs Computing kpt #: 296 total cpu time spent up to now is 146.7 secs Computing kpt #: 297 total cpu time spent up to now is 147.3 secs Computing kpt #: 298 total cpu time spent up to now is 147.8 secs Computing kpt #: 299 total cpu time spent up to now is 148.3 secs Computing kpt #: 300 total cpu time spent up to now is 148.8 secs Computing kpt #: 301 total cpu time spent up to now is 149.3 secs Computing kpt #: 302 total cpu time spent up to now is 149.9 secs Computing kpt #: 303 total cpu time spent up to now is 150.4 secs Computing kpt #: 304 total cpu time spent up to now is 150.9 secs Computing kpt #: 305 total cpu time spent up to now is 151.4 secs Computing kpt #: 306 total cpu time spent up to now is 151.9 secs Computing kpt #: 307 total cpu time spent up to now is 152.4 secs Computing kpt #: 308 total cpu time spent up to now is 152.9 secs Computing kpt #: 309 total cpu time spent up to now is 153.5 secs Computing kpt #: 310 total cpu time spent up to now is 154.0 secs Computing kpt #: 311 total cpu time spent up to now is 154.5 secs Computing kpt #: 312 total cpu time spent up to now is 155.0 secs Computing kpt #: 313 total cpu time spent up to now is 155.6 secs Computing kpt #: 314 total cpu time spent up to now is 156.1 secs Computing kpt #: 315 total cpu time spent up to now is 156.6 secs Computing kpt #: 316 total cpu time spent up to now is 157.1 secs Computing kpt #: 317 total cpu time spent up to now is 157.6 secs Computing kpt #: 318 total cpu time spent up to now is 158.1 secs Computing kpt #: 319 total cpu time spent up to now is 158.6 secs Computing kpt #: 320 total cpu time spent up to now is 159.1 secs Computing kpt #: 321 total cpu time spent up to now is 159.6 secs Computing kpt #: 322 total cpu time spent up to now is 160.1 secs Computing kpt #: 323 total cpu time spent up to now is 160.6 secs Computing kpt #: 324 total cpu time spent up to now is 161.1 secs Computing kpt #: 325 total cpu time spent up to now is 161.6 secs Computing kpt #: 326 total cpu time spent up to now is 162.1 secs Computing kpt #: 327 total cpu time spent up to now is 162.6 secs Computing kpt #: 328 total cpu time spent up to now is 163.1 secs Computing kpt #: 329 total cpu time spent up to now is 163.6 secs Computing kpt #: 330 total cpu time spent up to now is 164.2 secs Computing kpt #: 331 total cpu time spent up to now is 164.8 secs Computing kpt #: 332 total cpu time spent up to now is 165.4 secs Computing kpt #: 333 total cpu time spent up to now is 165.9 secs Computing kpt #: 334 total cpu time spent up to now is 166.4 secs Computing kpt #: 335 total cpu time spent up to now is 167.0 secs Computing kpt #: 336 total cpu time spent up to now is 167.5 secs Computing kpt #: 337 total cpu time spent up to now is 168.0 secs Computing kpt #: 338 total cpu time spent up to now is 168.5 secs Computing kpt #: 339 total cpu time spent up to now is 169.1 secs Computing kpt #: 340 total cpu time spent up to now is 169.6 secs Computing kpt #: 341 total cpu time spent up to now is 170.1 secs Computing kpt #: 342 total cpu time spent up to now is 170.7 secs Computing kpt #: 343 total cpu time spent up to now is 171.2 secs Computing kpt #: 344 total cpu time spent up to now is 171.7 secs Computing kpt #: 345 total cpu time spent up to now is 172.2 secs Computing kpt #: 346 total cpu time spent up to now is 172.7 secs Computing kpt #: 347 total cpu time spent up to now is 173.1 secs Computing kpt #: 348 total cpu time spent up to now is 173.6 secs Computing kpt #: 349 total cpu time spent up to now is 174.1 secs Computing kpt #: 350 total cpu time spent up to now is 174.5 secs Computing kpt #: 351 total cpu time spent up to now is 175.0 secs Computing kpt #: 352 total cpu time spent up to now is 175.4 secs Computing kpt #: 353 total cpu time spent up to now is 175.9 secs Computing kpt #: 354 total cpu time spent up to now is 176.3 secs Computing kpt #: 355 total cpu time spent up to now is 176.8 secs Computing kpt #: 356 total cpu time spent up to now is 177.2 secs Computing kpt #: 357 total cpu time spent up to now is 177.6 secs Computing kpt #: 358 total cpu time spent up to now is 178.1 secs Computing kpt #: 359 total cpu time spent up to now is 178.5 secs Computing kpt #: 360 total cpu time spent up to now is 179.0 secs Computing kpt #: 361 total cpu time spent up to now is 179.4 secs Computing kpt #: 362 total cpu time spent up to now is 179.9 secs Computing kpt #: 363 total cpu time spent up to now is 180.4 secs Computing kpt #: 364 total cpu time spent up to now is 180.8 secs Computing kpt #: 365 total cpu time spent up to now is 181.3 secs Computing kpt #: 366 total cpu time spent up to now is 181.8 secs Computing kpt #: 367 total cpu time spent up to now is 182.3 secs Computing kpt #: 368 total cpu time spent up to now is 182.8 secs Computing kpt #: 369 total cpu time spent up to now is 183.2 secs Computing kpt #: 370 total cpu time spent up to now is 183.7 secs Computing kpt #: 371 total cpu time spent up to now is 184.3 secs Computing kpt #: 372 total cpu time spent up to now is 184.8 secs Computing kpt #: 373 total cpu time spent up to now is 185.3 secs Computing kpt #: 374 total cpu time spent up to now is 185.9 secs Computing kpt #: 375 total cpu time spent up to now is 186.5 secs Computing kpt #: 376 total cpu time spent up to now is 187.0 secs Computing kpt #: 377 total cpu time spent up to now is 187.6 secs Computing kpt #: 378 total cpu time spent up to now is 188.1 secs Computing kpt #: 379 total cpu time spent up to now is 188.7 secs Computing kpt #: 380 total cpu time spent up to now is 189.1 secs Computing kpt #: 381 total cpu time spent up to now is 189.6 secs Computing kpt #: 382 total cpu time spent up to now is 190.1 secs Computing kpt #: 383 total cpu time spent up to now is 190.6 secs Computing kpt #: 384 total cpu time spent up to now is 191.2 secs Computing kpt #: 385 total cpu time spent up to now is 191.6 secs Computing kpt #: 386 total cpu time spent up to now is 192.1 secs Computing kpt #: 387 total cpu time spent up to now is 192.6 secs Computing kpt #: 388 total cpu time spent up to now is 193.1 secs Computing kpt #: 389 total cpu time spent up to now is 193.7 secs Computing kpt #: 390 total cpu time spent up to now is 194.2 secs Computing kpt #: 391 total cpu time spent up to now is 194.7 secs Computing kpt #: 392 total cpu time spent up to now is 195.3 secs Computing kpt #: 393 total cpu time spent up to now is 195.7 secs Computing kpt #: 394 total cpu time spent up to now is 196.2 secs Computing kpt #: 395 total cpu time spent up to now is 196.8 secs Computing kpt #: 396 total cpu time spent up to now is 197.3 secs Computing kpt #: 397 total cpu time spent up to now is 197.8 secs Computing kpt #: 398 total cpu time spent up to now is 198.3 secs Computing kpt #: 399 total cpu time spent up to now is 198.8 secs Computing kpt #: 400 total cpu time spent up to now is 199.3 secs Computing kpt #: 401 total cpu time spent up to now is 199.8 secs Computing kpt #: 402 total cpu time spent up to now is 200.3 secs Computing kpt #: 403 total cpu time spent up to now is 200.8 secs Computing kpt #: 404 total cpu time spent up to now is 201.3 secs Computing kpt #: 405 total cpu time spent up to now is 201.8 secs Computing kpt #: 406 total cpu time spent up to now is 202.3 secs Computing kpt #: 407 total cpu time spent up to now is 202.8 secs Computing kpt #: 408 total cpu time spent up to now is 203.3 secs Computing kpt #: 409 total cpu time spent up to now is 203.8 secs ethr = 2.78E-08, avg # of iterations = 17.0 total cpu time spent up to now is 203.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -47.6764 -47.6764 -47.6330 -47.6330 -21.9775 -21.9775 -21.8330 -21.8330 -14.3967 -14.3967 -14.1402 -14.1402 -14.0166 -14.0166 -13.9437 -13.9437 4.8683 4.8683 5.0051 5.0051 5.6583 5.6583 5.6927 5.6927 5.9529 5.9529 6.1376 6.1376 10.3344 10.3344 12.0367 12.0367 12.7119 12.7119 14.6978 14.6978 16.1165 16.1165 16.2819 16.2819 16.4893 16.4893 16.8640 16.8640 k = 0.0000 0.0000 0.0203 ( 2417 PWs) bands (ev): -47.6763 -47.6763 -47.6330 -47.6330 -21.9775 -21.9775 -21.8331 -21.8331 -14.3966 -14.3966 -14.1405 -14.1405 -14.0166 -14.0166 -13.9439 -13.9439 4.8686 4.8686 5.0053 5.0053 5.6585 5.6585 5.6926 5.6926 5.9526 5.9526 6.1395 6.1395 10.3366 10.3366 12.0368 12.0368 12.7131 12.7131 14.6977 14.6977 16.1060 16.1060 16.2753 16.2753 16.5008 16.5008 16.8537 16.8537 k = 0.0000 0.0000 0.0405 ( 2413 PWs) bands (ev): -47.6762 -47.6762 -47.6330 -47.6330 -21.9775 -21.9775 -21.8333 -21.8333 -14.3965 -14.3965 -14.1412 -14.1412 -14.0166 -14.0166 -13.9446 -13.9446 4.8695 4.8695 5.0059 5.0059 5.6588 5.6588 5.6922 5.6922 5.9518 5.9518 6.1453 6.1453 10.3432 10.3432 12.0370 12.0370 12.7170 12.7170 14.6971 14.6971 16.0766 16.0766 16.2593 16.2593 16.5272 16.5272 16.8307 16.8307 k = 0.0000 0.0000 0.0608 ( 2405 PWs) bands (ev): -47.6761 -47.6761 -47.6330 -47.6330 -21.9774 -21.9774 -21.8338 -21.8338 -14.3962 -14.3962 -14.1425 -14.1425 -14.0166 -14.0166 -13.9457 -13.9457 4.8712 4.8712 5.0068 5.0068 5.6593 5.6593 5.6916 5.6916 5.9504 5.9504 6.1549 6.1549 10.3542 10.3542 12.0372 12.0372 12.7234 12.7234 14.6963 14.6963 16.0338 16.0338 16.2385 16.2385 16.5506 16.5506 16.8126 16.8126 k = 0.0000 0.0000 0.0811 ( 2403 PWs) bands (ev): -47.6759 -47.6759 -47.6329 -47.6329 -21.9775 -21.9775 -21.8344 -21.8344 -14.3960 -14.3960 -14.1443 -14.1443 -14.0166 -14.0166 -13.9472 -13.9472 4.8735 4.8735 5.0080 5.0080 5.6599 5.6599 5.6906 5.6906 5.9483 5.9483 6.1684 6.1684 10.3696 10.3696 12.0376 12.0376 12.7323 12.7323 14.6951 14.6951 15.9830 15.9830 16.2136 16.2136 16.5534 16.5534 16.8174 16.8174 k = 0.0000 0.0000 0.1013 ( 2411 PWs) bands (ev): -47.6757 -47.6757 -47.6329 -47.6329 -21.9777 -21.9777 -21.8353 -21.8353 -14.3958 -14.3958 -14.1467 -14.1467 -14.0169 -14.0169 -13.9493 -13.9493 4.8762 4.8762 5.0094 5.0094 5.6604 5.6604 5.6893 5.6893 5.9456 5.9456 6.1859 6.1859 10.3893 10.3893 12.0380 12.0380 12.7436 12.7436 14.6934 14.6934 15.9281 15.9281 16.1838 16.1838 16.5314 16.5314 16.8499 16.8499 k = 0.0000 0.0000 0.1216 ( 2415 PWs) bands (ev): -47.6754 -47.6754 -47.6329 -47.6329 -21.9779 -21.9779 -21.8363 -21.8363 -14.3955 -14.3955 -14.1495 -14.1495 -14.0172 -14.0172 -13.9517 -13.9517 4.8796 4.8796 5.0111 5.0111 5.6610 5.6610 5.6878 5.6878 5.9422 5.9422 6.2074 6.2074 10.4133 10.4133 12.0386 12.0386 12.7575 12.7575 14.6912 14.6912 15.8716 15.8716 16.1486 16.1486 16.4951 16.4951 16.8995 16.8995 k = 0.0000 0.0000 0.1419 ( 2419 PWs) bands (ev): -47.6751 -47.6751 -47.6329 -47.6329 -21.9782 -21.9782 -21.8375 -21.8375 -14.3952 -14.3952 -14.1527 -14.1527 -14.0175 -14.0175 -13.9545 -13.9545 4.8835 4.8835 5.0131 5.0131 5.6617 5.6617 5.6862 5.6862 5.9382 5.9382 6.2329 6.2329 10.4416 10.4416 12.0393 12.0393 12.7737 12.7737 14.6885 14.6885 15.8148 15.8148 16.1078 16.1078 16.4538 16.4538 16.9556 16.9556 k = 0.0000 0.0000 0.1622 ( 2419 PWs) bands (ev): -47.6747 -47.6747 -47.6328 -47.6328 -21.9784 -21.9784 -21.8389 -21.8389 -14.3948 -14.3948 -14.1563 -14.1563 -14.0179 -14.0179 -13.9578 -13.9578 4.8881 4.8881 5.0153 5.0153 5.6624 5.6624 5.6845 5.6845 5.9336 5.9336 6.2624 6.2624 10.4741 10.4741 12.0402 12.0402 12.7923 12.7923 14.6852 14.6852 15.7587 15.7587 16.0619 16.0619 16.4122 16.4122 17.0107 17.0107 k = 0.0000 0.0000 0.1824 ( 2419 PWs) bands (ev): -47.6743 -47.6743 -47.6328 -47.6328 -21.9786 -21.9786 -21.8404 -21.8404 -14.3943 -14.3943 -14.1603 -14.1603 -14.0186 -14.0186 -13.9613 -13.9613 4.8932 4.8932 5.0176 5.0176 5.6629 5.6629 5.6829 5.6829 5.9284 5.9284 6.2959 6.2959 10.5107 10.5107 12.0412 12.0412 12.8132 12.8132 14.6811 14.6811 15.7036 15.7036 16.0118 16.0118 16.3718 16.3718 17.0583 17.0583 k = 0.0000 0.0000 0.2027 ( 2423 PWs) bands (ev): -47.6739 -47.6739 -47.6327 -47.6327 -21.9789 -21.9789 -21.8422 -21.8422 -14.3938 -14.3938 -14.1647 -14.1647 -14.0195 -14.0195 -13.9652 -13.9652 4.8987 4.8987 5.0201 5.0201 5.6632 5.6632 5.6813 5.6813 5.9225 5.9225 6.3335 6.3335 10.5514 10.5514 12.0424 12.0424 12.8363 12.8363 14.6762 14.6762 15.6500 15.6500 15.9587 15.9587 16.3330 16.3330 17.0928 17.0928 k = 0.0000 0.0000 0.2230 ( 2423 PWs) bands (ev): -47.6733 -47.6733 -47.6327 -47.6327 -21.9793 -21.9793 -21.8440 -21.8440 -14.3933 -14.3933 -14.1694 -14.1694 -14.0206 -14.0206 -13.9694 -13.9694 4.9047 4.9047 5.0228 5.0228 5.6631 5.6631 5.6801 5.6801 5.9160 5.9160 6.3751 6.3751 10.5961 10.5961 12.0438 12.0438 12.8615 12.8615 14.6704 14.6704 15.5981 15.5981 15.9039 15.9039 16.2958 16.2958 17.1123 17.1123 k = 0.0000 0.0000 0.2432 ( 2419 PWs) bands (ev): -47.6728 -47.6728 -47.6326 -47.6326 -21.9796 -21.9796 -21.8460 -21.8460 -14.3927 -14.3927 -14.1743 -14.1743 -14.0219 -14.0219 -13.9737 -13.9737 4.9113 4.9113 5.0255 5.0255 5.6626 5.6626 5.6795 5.6795 5.9090 5.9090 6.4207 6.4207 10.6447 10.6447 12.0455 12.0455 12.8887 12.8887 14.6635 14.6635 15.5480 15.5480 15.8483 15.8483 16.2596 16.2596 17.1190 17.1190 k = 0.0000 0.0000 0.2635 ( 2411 PWs) bands (ev): -47.6722 -47.6722 -47.6325 -47.6325 -21.9799 -21.9799 -21.8481 -21.8481 -14.3920 -14.3920 -14.1795 -14.1795 -14.0236 -14.0236 -13.9783 -13.9783 4.9182 4.9182 5.0283 5.0283 5.6616 5.6616 5.6794 5.6794 5.9015 5.9015 6.4703 6.4703 10.6971 10.6971 12.0474 12.0474 12.9178 12.9178 14.6555 14.6555 15.4996 15.4996 15.7929 15.7929 16.2243 16.2243 17.1140 17.1140 k = 0.0000 0.0000 0.2838 ( 2407 PWs) bands (ev): -47.6715 -47.6715 -47.6325 -47.6325 -21.9802 -21.9802 -21.8504 -21.8504 -14.3914 -14.3914 -14.1848 -14.1848 -14.0258 -14.0258 -13.9829 -13.9829 4.9255 4.9255 5.0311 5.0311 5.6601 5.6601 5.6800 5.6800 5.8933 5.8933 6.5237 6.5237 10.7532 10.7532 12.0496 12.0496 12.9488 12.9488 14.6461 14.6461 15.4531 15.4531 15.7384 15.7384 16.1896 16.1896 17.0958 17.0958 k = 0.0000 0.0000 0.3040 ( 2407 PWs) bands (ev): -47.6708 -47.6708 -47.6324 -47.6324 -21.9806 -21.9806 -21.8529 -21.8529 -14.3907 -14.3907 -14.1904 -14.1904 -14.0285 -14.0285 -13.9877 -13.9877 4.9330 4.9330 5.0337 5.0337 5.6582 5.6582 5.6810 5.6810 5.8846 5.8846 6.5810 6.5810 10.8128 10.8128 12.0521 12.0521 12.9814 12.9814 14.6354 14.6354 15.4084 15.4084 15.6851 15.6851 16.1555 16.1555 17.0627 17.0627 k = 0.0000 0.0000 0.3243 ( 2407 PWs) bands (ev): -47.6701 -47.6701 -47.6323 -47.6323 -21.9810 -21.9810 -21.8555 -21.8555 -14.3900 -14.3900 -14.1962 -14.1962 -14.0318 -14.0318 -13.9923 -13.9923 4.9407 4.9407 5.0363 5.0363 5.6561 5.6561 5.6824 5.6824 5.8754 5.8754 6.6420 6.6420 10.8759 10.8759 12.0550 12.0550 13.0155 13.0155 14.6231 14.6231 15.3655 15.3655 15.6336 15.6336 16.1220 16.1220 17.0161 17.0161 k = 0.0000 0.0000 0.3446 ( 2403 PWs) bands (ev): -47.6693 -47.6693 -47.6322 -47.6322 -21.9814 -21.9814 -21.8581 -21.8581 -14.3894 -14.3894 -14.2021 -14.2021 -14.0357 -14.0357 -13.9967 -13.9967 4.9487 4.9487 5.0387 5.0387 5.6542 5.6542 5.6841 5.6841 5.8657 5.8657 6.7067 6.7067 10.9422 10.9422 12.0583 12.0583 13.0511 13.0511 14.6091 14.6091 15.3241 15.3241 15.5839 15.5839 16.0891 16.0891 16.9599 16.9599 k = 0.0000 0.0000 0.3649 ( 2403 PWs) bands (ev): -47.6685 -47.6685 -47.6321 -47.6321 -21.9819 -21.9819 -21.8609 -21.8609 -14.3887 -14.3887 -14.2081 -14.2081 -14.0403 -14.0403 -14.0010 -14.0010 4.9568 4.9568 5.0410 5.0410 5.6523 5.6523 5.6862 5.6862 5.8555 5.8555 6.7751 6.7751 11.0117 11.0117 12.0620 12.0620 13.0878 13.0878 14.5933 14.5933 15.2842 15.2842 15.5362 15.5362 16.0571 16.0571 16.8970 16.8970 k = 0.0000 0.0000 0.3851 ( 2403 PWs) bands (ev): -47.6677 -47.6677 -47.6320 -47.6320 -21.9824 -21.9824 -21.8639 -21.8639 -14.3881 -14.3881 -14.2142 -14.2142 -14.0457 -14.0457 -14.0051 -14.0051 4.9649 4.9649 5.0431 5.0431 5.6506 5.6506 5.6885 5.6885 5.8450 5.8450 6.8470 6.8470 11.0841 11.0841 12.0662 12.0662 13.1255 13.1255 14.5757 14.5757 15.2455 15.2455 15.4904 15.4904 16.0260 16.0260 16.8295 16.8295 k = 0.0000 0.0000 0.4054 ( 2403 PWs) bands (ev): -47.6668 -47.6668 -47.6319 -47.6319 -21.9829 -21.9829 -21.8670 -21.8670 -14.3875 -14.3875 -14.2203 -14.2203 -14.0517 -14.0517 -14.0090 -14.0090 4.9730 4.9730 5.0449 5.0449 5.6493 5.6493 5.6910 5.6910 5.8341 5.8341 6.9223 6.9223 11.1592 11.1592 12.0710 12.0710 13.1641 13.1641 14.5560 14.5560 15.2080 15.2080 15.4466 15.4466 15.9962 15.9962 16.7591 16.7591 k = 0.0000 0.0000 0.4257 ( 2407 PWs) bands (ev): -47.6659 -47.6659 -47.6318 -47.6318 -21.9835 -21.9835 -21.8702 -21.8702 -14.3870 -14.3870 -14.2264 -14.2264 -14.0583 -14.0583 -14.0127 -14.0127 4.9808 4.9808 5.0464 5.0464 5.6484 5.6484 5.6938 5.6938 5.8227 5.8227 7.0010 7.0010 11.2368 11.2368 12.0764 12.0764 13.2032 13.2032 14.5343 14.5343 15.1713 15.1713 15.4045 15.4045 15.9678 15.9678 16.6869 16.6869 k = 0.0000 0.0000 0.4459 ( 2409 PWs) bands (ev): -47.6650 -47.6650 -47.6317 -47.6317 -21.9840 -21.9840 -21.8735 -21.8735 -14.3866 -14.3866 -14.2324 -14.2324 -14.0654 -14.0654 -14.0164 -14.0164 4.9886 4.9886 5.0477 5.0477 5.6480 5.6480 5.6967 5.6967 5.8112 5.8112 7.0829 7.0829 11.3166 11.3166 12.0825 12.0825 13.2426 13.2426 14.5104 14.5104 15.1353 15.1353 15.3639 15.3639 15.9412 15.9412 16.6139 16.6139 k = 0.0000 0.0000 0.4662 ( 2409 PWs) bands (ev): -47.6641 -47.6641 -47.6316 -47.6316 -21.9846 -21.9846 -21.8769 -21.8769 -14.3863 -14.3863 -14.2384 -14.2384 -14.0730 -14.0730 -14.0199 -14.0199 4.9960 4.9960 5.0487 5.0487 5.6483 5.6483 5.6999 5.6999 5.7994 5.7994 7.1679 7.1679 11.3984 11.3984 12.0894 12.0894 13.2821 13.2821 14.4844 14.4844 15.0997 15.0997 15.3243 15.3243 15.9166 15.9166 16.5410 16.5410 k = 0.0000 0.0000 0.4865 ( 2409 PWs) bands (ev): -47.6631 -47.6631 -47.6315 -47.6315 -21.9851 -21.9851 -21.8804 -21.8804 -14.3860 -14.3860 -14.2442 -14.2442 -14.0810 -14.0810 -14.0234 -14.0234 5.0031 5.0031 5.0494 5.0494 5.6493 5.6493 5.7032 5.7032 5.7874 5.7874 7.2560 7.2560 11.4816 11.4816 12.0972 12.0972 13.3213 13.3213 14.4562 14.4562 15.0643 15.0643 15.2854 15.2854 15.8943 15.8943 16.4694 16.4694 k = 0.0000 0.0000 0.5067 ( 2408 PWs) bands (ev): -47.6621 -47.6621 -47.6314 -47.6314 -21.9857 -21.9857 -21.8839 -21.8839 -14.3858 -14.3858 -14.2499 -14.2499 -14.0894 -14.0894 -14.0270 -14.0270 5.0097 5.0097 5.0498 5.0498 5.6510 5.6510 5.7065 5.7065 5.7754 5.7754 7.3470 7.3470 11.5660 11.5660 12.1060 12.1060 13.3600 13.3600 14.4258 14.4258 15.0290 15.0290 15.2467 15.2467 15.8747 15.8747 16.3999 16.3999 k = 0.0000 0.0000 0.5270 ( 2404 PWs) bands (ev): -47.6611 -47.6611 -47.6313 -47.6313 -21.9862 -21.9862 -21.8875 -21.8875 -14.3858 -14.3858 -14.2553 -14.2553 -14.0980 -14.0980 -14.0306 -14.0306 5.0158 5.0158 5.0499 5.0499 5.6537 5.6537 5.7098 5.7098 5.7635 5.7635 7.4407 7.4407 11.6509 11.6509 12.1161 12.1161 13.3978 13.3978 14.3931 14.3931 14.9936 14.9936 15.2074 15.2074 15.8581 15.8581 16.3337 16.3337 k = 0.0000 0.0000 0.5473 ( 2406 PWs) bands (ev): -47.6600 -47.6600 -47.6312 -47.6312 -21.9868 -21.9868 -21.8912 -21.8912 -14.3861 -14.3861 -14.2606 -14.2606 -14.1069 -14.1069 -14.0342 -14.0342 5.0212 5.0212 5.0496 5.0496 5.6572 5.6572 5.7126 5.7126 5.7522 5.7522 7.5371 7.5371 11.7358 11.7358 12.1276 12.1276 13.4344 13.4344 14.3584 14.3584 14.9581 14.9581 15.1669 15.1669 15.8448 15.8448 16.2717 16.2717 k = 0.0000 0.0000 0.5676 ( 2402 PWs) bands (ev): -47.6590 -47.6590 -47.6311 -47.6311 -21.9874 -21.9874 -21.8949 -21.8949 -14.3865 -14.3865 -14.2655 -14.2655 -14.1158 -14.1158 -14.0379 -14.0379 5.0259 5.0259 5.0491 5.0491 5.6617 5.6617 5.7139 5.7139 5.7425 5.7425 7.6359 7.6359 11.8197 11.8197 12.1409 12.1409 13.4695 13.4695 14.3215 14.3215 14.9227 14.9227 15.1245 15.1245 15.8350 15.8350 16.2151 16.2151 k = 0.0000 0.0000 0.5878 ( 2396 PWs) bands (ev): -47.6579 -47.6579 -47.6309 -47.6309 -21.9879 -21.9879 -21.8985 -21.8985 -14.3872 -14.3872 -14.2702 -14.2702 -14.1250 -14.1250 -14.0417 -14.0417 5.0299 5.0299 5.0484 5.0484 5.6670 5.6670 5.7116 5.7116 5.7369 5.7369 7.7371 7.7371 11.9015 11.9015 12.1568 12.1568 13.5026 13.5026 14.2827 14.2827 14.8875 14.8875 15.0796 15.0796 15.8291 15.8291 16.1648 16.1648 k = 0.0000 0.0000 0.6081 ( 2394 PWs) bands (ev): -47.6568 -47.6568 -47.6308 -47.6308 -21.9885 -21.9885 -21.9023 -21.9023 -14.3881 -14.3881 -14.2745 -14.2745 -14.1342 -14.1342 -14.0456 -14.0456 5.0331 5.0331 5.0472 5.0472 5.6726 5.6726 5.7047 5.7047 5.7366 5.7366 7.8405 7.8405 11.9791 11.9791 12.1764 12.1764 13.5336 13.5336 14.2419 14.2419 14.8530 14.8530 15.0316 15.0316 15.8273 15.8273 16.1218 16.1218 k = 0.0000 0.0000 0.6284 ( 2386 PWs) bands (ev): -47.6557 -47.6557 -47.6307 -47.6307 -21.9891 -21.9891 -21.9060 -21.9060 -14.3893 -14.3893 -14.2783 -14.2783 -14.1435 -14.1435 -14.0496 -14.0496 5.0354 5.0354 5.0459 5.0459 5.6766 5.6766 5.6977 5.6977 5.7393 5.7393 7.9458 7.9458 12.0494 12.0494 12.2023 12.2023 13.5620 13.5620 14.1993 14.1993 14.8198 14.8198 14.9803 14.9803 15.8297 15.8297 16.0867 16.0867 k = 0.0000 0.0000 0.6486 ( 2384 PWs) bands (ev): -47.6546 -47.6546 -47.6306 -47.6306 -21.9897 -21.9897 -21.9098 -21.9098 -14.3909 -14.3909 -14.2818 -14.2818 -14.1529 -14.1529 -14.0538 -14.0538 5.0367 5.0367 5.0444 5.0444 5.6729 5.6729 5.6984 5.6984 5.7432 5.7432 8.0531 8.0531 12.1075 12.1075 12.2384 12.2384 13.5876 13.5876 14.1550 14.1550 14.7885 14.7885 14.9257 14.9257 15.8362 15.8362 16.0602 16.0602 k = 0.0000 0.0000 0.6689 ( 2388 PWs) bands (ev): -47.6535 -47.6535 -47.6304 -47.6304 -21.9903 -21.9903 -21.9137 -21.9137 -14.3927 -14.3927 -14.2849 -14.2849 -14.1625 -14.1625 -14.0580 -14.0580 5.0370 5.0370 5.0426 5.0426 5.6629 5.6629 5.7060 5.7060 5.7476 5.7476 8.1619 8.1619 12.1508 12.1508 12.2860 12.2860 13.6102 13.6102 14.1091 14.1091 14.7599 14.7599 14.8683 14.8683 15.8465 15.8465 16.0427 16.0427 k = 0.0000 0.0000 0.6892 ( 2390 PWs) bands (ev): -47.6524 -47.6524 -47.6303 -47.6303 -21.9909 -21.9909 -21.9176 -21.9176 -14.3949 -14.3949 -14.2876 -14.2876 -14.1719 -14.1719 -14.0624 -14.0624 5.0362 5.0362 5.0409 5.0409 5.6511 5.6511 5.7160 5.7160 5.7525 5.7525 8.2723 8.2723 12.1833 12.1833 12.3403 12.3403 13.6296 13.6296 14.0619 14.0619 14.7336 14.7336 14.8103 14.8103 15.8599 15.8599 16.0347 16.0347 k = 0.0000 0.0000 0.7094 ( 2394 PWs) bands (ev): -47.6513 -47.6513 -47.6302 -47.6302 -21.9916 -21.9916 -21.9214 -21.9214 -14.3974 -14.3974 -14.2899 -14.2899 -14.1813 -14.1813 -14.0669 -14.0669 5.0344 5.0344 5.0391 5.0391 5.6389 5.6389 5.7269 5.7269 5.7581 5.7581 8.3838 8.3838 12.2106 12.2106 12.3941 12.3941 13.6458 13.6458 14.0133 14.0133 14.7037 14.7037 14.7594 14.7594 15.8754 15.8754 16.0371 16.0371 k = 0.0000 0.0000 0.7297 ( 2394 PWs) bands (ev): -47.6502 -47.6502 -47.6301 -47.6301 -21.9923 -21.9923 -21.9252 -21.9252 -14.4000 -14.4000 -14.2918 -14.2918 -14.1907 -14.1907 -14.0714 -14.0714 5.0319 5.0319 5.0372 5.0372 5.6266 5.6266 5.7381 5.7381 5.7647 5.7647 8.4965 8.4965 12.2360 12.2360 12.4431 12.4431 13.6586 13.6586 13.9638 13.9638 14.6549 14.6549 14.7331 14.7331 15.8916 15.8916 16.0505 16.0505 k = 0.0000 0.0000 0.7500 ( 2398 PWs) bands (ev): -47.6491 -47.6491 -47.6300 -47.6300 -21.9929 -21.9929 -21.9291 -21.9291 -14.4030 -14.4030 -14.2933 -14.2933 -14.2000 -14.2000 -14.0760 -14.0760 5.0287 5.0287 5.0349 5.0349 5.6143 5.6143 5.7482 5.7482 5.7733 5.7733 8.6100 8.6100 12.2610 12.2610 12.4845 12.4845 13.6682 13.6682 13.9133 13.9133 14.5923 14.5923 14.7285 14.7285 15.9073 15.9073 16.0751 16.0751 k = 0.0000 0.0000 0.7703 ( 2398 PWs) bands (ev): -47.6480 -47.6480 -47.6299 -47.6299 -21.9935 -21.9935 -21.9329 -21.9329 -14.4060 -14.4060 -14.2946 -14.2946 -14.2090 -14.2090 -14.0806 -14.0806 5.0250 5.0250 5.0323 5.0323 5.6022 5.6022 5.7565 5.7565 5.7847 5.7847 8.7241 8.7241 12.2863 12.2863 12.5165 12.5165 13.6746 13.6746 13.8620 13.8620 14.5259 14.5259 14.7378 14.7378 15.9222 15.9222 16.1105 16.1105 k = 0.0000 0.0000 0.7905 ( 2398 PWs) bands (ev): -47.6469 -47.6469 -47.6297 -47.6297 -21.9941 -21.9941 -21.9366 -21.9366 -14.4093 -14.4093 -14.2956 -14.2956 -14.2179 -14.2179 -14.0853 -14.0853 5.0209 5.0209 5.0295 5.0295 5.5903 5.5903 5.7629 5.7629 5.7988 5.7988 8.8385 8.8385 12.3120 12.3120 12.5383 12.5383 13.6779 13.6779 13.8102 13.8102 14.4587 14.4587 14.7594 14.7594 15.9366 15.9366 16.1553 16.1553 k = 0.0000 0.0000 0.8108 ( 2396 PWs) bands (ev): -47.6459 -47.6459 -47.6296 -47.6296 -21.9946 -21.9946 -21.9403 -21.9403 -14.4126 -14.4126 -14.2965 -14.2965 -14.2264 -14.2264 -14.0901 -14.0901 5.0163 5.0163 5.0266 5.0266 5.5787 5.5787 5.7681 5.7681 5.8146 5.8146 8.9531 8.9531 12.3382 12.3382 12.5495 12.5495 13.6785 13.6785 13.7580 13.7580 14.3923 14.3923 14.7932 14.7932 15.9505 15.9505 16.2084 16.2084 k = 0.0000 0.0000 0.8311 ( 2392 PWs) bands (ev): -47.6448 -47.6448 -47.6295 -47.6295 -21.9951 -21.9951 -21.9439 -21.9439 -14.4159 -14.4159 -14.2975 -14.2975 -14.2345 -14.2345 -14.0949 -14.0949 5.0112 5.0112 5.0236 5.0236 5.5673 5.5673 5.7726 5.7726 5.8316 5.8316 9.0676 9.0676 12.3647 12.3647 12.5501 12.5501 13.6765 13.6765 13.7056 13.7056 14.3276 14.3276 14.8388 14.8388 15.9642 15.9642 16.2687 16.2687 k = 0.0000 0.0000 0.8513 ( 2394 PWs) bands (ev): -47.6438 -47.6438 -47.6294 -47.6294 -21.9957 -21.9957 -21.9475 -21.9475 -14.4192 -14.4192 -14.2987 -14.2987 -14.2421 -14.2421 -14.0998 -14.0998 5.0055 5.0055 5.0205 5.0205 5.5563 5.5563 5.7766 5.7766 5.8495 5.8495 9.1817 9.1817 12.3910 12.3910 12.5409 12.5409 13.6525 13.6525 13.6730 13.6730 14.2657 14.2657 14.8957 14.8957 15.9774 15.9774 16.3354 16.3354 k = 0.0000 0.0000 0.8716 ( 2384 PWs) bands (ev): -47.6427 -47.6427 -47.6293 -47.6293 -21.9963 -21.9963 -21.9508 -21.9508 -14.4226 -14.4226 -14.3003 -14.3003 -14.2487 -14.2487 -14.1045 -14.1045 4.9996 4.9996 5.0176 5.0176 5.5456 5.5456 5.7803 5.7803 5.8680 5.8680 9.2951 9.2951 12.4165 12.4165 12.5232 12.5232 13.6003 13.6003 13.6669 13.6669 14.2075 14.2075 14.9629 14.9629 15.9898 15.9898 16.4077 16.4077 k = 0.0000 0.0000 0.8919 ( 2384 PWs) bands (ev): -47.6417 -47.6417 -47.6292 -47.6292 -21.9968 -21.9968 -21.9542 -21.9542 -14.4258 -14.4258 -14.3026 -14.3026 -14.2545 -14.2545 -14.1094 -14.1094 4.9933 4.9933 5.0146 5.0146 5.5353 5.5353 5.7836 5.7836 5.8869 5.8869 9.4077 9.4077 12.4393 12.4393 12.4995 12.4995 13.5481 13.5481 13.6594 13.6594 14.1539 14.1539 15.0392 15.0392 16.0011 16.0011 16.4851 16.4851 k = 0.0000 0.0000 0.9121 ( 2384 PWs) bands (ev): -47.6408 -47.6408 -47.6290 -47.6290 -21.9973 -21.9973 -21.9576 -21.9576 -14.4289 -14.4289 -14.3057 -14.3057 -14.2592 -14.2592 -14.1143 -14.1143 4.9866 4.9866 5.0116 5.0116 5.5253 5.5253 5.7867 5.7867 5.9062 5.9062 9.5191 9.5191 12.4464 12.4464 12.4832 12.4832 13.4964 13.4964 13.6506 13.6506 14.1061 14.1061 15.1233 15.1233 16.0109 16.0109 16.5670 16.5670 k = 0.0000 0.0000 0.9324 ( 2392 PWs) bands (ev): -47.6398 -47.6398 -47.6290 -47.6290 -21.9980 -21.9980 -21.9608 -21.9608 -14.4320 -14.4320 -14.3099 -14.3099 -14.2625 -14.2625 -14.1192 -14.1192 4.9798 4.9798 5.0086 5.0086 5.5156 5.5156 5.7894 5.7894 5.9255 5.9255 9.6290 9.6290 12.4177 12.4177 12.4951 12.4951 13.4451 13.4451 13.6409 13.6409 14.0650 14.0650 15.2138 15.2138 16.0191 16.0191 16.6531 16.6531 k = 0.0000 0.0000 0.9527 ( 2400 PWs) bands (ev): -47.6389 -47.6389 -47.6289 -47.6289 -21.9986 -21.9986 -21.9640 -21.9640 -14.4350 -14.4350 -14.3150 -14.3150 -14.2647 -14.2647 -14.1241 -14.1241 4.9728 4.9728 5.0057 5.0057 5.5063 5.5063 5.7918 5.7918 5.9448 5.9448 9.7374 9.7374 12.3770 12.3770 12.5114 12.5114 13.3946 13.3946 13.6305 13.6305 14.0320 14.0320 15.3092 15.3092 16.0255 16.0255 16.7428 16.7428 k = 0.0000 0.0000 0.9730 ( 2404 PWs) bands (ev): -47.6380 -47.6380 -47.6288 -47.6288 -21.9992 -21.9992 -21.9671 -21.9671 -14.4377 -14.4377 -14.3209 -14.3209 -14.2657 -14.2657 -14.1290 -14.1290 4.9657 4.9657 5.0029 5.0029 5.4975 5.4975 5.7941 5.7941 5.9642 5.9642 9.8438 9.8438 12.3321 12.3321 12.5247 12.5247 13.3450 13.3450 13.6195 13.6195 14.0081 14.0081 15.4080 15.4080 16.0302 16.0302 16.8359 16.8359 k = 0.0000 0.0000 0.9932 ( 2404 PWs) bands (ev): -47.6371 -47.6371 -47.6287 -47.6287 -21.9997 -21.9997 -21.9700 -21.9700 -14.4401 -14.4401 -14.3272 -14.3272 -14.2658 -14.2658 -14.1339 -14.1339 4.9587 4.9587 5.0002 5.0002 5.4891 5.4891 5.7962 5.7962 5.9834 5.9834 9.9481 9.9481 12.2848 12.2848 12.5332 12.5332 13.2963 13.2963 13.6080 13.6080 13.9944 13.9944 15.5081 15.5081 16.0340 16.0340 16.9318 16.9318 k = 0.0000 0.0000 1.0135 ( 2408 PWs) bands (ev): -47.6363 -47.6363 -47.6286 -47.6286 -22.0001 -22.0001 -21.9730 -21.9730 -14.4424 -14.4424 -14.3339 -14.3339 -14.2654 -14.2654 -14.1388 -14.1388 4.9518 4.9518 4.9975 4.9975 5.4811 5.4811 5.7981 5.7981 6.0024 6.0024 10.0501 10.0501 12.2362 12.2362 12.5360 12.5360 13.2489 13.2489 13.5963 13.5963 13.9916 13.9916 15.6067 15.6067 16.0387 16.0387 17.0303 17.0303 k = 0.0000 0.0000 1.0338 ( 2416 PWs) bands (ev): -47.6355 -47.6355 -47.6285 -47.6285 -22.0007 -22.0007 -21.9757 -21.9757 -14.4444 -14.4444 -14.3407 -14.3407 -14.2645 -14.2645 -14.1437 -14.1437 4.9449 4.9449 4.9949 4.9949 5.4736 5.4736 5.7997 5.7997 6.0210 6.0210 10.1496 10.1496 12.1872 12.1872 12.5325 12.5325 13.2029 13.2029 13.5844 13.5844 14.0003 14.0003 15.6988 15.6988 16.0482 16.0482 17.1308 17.1308 k = 0.0000 0.0000 1.0540 ( 2416 PWs) bands (ev): -47.6348 -47.6348 -47.6284 -47.6284 -22.0011 -22.0011 -21.9783 -21.9783 -14.4462 -14.4462 -14.3476 -14.3476 -14.2632 -14.2632 -14.1484 -14.1484 4.9382 4.9382 4.9925 4.9925 5.4665 5.4665 5.8012 5.8012 6.0392 6.0392 10.2464 10.2464 12.1383 12.1383 12.5226 12.5226 13.1584 13.1584 13.5724 13.5724 14.0205 14.0205 15.7755 15.7755 16.0708 16.0708 17.2329 17.2329 k = 0.0000 0.0000 1.0743 ( 2414 PWs) bands (ev): -47.6340 -47.6340 -47.6284 -47.6284 -22.0015 -22.0015 -21.9806 -21.9806 -14.4476 -14.4476 -14.3544 -14.3544 -14.2617 -14.2617 -14.1531 -14.1531 4.9317 4.9317 4.9903 4.9903 5.4599 5.4599 5.8026 5.8026 6.0568 6.0568 10.3404 10.3404 12.0902 12.0902 12.5063 12.5063 13.1157 13.1157 13.5605 13.5605 14.0518 14.0518 15.8248 15.8248 16.1177 16.1177 17.3361 17.3361 k = 0.0000 0.0000 1.0946 ( 2414 PWs) bands (ev): -47.6333 -47.6333 -47.6283 -47.6283 -22.0019 -22.0019 -21.9829 -21.9829 -14.4488 -14.4488 -14.3612 -14.3612 -14.2599 -14.2599 -14.1577 -14.1577 4.9253 4.9253 4.9882 4.9882 5.4538 5.4538 5.8038 5.8038 6.0738 6.0738 10.4314 10.4314 12.0435 12.0435 12.4842 12.4842 13.0749 13.0749 13.5488 13.5488 14.0935 14.0935 15.8436 15.8436 16.1913 16.1913 17.4398 17.4398 k = 0.0000 0.0000 1.1148 ( 2414 PWs) bands (ev): -47.6327 -47.6327 -47.6282 -47.6282 -22.0022 -22.0022 -21.9851 -21.9851 -14.4497 -14.4497 -14.3678 -14.3678 -14.2579 -14.2579 -14.1623 -14.1623 4.9193 4.9193 4.9862 4.9862 5.4481 5.4481 5.8048 5.8048 6.0900 6.0900 10.5192 10.5192 11.9985 11.9985 12.4570 12.4570 13.0362 13.0362 13.5374 13.5374 14.1445 14.1445 15.8410 15.8410 16.2822 16.2822 17.5432 17.5432 k = 0.0000 0.0000 1.1351 ( 2408 PWs) bands (ev): -47.6321 -47.6321 -47.6282 -47.6282 -22.0025 -22.0025 -21.9870 -21.9870 -14.4503 -14.4503 -14.3743 -14.3743 -14.2557 -14.2557 -14.1667 -14.1667 4.9136 4.9136 4.9844 4.9844 5.4429 5.4429 5.8057 5.8057 6.1055 6.1055 10.6038 10.6038 11.9556 11.9556 12.4254 12.4254 12.9999 12.9999 13.5265 13.5265 14.2035 14.2035 15.8256 15.8256 16.3810 16.3810 17.6454 17.6454 k = 0.0000 0.0000 1.1554 ( 2408 PWs) bands (ev): -47.6315 -47.6315 -47.6281 -47.6281 -22.0028 -22.0028 -21.9889 -21.9889 -14.4506 -14.4506 -14.3806 -14.3806 -14.2534 -14.2534 -14.1711 -14.1711 4.9082 4.9082 4.9827 4.9827 5.4381 5.4381 5.8065 5.8065 6.1200 6.1200 10.6849 10.6849 11.9151 11.9151 12.3903 12.3903 12.9659 12.9659 13.5161 13.5161 14.2693 14.2693 15.8023 15.8023 16.4823 16.4823 17.7453 17.7453 k = 0.0000 0.0000 1.1757 ( 2412 PWs) bands (ev): -47.6310 -47.6310 -47.6280 -47.6280 -22.0031 -22.0031 -21.9907 -21.9907 -14.4507 -14.4507 -14.3867 -14.3867 -14.2511 -14.2511 -14.1755 -14.1755 4.9032 4.9032 4.9812 4.9812 5.4337 5.4337 5.8071 5.8071 6.1334 6.1334 10.7624 10.7624 11.8773 11.8773 12.3526 12.3526 12.9345 12.9345 13.5064 13.5064 14.3406 14.3406 15.7734 15.7734 16.5834 16.5834 17.8411 17.8411 k = 0.0000 0.0000 1.1959 ( 2412 PWs) bands (ev): -47.6306 -47.6306 -47.6280 -47.6280 -22.0032 -22.0032 -21.9924 -21.9924 -14.4504 -14.4504 -14.3926 -14.3926 -14.2486 -14.2486 -14.1796 -14.1796 4.8985 4.8985 4.9798 4.9798 5.4298 5.4298 5.8077 5.8077 6.1460 6.1460 10.8361 10.8361 11.8425 11.8425 12.3132 12.3132 12.9057 12.9057 13.4975 13.4975 14.4160 14.4160 15.7401 15.7401 16.6821 16.6821 17.9307 17.9307 k = 0.0000 0.0000 1.2162 ( 2422 PWs) bands (ev): -47.6302 -47.6302 -47.6280 -47.6280 -22.0036 -22.0036 -21.9939 -21.9939 -14.4499 -14.4499 -14.3983 -14.3983 -14.2461 -14.2461 -14.1838 -14.1838 4.8942 4.8942 4.9784 4.9784 5.4261 5.4261 5.8080 5.8080 6.1573 6.1573 10.9056 10.9056 11.8108 11.8108 12.2730 12.2730 12.8798 12.8798 13.4893 13.4893 14.4941 14.4941 15.7033 15.7033 16.7769 16.7769 18.0116 18.0116 k = 0.0000 0.0000 1.2365 ( 2422 PWs) bands (ev): -47.6298 -47.6298 -47.6279 -47.6279 -22.0037 -22.0037 -21.9952 -21.9952 -14.4490 -14.4490 -14.4037 -14.4037 -14.2435 -14.2435 -14.1878 -14.1878 4.8904 4.8904 4.9773 4.9773 5.4230 5.4230 5.8084 5.8084 6.1675 6.1675 10.9705 10.9705 11.7825 11.7825 12.2328 12.2328 12.8567 12.8567 13.4819 13.4819 14.5736 14.5736 15.6634 15.6634 16.8665 16.8665 18.0812 18.0812 k = 0.0000 0.0000 1.2567 ( 2430 PWs) bands (ev): -47.6295 -47.6295 -47.6279 -47.6279 -22.0040 -22.0040 -21.9964 -21.9964 -14.4478 -14.4478 -14.4089 -14.4089 -14.2410 -14.2410 -14.1916 -14.1916 4.8870 4.8870 4.9762 4.9762 5.4203 5.4203 5.8087 5.8087 6.1764 6.1764 11.0302 11.0302 11.7577 11.7577 12.1938 12.1938 12.8365 12.8365 13.4755 13.4755 14.6529 14.6529 15.6211 15.6211 16.9494 16.9494 18.1376 18.1376 k = 0.0000 0.0000 1.2770 ( 2430 PWs) bands (ev): -47.6292 -47.6292 -47.6278 -47.6278 -22.0041 -22.0041 -21.9974 -21.9974 -14.4463 -14.4463 -14.4137 -14.4137 -14.2384 -14.2384 -14.1951 -14.1951 4.8841 4.8841 4.9754 4.9754 5.4180 5.4180 5.8090 5.8090 6.1840 6.1840 11.0841 11.0841 11.7364 11.7364 12.1569 12.1569 12.8193 12.8193 13.4700 13.4700 14.7304 14.7304 15.5770 15.5770 17.0239 17.0239 18.1810 18.1810 k = 0.0000 0.0000 1.2973 ( 2430 PWs) bands (ev): -47.6290 -47.6290 -47.6278 -47.6278 -22.0042 -22.0042 -21.9982 -21.9982 -14.4445 -14.4445 -14.4183 -14.4183 -14.2359 -14.2359 -14.1984 -14.1984 4.8818 4.8818 4.9747 4.9747 5.4161 5.4161 5.8092 5.8092 6.1904 6.1904 11.1310 11.1310 11.7189 11.7189 12.1235 12.1235 12.8051 12.8051 13.4655 13.4655 14.8041 14.8041 15.5323 15.5323 17.0885 17.0885 18.2135 18.2135 k = 0.0000 0.0000 1.3175 ( 2430 PWs) bands (ev): -47.6288 -47.6288 -47.6278 -47.6278 -22.0043 -22.0043 -21.9988 -21.9988 -14.4424 -14.4424 -14.4225 -14.4225 -14.2337 -14.2337 -14.2013 -14.2013 4.8800 4.8800 4.9742 4.9742 5.4147 5.4147 5.8094 5.8094 6.1953 6.1953 11.1697 11.1697 11.7052 11.7052 12.0951 12.0951 12.7941 12.7941 13.4619 13.4619 14.8710 14.8710 15.4888 15.4888 17.1413 17.1413 18.2386 18.2386 k = 0.0000 0.0000 1.3378 ( 2434 PWs) bands (ev): -47.6287 -47.6287 -47.6278 -47.6278 -22.0044 -22.0044 -21.9993 -21.9993 -14.4400 -14.4400 -14.4265 -14.4265 -14.2318 -14.2318 -14.2037 -14.2037 4.8787 4.8787 4.9738 4.9738 5.4137 5.4137 5.8094 5.8094 6.1988 6.1988 11.1988 11.1988 11.6953 11.6953 12.0732 12.0732 12.7862 12.7862 13.4593 13.4593 14.9270 14.9270 15.4502 15.4502 17.1806 17.1806 18.2599 18.2599 k = 0.0000 0.0000 1.3581 ( 2434 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9995 -21.9995 -14.4374 -14.4374 -14.4299 -14.4299 -14.2305 -14.2305 -14.2053 -14.2053 4.8779 4.8779 4.9736 4.9736 5.4131 5.4131 5.8095 5.8095 6.2009 6.2009 11.2170 11.2170 11.6894 11.6894 12.0593 12.0593 12.7814 12.7814 13.4578 13.4578 14.9658 14.9658 15.4221 15.4221 17.2049 17.2049 18.2798 18.2798 k = 0.0000 0.0000 1.3784 ( 2438 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9996 -21.9996 -14.4357 -14.4357 -14.4320 -14.4320 -14.2300 -14.2300 -14.2059 -14.2059 4.8776 4.8776 4.9735 4.9735 5.4129 5.4129 5.8095 5.8095 6.2015 6.2015 11.2232 11.2232 11.6874 11.6874 12.0546 12.0546 12.7798 12.7798 13.4573 13.4573 14.9799 14.9799 15.4115 15.4115 17.2132 17.2132 18.2955 18.2955 k = 0.0000 0.0000 1.3784 ( 2438 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9996 -21.9996 -14.4357 -14.4357 -14.4320 -14.4320 -14.2300 -14.2300 -14.2059 -14.2059 4.8776 4.8776 4.9735 4.9735 5.4129 5.4129 5.8095 5.8095 6.2015 6.2015 11.2232 11.2232 11.6874 11.6874 12.0546 12.0546 12.7798 12.7798 13.4573 13.4573 14.9799 14.9799 15.4115 15.4115 17.2132 17.2132 18.2955 18.2955 k =-0.0063 0.0162 1.3784 ( 2432 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0044 -22.0044 -21.9996 -21.9996 -14.4370 -14.4370 -14.4304 -14.4304 -14.2302 -14.2302 -14.2056 -14.2056 4.8779 4.8779 4.9736 4.9736 5.4131 5.4131 5.8095 5.8095 6.2011 6.2011 11.2233 11.2233 11.6879 11.6879 12.0558 12.0558 12.7736 12.7736 13.4564 13.4564 14.9787 14.9787 15.4181 15.4181 17.2123 17.2123 18.2914 18.2914 k =-0.0126 0.0324 1.3784 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6279 -47.6279 -22.0041 -22.0041 -21.9996 -21.9996 -14.4391 -14.4391 -14.4276 -14.4276 -14.2308 -14.2308 -14.2048 -14.2048 4.8786 4.8786 4.9738 4.9738 5.4136 5.4136 5.8095 5.8095 6.1995 6.1995 11.2235 11.2235 11.6894 11.6894 12.0597 12.0597 12.7551 12.7551 13.4538 13.4538 14.9750 14.9750 15.4374 15.4374 17.2099 17.2099 18.2837 18.2837 k =-0.0189 0.0487 1.3784 ( 2426 PWs) bands (ev): -47.6286 -47.6286 -47.6279 -47.6279 -22.0038 -22.0038 -21.9995 -21.9995 -14.4411 -14.4411 -14.4243 -14.4243 -14.2318 -14.2318 -14.2034 -14.2034 4.8797 4.8797 4.9743 4.9743 5.4145 5.4145 5.8095 5.8095 6.1970 6.1970 11.2236 11.2236 11.6918 11.6918 12.0660 12.0660 12.7254 12.7254 13.4494 13.4494 14.9690 14.9690 15.4683 15.4683 17.2058 17.2058 18.2740 18.2740 k =-0.0253 0.0649 1.3784 ( 2426 PWs) bands (ev): -47.6286 -47.6286 -47.6281 -47.6281 -22.0033 -22.0033 -21.9994 -21.9994 -14.4430 -14.4430 -14.4208 -14.4208 -14.2330 -14.2330 -14.2018 -14.2018 4.8813 4.8813 4.9748 4.9748 5.4158 5.4158 5.8094 5.8094 6.1934 6.1934 11.2235 11.2235 11.6951 11.6951 12.0749 12.0749 12.6857 12.6857 13.4434 13.4434 14.9609 14.9609 15.5094 15.5094 17.2000 17.2000 18.2614 18.2614 k =-0.0316 0.0811 1.3784 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6282 -47.6282 -22.0028 -22.0028 -21.9993 -21.9993 -14.4447 -14.4447 -14.4171 -14.4171 -14.2345 -14.2345 -14.1998 -14.1998 4.8834 4.8834 4.9754 4.9754 5.4173 5.4173 5.8092 5.8092 6.1887 6.1887 11.2226 11.2226 11.6992 11.6992 12.0863 12.0863 12.6377 12.6377 13.4359 13.4359 14.9510 14.9510 15.5587 15.5587 17.1925 17.1925 18.2444 18.2444 k =-0.0379 0.0973 1.3784 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6285 -47.6285 -22.0022 -22.0022 -21.9992 -21.9992 -14.4462 -14.4462 -14.4132 -14.4132 -14.2361 -14.2361 -14.1976 -14.1976 4.8858 4.8858 4.9763 4.9763 5.4193 5.4193 5.8091 5.8091 6.1830 6.1830 11.2205 11.2205 11.7040 11.7040 12.1002 12.1002 12.5836 12.5836 13.4269 13.4269 14.9393 14.9393 15.6144 15.6144 17.1832 17.1832 18.2211 18.2211 k =-0.0379 0.0973 1.3784 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6285 -47.6285 -22.0022 -22.0022 -21.9992 -21.9992 -14.4462 -14.4462 -14.4132 -14.4132 -14.2361 -14.2361 -14.1976 -14.1976 4.8858 4.8858 4.9763 4.9763 5.4193 5.4193 5.8091 5.8091 6.1830 6.1830 11.2205 11.2205 11.7040 11.7040 12.1002 12.1002 12.5836 12.5836 13.4269 13.4269 14.9393 14.9393 15.6144 15.6144 17.1832 17.1832 18.2211 18.2211 k =-0.0430 0.1105 1.3642 ( 2428 PWs) bands (ev): -47.6287 -47.6287 -47.6286 -47.6286 -22.0015 -22.0015 -21.9991 -21.9991 -14.4472 -14.4472 -14.4096 -14.4096 -14.2375 -14.2375 -14.1955 -14.1955 4.8883 4.8883 4.9771 4.9771 5.4212 5.4212 5.8090 5.8090 6.1774 6.1774 11.2149 11.2149 11.7093 11.7093 12.1153 12.1153 12.5367 12.5367 13.4188 13.4188 14.9248 14.9248 15.6649 15.6649 17.1707 17.1707 18.1926 18.1926 k =-0.0482 0.1237 1.3500 ( 2432 PWs) bands (ev): -47.6289 -47.6289 -47.6287 -47.6287 -22.0007 -22.0007 -21.9989 -21.9989 -14.4482 -14.4482 -14.4056 -14.4056 -14.2392 -14.2392 -14.1930 -14.1930 4.8912 4.8912 4.9780 4.9780 5.4235 5.4235 5.8087 5.8087 6.1704 6.1704 11.2029 11.2029 11.7169 11.7169 12.1359 12.1359 12.4885 12.4885 13.4101 13.4101 14.9036 14.9036 15.7196 15.7196 17.1503 17.1503 18.1507 18.1507 k =-0.0533 0.1369 1.3359 ( 2430 PWs) bands (ev): -47.6291 -47.6291 -47.6288 -47.6288 -21.9999 -21.9999 -21.9985 -21.9985 -14.4491 -14.4491 -14.4012 -14.4012 -14.2409 -14.2409 -14.1902 -14.1902 4.8946 4.8946 4.9792 4.9792 5.4263 5.4263 5.8085 5.8085 6.1622 6.1622 11.1851 11.1851 11.7267 11.7267 12.1611 12.1611 12.4397 12.4397 13.4009 13.4009 14.8776 14.8776 15.7753 15.7753 17.1225 17.1225 18.0946 18.0946 k =-0.0584 0.1501 1.3217 ( 2432 PWs) bands (ev): -47.6294 -47.6294 -47.6289 -47.6289 -21.9990 -21.9990 -21.9981 -21.9981 -14.4498 -14.4498 -14.3965 -14.3965 -14.2427 -14.2427 -14.1871 -14.1871 4.8985 4.8985 4.9804 4.9804 5.4294 5.4294 5.8082 5.8082 6.1528 6.1528 11.1622 11.1622 11.7386 11.7386 12.1890 12.1890 12.3916 12.3916 13.3911 13.3911 14.8485 14.8485 15.8296 15.8296 17.0882 17.0882 18.0248 18.0248 k =-0.0636 0.1633 1.3076 ( 2428 PWs) bands (ev): -47.6297 -47.6297 -47.6291 -47.6291 -21.9980 -21.9980 -21.9975 -21.9975 -14.4502 -14.4502 -14.3915 -14.3915 -14.2443 -14.2443 -14.1837 -14.1837 4.9028 4.9028 4.9818 4.9818 5.4331 5.4331 5.8078 5.8078 6.1424 6.1424 11.1348 11.1348 11.7525 11.7525 12.2157 12.2157 12.3481 12.3481 13.3806 13.3806 14.8175 14.8175 15.8803 15.8803 17.0480 17.0480 17.9435 17.9435 k =-0.0687 0.1765 1.2934 ( 2426 PWs) bands (ev): -47.6300 -47.6300 -47.6292 -47.6292 -21.9971 -21.9971 -21.9967 -21.9967 -14.4505 -14.4505 -14.3864 -14.3864 -14.2459 -14.2459 -14.1802 -14.1802 4.9075 4.9075 4.9832 4.9832 5.4371 5.4371 5.8073 5.8073 6.1310 6.1310 11.1036 11.1036 11.7682 11.7682 12.2256 12.2256 12.3242 12.3242 13.3694 13.3694 14.7853 14.7853 15.9257 15.9257 17.0025 17.0025 17.8538 17.8538 k =-0.0738 0.1897 1.2793 ( 2428 PWs) bands (ev): -47.6303 -47.6303 -47.6294 -47.6294 -21.9964 -21.9964 -21.9957 -21.9957 -14.4506 -14.4506 -14.3812 -14.3812 -14.2474 -14.2474 -14.1765 -14.1765 4.9124 4.9124 4.9847 4.9847 5.4415 5.4415 5.8066 5.8066 6.1185 6.1185 11.0691 11.0691 11.7857 11.7857 12.1988 12.1988 12.3394 12.3394 13.3574 13.3574 14.7526 14.7526 15.9644 15.9644 16.9526 16.9526 17.7588 17.7588 k =-0.0790 0.2028 1.2651 ( 2428 PWs) bands (ev): -47.6307 -47.6307 -47.6296 -47.6296 -21.9956 -21.9956 -21.9944 -21.9944 -14.4506 -14.4506 -14.3759 -14.3759 -14.2486 -14.2486 -14.1727 -14.1727 4.9177 4.9177 4.9863 4.9863 5.4462 5.4462 5.8058 5.8058 6.1053 6.1053 11.0320 11.0320 11.8047 11.8047 12.1533 12.1533 12.3754 12.3754 13.3446 13.3446 14.7200 14.7200 15.9954 15.9954 16.8985 16.8985 17.6611 17.6611 k =-0.0841 0.2160 1.2510 ( 2428 PWs) bands (ev): -47.6311 -47.6311 -47.6298 -47.6298 -21.9948 -21.9948 -21.9931 -21.9931 -14.4503 -14.4503 -14.3707 -14.3707 -14.2494 -14.2494 -14.1687 -14.1687 4.9233 4.9233 4.9880 4.9880 5.4514 5.4514 5.8048 5.8048 6.0913 6.0913 10.9928 10.9928 11.8250 11.8250 12.1026 12.1026 12.4186 12.4186 13.3310 13.3310 14.6877 14.6877 16.0178 16.0178 16.8409 16.8409 17.5630 17.5630 k =-0.0892 0.2292 1.2368 ( 2425 PWs) bands (ev): -47.6315 -47.6315 -47.6301 -47.6301 -21.9939 -21.9939 -21.9918 -21.9918 -14.4499 -14.4499 -14.3657 -14.3657 -14.2499 -14.2499 -14.1646 -14.1646 4.9290 4.9290 4.9897 4.9897 5.4569 5.4569 5.8036 5.8036 6.0769 6.0769 10.9517 10.9517 11.8462 11.8462 12.0501 12.0501 12.4652 12.4652 13.3165 13.3165 14.6561 14.6561 16.0312 16.0312 16.7803 16.7803 17.4664 17.4664 k =-0.0944 0.2424 1.2227 ( 2423 PWs) bands (ev): -47.6319 -47.6319 -47.6303 -47.6303 -21.9929 -21.9929 -21.9903 -21.9903 -14.4493 -14.4493 -14.3609 -14.3609 -14.2498 -14.2498 -14.1603 -14.1603 4.9348 4.9348 4.9916 4.9916 5.4628 5.4628 5.8022 5.8022 6.0620 6.0620 10.9093 10.9093 11.8675 11.8675 11.9975 11.9975 12.5140 12.5140 13.3012 13.3012 14.6255 14.6255 16.0355 16.0355 16.7170 16.7170 17.3725 17.3725 k =-0.0995 0.2556 1.2085 ( 2417 PWs) bands (ev): -47.6323 -47.6323 -47.6306 -47.6306 -21.9919 -21.9919 -21.9887 -21.9887 -14.4486 -14.4486 -14.3564 -14.3564 -14.2491 -14.2491 -14.1560 -14.1560 4.9408 4.9408 4.9934 4.9934 5.4691 5.4691 5.8003 5.8003 6.0468 6.0468 10.8658 10.8658 11.8853 11.8853 11.9485 11.9485 12.5646 12.5646 13.2852 13.2852 14.5960 14.5960 16.0310 16.0310 16.6517 16.6517 17.2825 17.2825 k =-0.1046 0.2688 1.1943 ( 2415 PWs) bands (ev): -47.6327 -47.6327 -47.6309 -47.6309 -21.9909 -21.9909 -21.9872 -21.9872 -14.4477 -14.4477 -14.3525 -14.3525 -14.2477 -14.2477 -14.1515 -14.1515 4.9465 4.9465 4.9954 4.9954 5.4756 5.4756 5.7981 5.7981 6.0316 6.0316 10.8214 10.8214 11.8721 11.8721 11.9304 11.9304 12.6164 12.6164 13.2687 13.2687 14.5677 14.5677 16.0181 16.0181 16.5849 16.5849 17.1968 17.1968 k =-0.1098 0.2820 1.1802 ( 2418 PWs) bands (ev): -47.6332 -47.6332 -47.6312 -47.6312 -21.9898 -21.9898 -21.9857 -21.9857 -14.4468 -14.4468 -14.3491 -14.3491 -14.2456 -14.2456 -14.1470 -14.1470 4.9521 4.9521 4.9973 4.9973 5.4824 5.4824 5.7954 5.7954 6.0165 6.0165 10.7765 10.7765 11.8237 11.8237 11.9475 11.9475 12.6692 12.6692 13.2518 13.2518 14.5408 14.5408 15.9978 15.9978 16.5172 16.5172 17.1160 17.1160 k =-0.1149 0.2952 1.1660 ( 2418 PWs) bands (ev): -47.6336 -47.6336 -47.6315 -47.6315 -21.9887 -21.9887 -21.9841 -21.9841 -14.4457 -14.4457 -14.3464 -14.3464 -14.2426 -14.2426 -14.1424 -14.1424 4.9574 4.9574 4.9994 4.9994 5.4894 5.4894 5.7922 5.7922 6.0018 6.0018 10.7311 10.7311 11.7701 11.7701 11.9692 11.9692 12.7228 12.7228 13.2349 13.2349 14.5153 14.5153 15.9709 15.9709 16.4492 16.4492 17.0400 17.0400 k =-0.1200 0.3084 1.1519 ( 2424 PWs) bands (ev): -47.6341 -47.6341 -47.6319 -47.6319 -21.9876 -21.9876 -21.9826 -21.9826 -14.4446 -14.4446 -14.3445 -14.3445 -14.2389 -14.2389 -14.1378 -14.1378 4.9622 4.9622 5.0016 5.0016 5.4966 5.4966 5.7883 5.7883 5.9876 5.9876 10.6854 10.6854 11.7156 11.7156 11.9909 11.9909 12.7771 12.7771 13.2183 13.2183 14.4911 14.4911 15.9386 15.9386 16.3817 16.3817 16.9689 16.9689 k =-0.1252 0.3216 1.1377 ( 2420 PWs) bands (ev): -47.6346 -47.6346 -47.6322 -47.6322 -21.9863 -21.9863 -21.9809 -21.9809 -14.4434 -14.4434 -14.3431 -14.3431 -14.2342 -14.2342 -14.1330 -14.1330 4.9666 4.9666 5.0040 5.0040 5.5041 5.5041 5.7838 5.7838 5.9743 5.9743 10.6395 10.6395 11.6612 11.6612 12.0115 12.0115 12.8317 12.8317 13.2026 13.2026 14.4683 14.4683 15.9021 15.9021 16.3154 16.3154 16.9023 16.9023 k =-0.1303 0.3347 1.1236 ( 2418 PWs) bands (ev): -47.6351 -47.6351 -47.6326 -47.6326 -21.9850 -21.9850 -21.9793 -21.9793 -14.4421 -14.4421 -14.3424 -14.3424 -14.2288 -14.2288 -14.1281 -14.1281 4.9705 4.9705 5.0065 5.0065 5.5117 5.5117 5.7786 5.7786 5.9620 5.9620 10.5936 10.5936 11.6070 11.6070 12.0301 12.0301 12.8865 12.8865 13.1884 13.1884 14.4469 14.4469 15.8625 15.8625 16.2507 16.2507 16.8401 16.8401 k =-0.1354 0.3479 1.1094 ( 2412 PWs) bands (ev): -47.6355 -47.6355 -47.6329 -47.6329 -21.9838 -21.9838 -21.9775 -21.9775 -14.4407 -14.4407 -14.3422 -14.3422 -14.2228 -14.2228 -14.1233 -14.1233 4.9737 4.9737 5.0091 5.0091 5.5195 5.5195 5.7727 5.7727 5.9509 5.9509 10.5477 10.5477 11.5535 11.5535 12.0461 12.0461 12.9411 12.9411 13.1763 13.1763 14.4266 14.4266 15.8210 15.8210 16.1882 16.1882 16.7820 16.7820 k =-0.1406 0.3611 1.0953 ( 2408 PWs) bands (ev): -47.6360 -47.6360 -47.6333 -47.6333 -21.9825 -21.9825 -21.9758 -21.9758 -14.4393 -14.4393 -14.3426 -14.3426 -14.2161 -14.2161 -14.1184 -14.1184 4.9763 4.9763 5.0118 5.0118 5.5273 5.5273 5.7661 5.7661 5.9411 5.9411 10.5019 10.5019 11.5008 11.5008 12.0588 12.0588 12.9952 12.9952 13.1674 13.1674 14.4076 14.4076 15.7784 15.7784 16.1285 16.1285 16.7276 16.7276 k =-0.1457 0.3743 1.0811 ( 2408 PWs) bands (ev): -47.6365 -47.6365 -47.6336 -47.6336 -21.9812 -21.9812 -21.9742 -21.9742 -14.4378 -14.4378 -14.3434 -14.3434 -14.2090 -14.2090 -14.1135 -14.1135 4.9783 4.9783 5.0142 5.0142 5.5350 5.5350 5.7589 5.7589 5.9326 5.9326 10.4562 10.4562 11.4492 11.4492 12.0675 12.0675 13.0477 13.0477 13.1628 13.1628 14.3898 14.3898 15.7357 15.7357 16.0718 16.0718 16.6766 16.6766 k =-0.1508 0.3875 1.0670 ( 2408 PWs) bands (ev): -47.6370 -47.6370 -47.6340 -47.6340 -21.9799 -21.9799 -21.9725 -21.9725 -14.4364 -14.4364 -14.3446 -14.3446 -14.2016 -14.2016 -14.1087 -14.1087 4.9797 4.9797 5.0165 5.0165 5.5427 5.5427 5.7512 5.7512 5.9254 5.9254 10.4108 10.4108 11.3988 11.3988 12.0719 12.0719 13.0961 13.0961 13.1657 13.1657 14.3731 14.3731 15.6935 15.6935 16.0186 16.0186 16.6287 16.6287 k =-0.1560 0.4007 1.0528 ( 2408 PWs) bands (ev): -47.6375 -47.6375 -47.6344 -47.6344 -21.9787 -21.9787 -21.9709 -21.9709 -14.4349 -14.4349 -14.3461 -14.3461 -14.1938 -14.1938 -14.1039 -14.1039 4.9807 4.9807 5.0184 5.0184 5.5502 5.5502 5.7434 5.7434 5.9195 5.9195 10.3657 10.3657 11.3499 11.3499 12.0715 12.0715 13.1310 13.1310 13.1854 13.1854 14.3577 14.3577 15.6524 15.6524 15.9691 15.9691 16.5837 16.5837 k =-0.1611 0.4139 1.0386 ( 2404 PWs) bands (ev): -47.6379 -47.6379 -47.6347 -47.6347 -21.9774 -21.9774 -21.9692 -21.9692 -14.4333 -14.4333 -14.3477 -14.3477 -14.1858 -14.1858 -14.0992 -14.0992 4.9812 4.9812 5.0198 5.0198 5.5575 5.5575 5.7356 5.7356 5.9148 5.9148 10.3211 10.3211 11.3026 11.3026 12.0662 12.0662 13.1489 13.1489 13.2255 13.2255 14.3435 14.3435 15.6127 15.6127 15.9236 15.9236 16.5412 16.5412 k =-0.1662 0.4271 1.0245 ( 2404 PWs) bands (ev): -47.6384 -47.6384 -47.6351 -47.6351 -21.9762 -21.9762 -21.9676 -21.9676 -14.4318 -14.4318 -14.3496 -14.3496 -14.1778 -14.1778 -14.0945 -14.0945 4.9815 4.9815 5.0207 5.0207 5.5646 5.5646 5.7280 5.7280 5.9111 5.9111 10.2769 10.2769 11.2572 11.2572 12.0561 12.0561 13.1630 13.1630 13.2723 13.2723 14.3308 14.3308 15.5746 15.5746 15.8823 15.8823 16.5011 16.5011 k =-0.1714 0.4403 1.0103 ( 2403 PWs) bands (ev): -47.6388 -47.6388 -47.6355 -47.6355 -21.9749 -21.9749 -21.9661 -21.9661 -14.4303 -14.4303 -14.3516 -14.3516 -14.1697 -14.1697 -14.0900 -14.0900 4.9814 4.9814 5.0209 5.0209 5.5713 5.5713 5.7209 5.7209 5.9084 5.9084 10.2333 10.2333 11.2137 11.2137 12.0415 12.0415 13.1792 13.1792 13.3194 13.3194 14.3198 14.3198 15.5384 15.5384 15.8452 15.8452 16.4630 16.4630 k =-0.1765 0.4535 0.9962 ( 2403 PWs) bands (ev): -47.6393 -47.6393 -47.6358 -47.6358 -21.9737 -21.9737 -21.9646 -21.9646 -14.4288 -14.4288 -14.3537 -14.3537 -14.1616 -14.1616 -14.0856 -14.0856 4.9811 4.9811 5.0205 5.0205 5.5777 5.5777 5.7145 5.7145 5.9064 5.9064 10.1904 10.1904 11.1724 11.1724 12.0230 12.0230 13.1984 13.1984 13.3648 13.3648 14.3108 14.3108 15.5040 15.5040 15.8126 15.8126 16.4268 16.4268 k =-0.1817 0.4667 0.9820 ( 2401 PWs) bands (ev): -47.6397 -47.6397 -47.6361 -47.6361 -21.9726 -21.9726 -21.9631 -21.9631 -14.4272 -14.4272 -14.3559 -14.3559 -14.1536 -14.1536 -14.0813 -14.0813 4.9806 4.9806 5.0194 5.0194 5.5836 5.5836 5.7090 5.7090 5.9052 5.9052 10.1484 10.1484 11.1333 11.1333 12.0010 12.0010 13.2206 13.2206 13.4079 13.4079 14.3042 14.3042 15.4715 15.4715 15.7842 15.7842 16.3922 16.3922 k =-0.1868 0.4798 0.9679 ( 2405 PWs) bands (ev): -47.6401 -47.6401 -47.6365 -47.6365 -21.9715 -21.9715 -21.9618 -21.9618 -14.4257 -14.4257 -14.3582 -14.3582 -14.1457 -14.1457 -14.0773 -14.0773 4.9798 4.9798 5.0176 5.0176 5.5889 5.5889 5.7043 5.7043 5.9044 5.9044 10.1075 10.1075 11.0964 11.0964 11.9764 11.9764 13.2452 13.2452 13.4479 13.4479 14.3005 14.3005 15.4409 15.4409 15.7601 15.7601 16.3589 16.3589 k =-0.1919 0.4930 0.9537 ( 2403 PWs) bands (ev): -47.6405 -47.6405 -47.6368 -47.6368 -21.9704 -21.9704 -21.9604 -21.9604 -14.4241 -14.4241 -14.3605 -14.3605 -14.1379 -14.1379 -14.0734 -14.0734 4.9789 4.9789 5.0152 5.0152 5.5937 5.5937 5.7007 5.7007 5.9043 5.9043 10.0677 10.0677 11.0619 11.0619 11.9498 11.9498 13.2715 13.2715 13.4844 13.4844 14.2999 14.2999 15.4123 15.4123 15.7401 15.7401 16.3270 16.3270 k =-0.1971 0.5062 0.9396 ( 2404 PWs) bands (ev): -47.6409 -47.6409 -47.6371 -47.6371 -21.9694 -21.9694 -21.9591 -21.9591 -14.4226 -14.4226 -14.3629 -14.3629 -14.1303 -14.1303 -14.0698 -14.0698 4.9779 4.9779 5.0123 5.0123 5.5980 5.5980 5.6980 5.6980 5.9045 5.9045 10.0293 10.0293 11.0297 11.0297 11.9219 11.9219 13.2988 13.2988 13.5172 13.5172 14.3028 14.3028 15.3856 15.3856 15.7237 15.7237 16.2962 16.2962 k =-0.2022 0.5194 0.9254 ( 2402 PWs) bands (ev): -47.6413 -47.6413 -47.6374 -47.6374 -21.9683 -21.9683 -21.9579 -21.9579 -14.4210 -14.4210 -14.3652 -14.3652 -14.1230 -14.1230 -14.0664 -14.0664 4.9769 4.9769 5.0090 5.0090 5.6017 5.6017 5.6964 5.6964 5.9050 5.9050 9.9925 9.9925 10.9999 10.9999 11.8934 11.8934 13.3262 13.3262 13.5462 13.5462 14.3092 14.3092 15.3609 15.3609 15.7108 15.7108 16.2664 16.2664 k =-0.2073 0.5326 0.9112 ( 2403 PWs) bands (ev): -47.6416 -47.6416 -47.6377 -47.6377 -21.9674 -21.9674 -21.9568 -21.9568 -14.4195 -14.4195 -14.3675 -14.3675 -14.1159 -14.1159 -14.0633 -14.0633 4.9757 4.9757 5.0054 5.0054 5.6049 5.6049 5.6955 5.6955 5.9058 5.9058 9.9574 9.9574 10.9725 10.9725 11.8649 11.8649 13.3530 13.3530 13.5716 13.5716 14.3192 14.3192 15.3382 15.3382 15.7009 15.7009 16.2377 16.2377 k =-0.2125 0.5458 0.8971 ( 2399 PWs) bands (ev): -47.6419 -47.6419 -47.6379 -47.6379 -21.9665 -21.9665 -21.9557 -21.9557 -14.4179 -14.4179 -14.3698 -14.3698 -14.1092 -14.1092 -14.0605 -14.0605 4.9745 4.9745 5.0015 5.0015 5.6078 5.6078 5.6953 5.6953 5.9068 5.9068 9.9242 9.9242 10.9474 10.9474 11.8370 11.8370 13.3783 13.3783 13.5937 13.5937 14.3324 14.3324 15.3176 15.3176 15.6936 15.6936 16.2100 16.2100 k =-0.2176 0.5590 0.8829 ( 2401 PWs) bands (ev): -47.6422 -47.6422 -47.6381 -47.6381 -21.9657 -21.9657 -21.9547 -21.9547 -14.4164 -14.4164 -14.3720 -14.3720 -14.1028 -14.1028 -14.0580 -14.0580 4.9731 4.9731 4.9976 4.9976 5.6101 5.6101 5.6957 5.6957 5.9080 5.9080 9.8932 9.8932 10.9247 10.9247 11.8101 11.8101 13.4014 13.4014 13.6132 13.6132 14.3483 14.3483 15.2991 15.2991 15.6885 15.6885 16.1835 16.1835 k =-0.2227 0.5722 0.8688 ( 2399 PWs) bands (ev): -47.6425 -47.6425 -47.6384 -47.6384 -21.9650 -21.9650 -21.9538 -21.9538 -14.4148 -14.4148 -14.3742 -14.3742 -14.0967 -14.0967 -14.0558 -14.0558 4.9718 4.9718 4.9937 4.9937 5.6122 5.6122 5.6965 5.6965 5.9093 5.9093 9.8646 9.8646 10.9043 10.9043 11.7846 11.7846 13.4217 13.4217 13.6306 13.6306 14.3662 14.3662 15.2827 15.2827 15.6851 15.6851 16.1583 16.1583 k =-0.2279 0.5854 0.8546 ( 2405 PWs) bands (ev): -47.6427 -47.6427 -47.6386 -47.6386 -21.9644 -21.9644 -21.9530 -21.9530 -14.4133 -14.4133 -14.3764 -14.3764 -14.0911 -14.0911 -14.0540 -14.0540 4.9703 4.9703 4.9900 4.9900 5.6140 5.6140 5.6974 5.6974 5.9105 5.9105 9.8384 9.8384 10.8862 10.8862 11.7609 11.7609 13.4388 13.4388 13.6466 13.6466 14.3852 14.3852 15.2684 15.2684 15.6832 15.6832 16.1345 16.1345 k =-0.2330 0.5986 0.8405 ( 2401 PWs) bands (ev): -47.6429 -47.6429 -47.6388 -47.6388 -21.9638 -21.9638 -21.9522 -21.9522 -14.4118 -14.4118 -14.3784 -14.3784 -14.0859 -14.0859 -14.0525 -14.0525 4.9689 4.9689 4.9866 4.9866 5.6156 5.6156 5.6986 5.6986 5.9118 5.9118 9.8149 9.8149 10.8703 10.8703 11.7393 11.7393 13.4525 13.4525 13.6614 13.6614 14.4045 14.4045 15.2561 15.2561 15.6823 15.6823 16.1125 16.1125 k =-0.2381 0.6117 0.8263 ( 2397 PWs) bands (ev): -47.6431 -47.6431 -47.6389 -47.6389 -21.9632 -21.9632 -21.9515 -21.9515 -14.4103 -14.4103 -14.3804 -14.3804 -14.0812 -14.0812 -14.0513 -14.0513 4.9674 4.9674 4.9837 4.9837 5.6170 5.6170 5.6999 5.6999 5.9131 5.9131 9.7942 9.7942 10.8566 10.8566 11.7201 11.7201 13.4630 13.4630 13.6751 13.6751 14.4232 14.4232 15.2459 15.2459 15.6821 15.6821 16.0925 16.0925 k =-0.2433 0.6249 0.8122 ( 2403 PWs) bands (ev): -47.6433 -47.6433 -47.6390 -47.6390 -21.9629 -21.9629 -21.9510 -21.9510 -14.4089 -14.4089 -14.3823 -14.3823 -14.0770 -14.0770 -14.0505 -14.0505 4.9659 4.9659 4.9811 4.9811 5.6181 5.6181 5.7009 5.7009 5.9142 5.9142 9.7765 9.7765 10.8450 10.8450 11.7035 11.7035 13.4707 13.4707 13.6876 13.6876 14.4405 14.4405 15.2374 15.2374 15.6825 15.6825 16.0748 16.0748 k =-0.2484 0.6381 0.7980 ( 2403 PWs) bands (ev): -47.6434 -47.6434 -47.6392 -47.6392 -21.9625 -21.9625 -21.9506 -21.9506 -14.4076 -14.4076 -14.3839 -14.3839 -14.0734 -14.0734 -14.0500 -14.0500 4.9646 4.9646 4.9792 4.9792 5.6190 5.6190 5.7019 5.7019 5.9151 5.9151 9.7618 9.7618 10.8357 10.8357 11.6896 11.6896 13.4761 13.4761 13.6986 13.6986 14.4557 14.4557 15.2308 15.2308 15.6830 15.6830 16.0598 16.0598 k =-0.2535 0.6513 0.7839 ( 2401 PWs) bands (ev): -47.6435 -47.6435 -47.6392 -47.6392 -21.9621 -21.9621 -21.9502 -21.9502 -14.4064 -14.4064 -14.3854 -14.3854 -14.0704 -14.0704 -14.0497 -14.0497 4.9633 4.9633 4.9777 4.9777 5.6198 5.6198 5.7027 5.7027 5.9159 5.9159 9.7503 9.7503 10.8284 10.8284 11.6787 11.6787 13.4797 13.4797 13.7076 13.7076 14.4682 14.4682 15.2257 15.2257 15.6837 15.6837 16.0477 16.0477 k =-0.2587 0.6645 0.7697 ( 2403 PWs) bands (ev): -47.6436 -47.6436 -47.6393 -47.6393 -21.9620 -21.9620 -21.9500 -21.9500 -14.4055 -14.4055 -14.3865 -14.3865 -14.0681 -14.0681 -14.0497 -14.0497 4.9624 4.9624 4.9767 4.9767 5.6203 5.6203 5.7033 5.7033 5.9165 5.9165 9.7420 9.7420 10.8232 10.8232 11.6709 11.6709 13.4819 13.4819 13.7143 13.7143 14.4775 14.4775 15.2222 15.2222 15.6842 15.6842 16.0388 16.0388 k =-0.2638 0.6777 0.7555 ( 2407 PWs) bands (ev): -47.6437 -47.6437 -47.6393 -47.6393 -21.9619 -21.9619 -21.9499 -21.9499 -14.4049 -14.4049 -14.3873 -14.3873 -14.0668 -14.0668 -14.0497 -14.0497 4.9617 4.9617 4.9760 4.9760 5.6206 5.6206 5.7037 5.7037 5.9168 5.9168 9.7370 9.7370 10.8201 10.8201 11.6661 11.6661 13.4831 13.4831 13.7184 13.7184 14.4833 14.4833 15.2202 15.2202 15.6846 15.6846 16.0334 16.0334 k =-0.2689 0.6909 0.7414 ( 2403 PWs) bands (ev): -47.6437 -47.6437 -47.6393 -47.6393 -21.9618 -21.9618 -21.9498 -21.9498 -14.4046 -14.4046 -14.3875 -14.3875 -14.0662 -14.0662 -14.0497 -14.0497 4.9615 4.9615 4.9759 4.9759 5.6207 5.6207 5.7038 5.7038 5.9170 5.9170 9.7353 9.7353 10.8191 10.8191 11.6645 11.6645 13.4835 13.4835 13.7198 13.7198 14.4852 14.4852 15.2195 15.2195 15.6847 15.6847 16.0316 16.0316 k =-0.2689 0.6909 0.7414 ( 2403 PWs) bands (ev): -47.6437 -47.6437 -47.6393 -47.6393 -21.9618 -21.9618 -21.9498 -21.9498 -14.4046 -14.4046 -14.3875 -14.3875 -14.0662 -14.0662 -14.0497 -14.0497 4.9615 4.9615 4.9759 4.9759 5.6207 5.6207 5.7038 5.7038 5.9170 5.9170 9.7353 9.7353 10.8191 10.8191 11.6645 11.6645 13.4835 13.4835 13.7198 13.7198 14.4852 14.4852 15.2195 15.2195 15.6847 15.6847 16.0316 16.0316 k =-0.2638 0.6776 0.7271 ( 2407 PWs) bands (ev): -47.6429 -47.6429 -47.6399 -47.6399 -21.9599 -21.9599 -21.9525 -21.9525 -14.4034 -14.4034 -14.3914 -14.3914 -14.0639 -14.0639 -14.0521 -14.0521 4.9616 4.9616 4.9758 4.9758 5.6201 5.6201 5.7044 5.7044 5.9192 5.9192 9.8358 9.8358 10.6698 10.6698 11.7358 11.7358 13.4800 13.4800 13.7180 13.7180 14.5263 14.5263 15.1852 15.1852 15.6659 15.6659 16.0144 16.0144 k =-0.2586 0.6643 0.7129 ( 2403 PWs) bands (ev): -47.6421 -47.6421 -47.6406 -47.6406 -21.9579 -21.9579 -21.9548 -21.9548 -14.4029 -14.4029 -14.3937 -14.3937 -14.0627 -14.0627 -14.0532 -14.0532 4.9619 4.9619 4.9759 4.9759 5.6198 5.6198 5.7050 5.7050 5.9209 5.9209 9.9356 9.9356 10.5211 10.5211 11.8014 11.8014 13.4769 13.4769 13.7189 13.7189 14.5684 14.5684 15.1519 15.1519 15.6499 15.6499 15.9995 15.9995 k =-0.2534 0.6510 0.6986 ( 2409 PWs) bands (ev): -47.6414 -47.6414 -47.6412 -47.6412 -21.9572 -21.9572 -21.9559 -21.9559 -14.4041 -14.4041 -14.3937 -14.3937 -14.0637 -14.0637 -14.0522 -14.0522 4.9623 4.9623 4.9762 4.9762 5.6197 5.6197 5.7055 5.7055 5.9218 5.9218 10.0328 10.0328 10.3751 10.3751 11.8605 11.8605 13.4746 13.4746 13.7220 13.7220 14.6110 14.6110 15.1201 15.1201 15.6366 15.6366 15.9869 15.9869 k =-0.2483 0.6377 0.6844 ( 2401 PWs) bands (ev): -47.6419 -47.6419 -47.6407 -47.6407 -21.9593 -21.9593 -21.9537 -21.9537 -14.4063 -14.4063 -14.3915 -14.3915 -14.0659 -14.0659 -14.0498 -14.0498 4.9630 4.9630 4.9769 4.9769 5.6201 5.6201 5.7060 5.7060 5.9222 5.9222 10.1130 10.1130 10.2464 10.2464 11.9129 11.9129 13.4733 13.4733 13.7271 13.7271 14.6541 14.6541 15.0903 15.0903 15.6263 15.6263 15.9767 15.9767 k =-0.2431 0.6245 0.6701 ( 2401 PWs) bands (ev): -47.6426 -47.6426 -47.6400 -47.6400 -21.9615 -21.9615 -21.9513 -21.9513 -14.4089 -14.4089 -14.3883 -14.3883 -14.0687 -14.0687 -14.0469 -14.0469 4.9637 4.9637 4.9777 4.9777 5.6206 5.6206 5.7064 5.7064 5.9218 5.9218 10.0520 10.0520 10.2590 10.2590 11.9581 11.9581 13.4729 13.4729 13.7338 13.7338 14.6973 14.6973 15.0630 15.0630 15.6189 15.6189 15.9688 15.9688 k =-0.2379 0.6112 0.6558 ( 2397 PWs) bands (ev): -47.6434 -47.6434 -47.6394 -47.6394 -21.9635 -21.9635 -21.9488 -21.9488 -14.4112 -14.4112 -14.3845 -14.3845 -14.0716 -14.0716 -14.0438 -14.0438 4.9645 4.9645 4.9789 4.9789 5.6215 5.6215 5.7069 5.7069 5.9208 5.9208 9.9139 9.9139 10.3491 10.3491 11.9960 11.9960 13.4734 13.4734 13.7418 13.7418 14.7404 14.7404 15.0384 15.0384 15.6145 15.6145 15.9631 15.9631 k =-0.2327 0.5979 0.6416 ( 2389 PWs) bands (ev): -47.6441 -47.6441 -47.6388 -47.6388 -21.9653 -21.9653 -21.9462 -21.9462 -14.4132 -14.4132 -14.3801 -14.3801 -14.0746 -14.0746 -14.0406 -14.0406 4.9653 4.9653 4.9807 4.9807 5.6226 5.6226 5.7073 5.7073 5.9192 5.9192 9.7707 9.7707 10.4444 10.4444 12.0266 12.0266 13.4744 13.4744 13.7511 13.7511 14.7830 14.7830 15.0168 15.0168 15.6131 15.6131 15.9596 15.9596 k =-0.2276 0.5846 0.6273 ( 2395 PWs) bands (ev): -47.6449 -47.6449 -47.6382 -47.6382 -21.9671 -21.9671 -21.9436 -21.9436 -14.4150 -14.4150 -14.3754 -14.3754 -14.0777 -14.0777 -14.0375 -14.0375 4.9659 4.9659 4.9826 4.9826 5.6240 5.6240 5.7076 5.7076 5.9169 5.9169 9.6277 9.6277 10.5396 10.5396 12.0498 12.0498 13.4755 13.4755 13.7617 13.7617 14.8251 14.8251 14.9984 14.9984 15.6147 15.6147 15.9583 15.9583 k =-0.2224 0.5713 0.6131 ( 2401 PWs) bands (ev): -47.6458 -47.6458 -47.6377 -47.6377 -21.9689 -21.9689 -21.9410 -21.9410 -14.4165 -14.4165 -14.3703 -14.3703 -14.0806 -14.0806 -14.0343 -14.0343 4.9663 4.9663 4.9851 4.9851 5.6255 5.6255 5.7078 5.7078 5.9139 5.9139 9.4858 9.4858 10.6335 10.6335 12.0659 12.0659 13.4764 13.4764 13.7737 13.7737 14.8661 14.8661 14.9832 14.9832 15.6192 15.6192 15.9590 15.9590 k =-0.2172 0.5580 0.5988 ( 2401 PWs) bands (ev): -47.6466 -47.6466 -47.6371 -47.6371 -21.9704 -21.9704 -21.9382 -21.9382 -14.4175 -14.4175 -14.3648 -14.3648 -14.0834 -14.0834 -14.0312 -14.0312 4.9666 4.9666 4.9880 4.9880 5.6273 5.6273 5.7081 5.7081 5.9104 5.9104 9.3456 9.3456 10.7257 10.7257 12.0750 12.0750 13.4766 13.4766 13.7874 13.7874 14.9058 14.9058 14.9714 14.9714 15.6267 15.6267 15.9617 15.9617 k =-0.2120 0.5447 0.5846 ( 2405 PWs) bands (ev): -47.6475 -47.6475 -47.6366 -47.6366 -21.9718 -21.9718 -21.9354 -21.9354 -14.4183 -14.4183 -14.3589 -14.3589 -14.0861 -14.0861 -14.0282 -14.0282 4.9667 4.9667 4.9914 4.9914 5.6294 5.6294 5.7082 5.7082 5.9064 5.9064 9.2072 9.2072 10.8159 10.8159 12.0772 12.0772 13.4757 13.4757 13.8030 13.8030 14.9408 14.9408 14.9655 14.9655 15.6369 15.6369 15.9663 15.9663 k =-0.2069 0.5315 0.5703 ( 2419 PWs) bands (ev): -47.6484 -47.6484 -47.6362 -47.6362 -21.9734 -21.9734 -21.9325 -21.9325 -14.4188 -14.4188 -14.3529 -14.3529 -14.0887 -14.0887 -14.0253 -14.0253 4.9666 4.9666 4.9950 4.9950 5.6314 5.6314 5.7082 5.7082 5.9018 5.9018 9.0707 9.0707 10.9035 10.9035 12.0729 12.0729 13.4734 13.4734 13.8208 13.8208 14.9483 14.9483 14.9878 14.9878 15.6500 15.6500 15.9727 15.9727 k =-0.2017 0.5182 0.5560 ( 2407 PWs) bands (ev): -47.6493 -47.6493 -47.6358 -47.6358 -21.9745 -21.9745 -21.9293 -21.9293 -14.4188 -14.4188 -14.3463 -14.3463 -14.0909 -14.0909 -14.0222 -14.0222 4.9665 4.9665 4.9991 4.9991 5.6340 5.6340 5.7085 5.7085 5.8971 5.8971 8.9364 8.9364 10.9886 10.9886 12.0622 12.0622 13.4696 13.4696 13.8412 13.8412 14.9436 14.9436 15.0226 15.0226 15.6659 15.6659 15.9807 15.9807 k =-0.1965 0.5049 0.5418 ( 2411 PWs) bands (ev): -47.6502 -47.6502 -47.6354 -47.6354 -21.9756 -21.9756 -21.9262 -21.9262 -14.4186 -14.4186 -14.3397 -14.3397 -14.0930 -14.0930 -14.0194 -14.0194 4.9662 4.9662 5.0034 5.0034 5.6364 5.6364 5.7085 5.7085 5.8920 5.8920 8.8043 8.8043 11.0707 11.0707 12.0454 12.0454 13.4642 13.4642 13.8641 13.8641 14.9388 14.9388 15.0569 15.0569 15.6843 15.6843 15.9903 15.9903 k =-0.1914 0.4916 0.5275 ( 2403 PWs) bands (ev): -47.6511 -47.6511 -47.6350 -47.6350 -21.9765 -21.9765 -21.9229 -21.9229 -14.4180 -14.4180 -14.3327 -14.3327 -14.0947 -14.0947 -14.0166 -14.0166 4.9658 4.9658 5.0080 5.0080 5.6390 5.6390 5.7087 5.7087 5.8867 5.8867 8.6746 8.6746 11.1497 11.1497 12.0229 12.0229 13.4573 13.4573 13.8898 13.8898 14.9346 14.9346 15.0899 15.0899 15.7054 15.7054 16.0013 16.0013 k =-0.1862 0.4783 0.5133 ( 2401 PWs) bands (ev): -47.6521 -47.6521 -47.6347 -47.6347 -21.9774 -21.9774 -21.9196 -21.9196 -14.4172 -14.4172 -14.3255 -14.3255 -14.0963 -14.0963 -14.0139 -14.0139 4.9652 4.9652 5.0127 5.0127 5.6415 5.6415 5.7087 5.7087 5.8813 5.8813 8.5474 8.5474 11.2253 11.2253 11.9948 11.9948 13.4491 13.4491 13.9181 13.9181 14.9306 14.9306 15.1212 15.1212 15.7289 15.7289 16.0136 16.0136 k =-0.1810 0.4650 0.4990 ( 2399 PWs) bands (ev): -47.6530 -47.6530 -47.6343 -47.6343 -21.9782 -21.9782 -21.9163 -21.9163 -14.4162 -14.4162 -14.3183 -14.3183 -14.0974 -14.0974 -14.0113 -14.0113 4.9645 4.9645 5.0173 5.0173 5.6441 5.6441 5.7086 5.7086 5.8759 5.8759 8.4226 8.4226 11.2974 11.2974 11.9616 11.9616 13.4396 13.4396 13.9490 13.9490 14.9268 14.9268 15.1508 15.1508 15.7549 15.7549 16.0270 16.0270 k =-0.1758 0.4517 0.4848 ( 2403 PWs) bands (ev): -47.6540 -47.6540 -47.6341 -47.6341 -21.9790 -21.9790 -21.9129 -21.9129 -14.4150 -14.4150 -14.3110 -14.3110 -14.0983 -14.0983 -14.0088 -14.0088 4.9636 4.9636 5.0220 5.0220 5.6465 5.6465 5.7083 5.7083 5.8707 5.8707 8.3005 8.3005 11.3659 11.3659 11.9235 11.9235 13.4289 13.4289 13.9823 13.9823 14.9232 14.9232 15.1786 15.1786 15.7831 15.7831 16.0414 16.0414 k =-0.1707 0.4385 0.4705 ( 2407 PWs) bands (ev): -47.6549 -47.6549 -47.6338 -47.6338 -21.9798 -21.9798 -21.9095 -21.9095 -14.4137 -14.4137 -14.3036 -14.3036 -14.0987 -14.0987 -14.0064 -14.0064 4.9626 4.9626 5.0266 5.0266 5.6487 5.6487 5.7079 5.7079 5.8657 5.8657 8.1811 8.1811 11.4305 11.4305 11.8811 11.8811 13.4170 13.4170 14.0177 14.0177 14.9198 14.9198 15.2048 15.2048 15.8137 15.8137 16.0566 16.0566 k =-0.1655 0.4252 0.4562 ( 2407 PWs) bands (ev): -47.6559 -47.6559 -47.6336 -47.6336 -21.9803 -21.9803 -21.9061 -21.9061 -14.4122 -14.4122 -14.2961 -14.2961 -14.0987 -14.0987 -14.0042 -14.0042 4.9615 4.9615 5.0311 5.0311 5.6509 5.6509 5.7074 5.7074 5.8612 5.8612 8.0645 8.0645 11.4910 11.4910 11.8348 11.8348 13.4040 13.4040 14.0550 14.0550 14.9171 14.9171 15.2294 15.2294 15.8463 15.8463 16.0726 16.0726 k =-0.1603 0.4119 0.4420 ( 2403 PWs) bands (ev): -47.6569 -47.6569 -47.6334 -47.6334 -21.9807 -21.9807 -21.9026 -21.9026 -14.4105 -14.4105 -14.2887 -14.2887 -14.0981 -14.0981 -14.0020 -14.0020 4.9603 4.9603 5.0354 5.0354 5.6529 5.6529 5.7067 5.7067 5.8574 5.8574 7.9507 7.9507 11.5470 11.5470 11.7855 11.7855 13.3897 13.3897 14.0939 14.0939 14.9154 14.9154 15.2526 15.2526 15.8810 15.8810 16.0891 16.0891 k =-0.1552 0.3986 0.4277 ( 2403 PWs) bands (ev): -47.6579 -47.6579 -47.6332 -47.6332 -21.9811 -21.9811 -21.8991 -21.8991 -14.4089 -14.4089 -14.2813 -14.2813 -14.0970 -14.0970 -13.9998 -13.9998 4.9589 4.9589 5.0394 5.0394 5.6547 5.6547 5.7056 5.7056 5.8543 5.8543 7.8398 7.8398 11.5967 11.5967 11.7354 11.7354 13.3739 13.3739 14.1341 14.1341 14.9150 14.9150 15.2745 15.2745 15.9177 15.9177 16.1061 16.1061 k =-0.1500 0.3853 0.4135 ( 2407 PWs) bands (ev): -47.6588 -47.6588 -47.6331 -47.6331 -21.9814 -21.9814 -21.8957 -21.8957 -14.4072 -14.4072 -14.2741 -14.2741 -14.0955 -14.0955 -13.9979 -13.9979 4.9573 4.9573 5.0430 5.0430 5.6562 5.6562 5.7042 5.7042 5.8520 5.8520 7.7320 7.7320 11.6276 11.6276 11.6973 11.6973 13.3567 13.3567 14.1751 14.1751 14.9166 14.9166 15.2955 15.2955 15.9563 15.9563 16.1235 16.1235 k =-0.1448 0.3720 0.3992 ( 2407 PWs) bands (ev): -47.6598 -47.6598 -47.6329 -47.6329 -21.9816 -21.9816 -21.8923 -21.8923 -14.4055 -14.4055 -14.2670 -14.2670 -14.0934 -14.0934 -13.9960 -13.9960 4.9556 4.9556 5.0462 5.0462 5.6575 5.6575 5.7025 5.7025 5.8506 5.8506 7.6272 7.6272 11.5983 11.5983 11.7131 11.7131 13.3378 13.3378 14.2167 14.2167 14.9207 14.9207 15.3158 15.3158 15.9966 15.9966 16.1412 16.1412 k =-0.1396 0.3587 0.3850 ( 2399 PWs) bands (ev): -47.6608 -47.6608 -47.6328 -47.6328 -21.9817 -21.9817 -21.8887 -21.8887 -14.4038 -14.4038 -14.2600 -14.2600 -14.0907 -14.0907 -13.9942 -13.9942 4.9538 4.9538 5.0491 5.0491 5.6586 5.6586 5.7007 5.7007 5.8503 5.8503 7.5255 7.5255 11.5422 11.5422 11.7500 11.7500 13.3171 13.3171 14.2583 14.2583 14.9277 14.9277 15.3359 15.3359 16.0385 16.0385 16.1591 16.1591 k =-0.1345 0.3454 0.3707 ( 2399 PWs) bands (ev): -47.6617 -47.6617 -47.6327 -47.6327 -21.9818 -21.9818 -21.8853 -21.8853 -14.4022 -14.4022 -14.2531 -14.2531 -14.0875 -14.0875 -13.9925 -13.9925 4.9518 4.9518 5.0513 5.0513 5.6595 5.6595 5.6985 5.6985 5.8510 5.8510 7.4270 7.4270 11.4808 11.4808 11.7870 11.7870 13.2945 13.2945 14.2997 14.2997 14.9381 14.9381 15.3561 15.3561 16.0816 16.0816 16.1775 16.1775 k =-0.1293 0.3322 0.3564 ( 2401 PWs) bands (ev): -47.6627 -47.6627 -47.6326 -47.6326 -21.9818 -21.9818 -21.8820 -21.8820 -14.4007 -14.4007 -14.2465 -14.2465 -14.0839 -14.0839 -13.9909 -13.9909 4.9496 4.9496 5.0530 5.0530 5.6601 5.6601 5.6962 5.6962 5.8525 5.8525 7.3318 7.3318 11.4172 11.4172 11.8213 11.8213 13.2702 13.2702 14.3403 14.3403 14.9521 14.9521 15.3770 15.3770 16.1254 16.1254 16.1966 16.1966 k =-0.1241 0.3189 0.3422 ( 2401 PWs) bands (ev): -47.6636 -47.6636 -47.6326 -47.6326 -21.9817 -21.9817 -21.8788 -21.8788 -14.3993 -14.3993 -14.2400 -14.2400 -14.0798 -14.0798 -13.9894 -13.9894 4.9472 4.9472 5.0540 5.0540 5.6606 5.6606 5.6937 5.6937 5.8550 5.8550 7.2398 7.2398 11.3525 11.3525 11.8527 11.8527 13.2442 13.2442 14.3796 14.3796 14.9701 14.9701 15.3990 15.3990 16.1681 16.1681 16.2180 16.2180 k =-0.1190 0.3056 0.3279 ( 2405 PWs) bands (ev): -47.6645 -47.6645 -47.6325 -47.6325 -21.9817 -21.9817 -21.8756 -21.8756 -14.3980 -14.3980 -14.2337 -14.2337 -14.0753 -14.0753 -13.9880 -13.9880 4.9446 4.9446 5.0544 5.0544 5.6610 5.6610 5.6913 5.6913 5.8582 5.8582 7.1512 7.1512 11.2870 11.2870 11.8810 11.8810 13.2166 13.2166 14.4173 14.4173 14.9922 14.9922 15.4228 15.4228 16.2048 16.2048 16.2465 16.2465 k =-0.1138 0.2923 0.3137 ( 2409 PWs) bands (ev): -47.6654 -47.6654 -47.6325 -47.6325 -21.9816 -21.9816 -21.8724 -21.8724 -14.3970 -14.3970 -14.2276 -14.2276 -14.0705 -14.0705 -13.9866 -13.9866 4.9418 4.9418 5.0542 5.0542 5.6613 5.6613 5.6889 5.6889 5.8621 5.8621 7.0661 7.0661 11.2215 11.2215 11.9063 11.9063 13.1876 13.1876 14.4529 14.4529 15.0184 15.0184 15.4487 15.4487 16.2307 16.2307 16.2866 16.2866 k =-0.1086 0.2790 0.2994 ( 2413 PWs) bands (ev): -47.6663 -47.6663 -47.6325 -47.6325 -21.9816 -21.9816 -21.8693 -21.8693 -14.3960 -14.3960 -14.2216 -14.2216 -14.0655 -14.0655 -13.9852 -13.9852 4.9387 4.9387 5.0534 5.0534 5.6616 5.6616 5.6866 5.6866 5.8665 5.8665 6.9844 6.9844 11.1561 11.1561 11.9287 11.9287 13.1574 13.1574 14.4862 14.4862 15.0488 15.0488 15.4774 15.4774 16.2504 16.2504 16.3336 16.3336 k =-0.1034 0.2657 0.2852 ( 2417 PWs) bands (ev): -47.6671 -47.6671 -47.6325 -47.6325 -21.9814 -21.9814 -21.8663 -21.8663 -14.3952 -14.3952 -14.2158 -14.2158 -14.0603 -14.0603 -13.9838 -13.9838 4.9355 4.9355 5.0520 5.0520 5.6619 5.6619 5.6846 5.6846 5.8714 5.8714 6.9063 6.9063 11.0914 11.0914 11.9483 11.9483 13.1265 13.1265 14.5167 14.5167 15.0832 15.0832 15.5091 15.5091 16.2678 16.2678 16.3834 16.3834 k =-0.0983 0.2524 0.2709 ( 2417 PWs) bands (ev): -47.6680 -47.6680 -47.6325 -47.6325 -21.9812 -21.9812 -21.8633 -21.8633 -14.3946 -14.3946 -14.2100 -14.2100 -14.0551 -14.0551 -13.9823 -13.9823 4.9322 4.9322 5.0501 5.0501 5.6624 5.6624 5.6827 5.6827 5.8767 5.8767 6.8317 6.8317 11.0276 11.0276 11.9654 11.9654 13.0949 13.0949 14.5444 14.5444 15.1214 15.1214 15.5441 15.5441 16.2840 16.2840 16.4345 16.4345 k =-0.0931 0.2392 0.2566 ( 2411 PWs) bands (ev): -47.6687 -47.6687 -47.6325 -47.6325 -21.9809 -21.9809 -21.8604 -21.8604 -14.3941 -14.3941 -14.2042 -14.2042 -14.0498 -14.0498 -13.9808 -13.9808 4.9286 4.9286 5.0478 5.0478 5.6631 5.6631 5.6810 5.6810 5.8823 5.8823 6.7608 6.7608 10.9651 10.9651 11.9802 11.9802 13.0631 13.0631 14.5690 14.5690 15.1633 15.1633 15.5825 15.5825 16.2995 16.2995 16.4865 16.4865 k =-0.0879 0.2259 0.2424 ( 2411 PWs) bands (ev): -47.6695 -47.6695 -47.6325 -47.6325 -21.9807 -21.9807 -21.8576 -21.8576 -14.3938 -14.3938 -14.1987 -14.1987 -14.0448 -14.0448 -13.9791 -13.9791 4.9249 4.9249 5.0450 5.0450 5.6638 5.6638 5.6796 5.6796 5.8880 5.8880 6.6936 6.6936 10.9042 10.9042 11.9927 11.9927 13.0314 13.0314 14.5908 14.5908 15.2087 15.2087 15.6245 15.6245 16.3145 16.3145 16.5388 16.5388 k =-0.0828 0.2126 0.2281 ( 2415 PWs) bands (ev): -47.6703 -47.6703 -47.6325 -47.6325 -21.9804 -21.9804 -21.8550 -21.8550 -14.3936 -14.3936 -14.1933 -14.1933 -14.0401 -14.0401 -13.9773 -13.9773 4.9209 4.9209 5.0419 5.0419 5.6645 5.6645 5.6784 5.6784 5.8938 5.8938 6.6301 6.6301 10.8452 10.8452 12.0031 12.0031 13.0000 13.0000 14.6096 14.6096 15.2573 15.2573 15.6697 15.6697 16.3292 16.3292 16.5912 16.5912 k =-0.0776 0.1993 0.2139 ( 2415 PWs) bands (ev): -47.6709 -47.6709 -47.6326 -47.6326 -21.9802 -21.9802 -21.8525 -21.8525 -14.3935 -14.3935 -14.1879 -14.1879 -14.0357 -14.0357 -13.9753 -13.9753 4.9168 4.9168 5.0386 5.0386 5.6652 5.6652 5.6776 5.6776 5.8996 5.8996 6.5703 6.5703 10.7884 10.7884 12.0118 12.0118 12.9693 12.9693 14.6258 14.6258 15.3089 15.3089 15.7179 15.7179 16.3438 16.3438 16.6433 16.6433 k =-0.0724 0.1860 0.1996 ( 2419 PWs) bands (ev): -47.6716 -47.6716 -47.6326 -47.6326 -21.9799 -21.9799 -21.8501 -21.8501 -14.3936 -14.3936 -14.1828 -14.1828 -14.0318 -14.0318 -13.9731 -13.9731 4.9125 4.9125 5.0351 5.0351 5.6657 5.6657 5.6772 5.6772 5.9054 5.9054 6.5143 6.5143 10.7340 10.7340 12.0188 12.0188 12.9394 12.9394 14.6395 14.6395 15.3631 15.3631 15.7687 15.7687 16.3583 16.3583 16.6947 16.6947 k =-0.0672 0.1727 0.1853 ( 2419 PWs) bands (ev): -47.6722 -47.6722 -47.6327 -47.6327 -21.9797 -21.9797 -21.8479 -21.8479 -14.3937 -14.3937 -14.1778 -14.1778 -14.0284 -14.0284 -13.9707 -13.9707 4.9081 4.9081 5.0316 5.0316 5.6659 5.6659 5.6775 5.6775 5.9110 5.9110 6.4622 6.4622 10.6822 10.6822 12.0244 12.0244 12.9107 12.9107 14.6511 14.6511 15.4198 15.4198 15.8215 15.8215 16.3733 16.3733 16.7449 16.7449 k =-0.0621 0.1594 0.1711 ( 2419 PWs) bands (ev): -47.6728 -47.6728 -47.6327 -47.6327 -21.9795 -21.9795 -21.8457 -21.8457 -14.3939 -14.3939 -14.1730 -14.1730 -14.0254 -14.0254 -13.9680 -13.9680 4.9036 4.9036 5.0282 5.0282 5.6657 5.6657 5.6783 5.6783 5.9165 5.9165 6.4140 6.4140 10.6334 10.6334 12.0287 12.0287 12.8833 12.8833 14.6607 14.6607 15.4785 15.4785 15.8755 15.8755 16.3889 16.3889 16.7932 16.7932 k =-0.0569 0.1462 0.1568 ( 2427 PWs) bands (ev): -47.6734 -47.6734 -47.6328 -47.6328 -21.9793 -21.9793 -21.8438 -21.8438 -14.3942 -14.3942 -14.1684 -14.1684 -14.0230 -14.0230 -13.9653 -13.9653 4.8990 4.8990 5.0248 5.0248 5.6652 5.6652 5.6794 5.6794 5.9217 5.9217 6.3696 6.3696 10.5876 10.5876 12.0319 12.0319 12.8575 12.8575 14.6686 14.6686 15.5391 15.5391 15.9299 15.9299 16.4057 16.4057 16.8386 16.8386 k =-0.0517 0.1329 0.1426 ( 2431 PWs) bands (ev): -47.6739 -47.6739 -47.6328 -47.6328 -21.9791 -21.9791 -21.8420 -21.8420 -14.3946 -14.3946 -14.1641 -14.1641 -14.0211 -14.0211 -13.9624 -13.9624 4.8946 4.8946 5.0215 5.0215 5.6645 5.6645 5.6810 5.6810 5.9266 5.9266 6.3291 6.3291 10.5452 10.5452 12.0342 12.0342 12.8333 12.8333 14.6752 14.6752 15.6012 15.6012 15.9836 15.9836 16.4242 16.4242 16.8793 16.8793 k =-0.0465 0.1196 0.1283 ( 2431 PWs) bands (ev): -47.6743 -47.6743 -47.6328 -47.6328 -21.9788 -21.9788 -21.8403 -21.8403 -14.3949 -14.3949 -14.1599 -14.1599 -14.0197 -14.0197 -13.9595 -13.9595 4.8903 4.8903 5.0185 5.0185 5.6636 5.6636 5.6827 5.6827 5.9313 5.9313 6.2925 6.2925 10.5063 10.5063 12.0358 12.0358 12.8111 12.8111 14.6805 14.6805 15.6645 15.6645 16.0351 16.0351 16.4452 16.4452 16.9111 16.9111 k =-0.0414 0.1063 0.1141 ( 2431 PWs) bands (ev): -47.6748 -47.6748 -47.6329 -47.6329 -21.9786 -21.9786 -21.8388 -21.8388 -14.3952 -14.3952 -14.1561 -14.1561 -14.0186 -14.0186 -13.9566 -13.9566 4.8862 4.8862 5.0158 5.0158 5.6628 5.6628 5.6844 5.6844 5.9356 5.9356 6.2598 6.2598 10.4710 10.4710 12.0367 12.0367 12.7908 12.7908 14.6849 14.6849 15.7284 15.7284 16.0832 16.0832 16.4691 16.4691 16.9250 16.9250 k =-0.0362 0.0930 0.0998 ( 2423 PWs) bands (ev): -47.6751 -47.6751 -47.6329 -47.6329 -21.9783 -21.9783 -21.8374 -21.8374 -14.3954 -14.3954 -14.1525 -14.1525 -14.0179 -14.0179 -13.9538 -13.9538 4.8824 4.8824 5.0134 5.0134 5.6619 5.6619 5.6862 5.6862 5.9396 5.9396 6.2310 6.2310 10.4395 10.4395 12.0373 12.0373 12.7727 12.7727 14.6884 14.6884 15.7926 15.7926 16.1263 16.1263 16.4959 16.4959 16.9107 16.9107 k =-0.0310 0.0797 0.0855 ( 2419 PWs) bands (ev): -47.6754 -47.6754 -47.6329 -47.6329 -21.9781 -21.9781 -21.8362 -21.8362 -14.3957 -14.3957 -14.1494 -14.1494 -14.0173 -14.0173 -13.9512 -13.9512 4.8789 4.8789 5.0112 5.0112 5.6611 5.6611 5.6878 5.6878 5.9431 5.9431 6.2061 6.2061 10.4120 10.4120 12.0375 12.0375 12.7568 12.7568 14.6912 14.6912 15.8564 15.8564 16.1635 16.1635 16.5241 16.5241 16.8751 16.8751 k =-0.0259 0.0664 0.0713 ( 2415 PWs) bands (ev): -47.6757 -47.6757 -47.6329 -47.6329 -21.9778 -21.9778 -21.8353 -21.8353 -14.3959 -14.3959 -14.1466 -14.1466 -14.0170 -14.0170 -13.9491 -13.9491 4.8758 4.8758 5.0094 5.0094 5.6604 5.6604 5.6893 5.6893 5.9461 5.9461 6.1851 6.1851 10.3885 10.3885 12.0375 12.0375 12.7432 12.7432 14.6934 14.6934 15.9188 15.9188 16.1946 16.1946 16.5490 16.5490 16.8369 16.8369 k =-0.0207 0.0531 0.0570 ( 2413 PWs) bands (ev): -47.6760 -47.6760 -47.6330 -47.6330 -21.9776 -21.9776 -21.8345 -21.8345 -14.3961 -14.3961 -14.1443 -14.1443 -14.0168 -14.0168 -13.9472 -13.9472 4.8732 4.8732 5.0079 5.0079 5.6598 5.6598 5.6906 5.6906 5.9485 5.9485 6.1680 6.1680 10.3691 10.3691 12.0373 12.0373 12.7320 12.7320 14.6951 14.6951 15.9781 15.9781 16.2202 16.2202 16.5613 16.5613 16.8123 16.8123 k =-0.0155 0.0399 0.0428 ( 2407 PWs) bands (ev): -47.6761 -47.6761 -47.6330 -47.6330 -21.9774 -21.9774 -21.8338 -21.8338 -14.3963 -14.3963 -14.1424 -14.1424 -14.0166 -14.0166 -13.9457 -13.9457 4.8711 4.8711 5.0068 5.0068 5.6592 5.6592 5.6916 5.6916 5.9505 5.9505 6.1547 6.1547 10.3540 10.3540 12.0371 12.0371 12.7232 12.7232 14.6963 14.6963 16.0320 16.0320 16.2416 16.2416 16.5525 16.5525 16.8120 16.8120 k =-0.0103 0.0266 0.0285 ( 2411 PWs) bands (ev): -47.6762 -47.6762 -47.6330 -47.6330 -21.9774 -21.9774 -21.8333 -21.8333 -14.3965 -14.3965 -14.1412 -14.1412 -14.0166 -14.0166 -13.9446 -13.9446 4.8695 4.8695 5.0059 5.0059 5.6588 5.6588 5.6923 5.6923 5.9518 5.9518 6.1452 6.1452 10.3431 10.3431 12.0369 12.0369 12.7169 12.7169 14.6972 14.6972 16.0764 16.0764 16.2602 16.2602 16.5272 16.5272 16.8311 16.8311 k =-0.0052 0.0133 0.0143 ( 2413 PWs) bands (ev): -47.6763 -47.6763 -47.6330 -47.6330 -21.9774 -21.9774 -21.8330 -21.8330 -14.3966 -14.3966 -14.1404 -14.1404 -14.0165 -14.0165 -13.9439 -13.9439 4.8686 4.8686 5.0054 5.0054 5.6585 5.6585 5.6927 5.6927 5.9527 5.9527 6.1395 6.1395 10.3366 10.3366 12.0368 12.0368 12.7131 12.7131 14.6977 14.6977 16.1061 16.1061 16.2753 16.2753 16.5008 16.5008 16.8539 16.8539 k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -47.6764 -47.6764 -47.6330 -47.6330 -21.9775 -21.9775 -21.8330 -21.8330 -14.3967 -14.3967 -14.1402 -14.1402 -14.0166 -14.0166 -13.9437 -13.9437 4.8683 4.8683 5.0051 5.0051 5.6583 5.6583 5.6927 5.6927 5.9529 5.9529 6.1376 6.1376 10.3344 10.3344 12.0367 12.0367 12.7119 12.7119 14.6978 14.6978 16.1165 16.1165 16.2819 16.2819 16.4893 16.4893 16.8640 16.8640 k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -47.6764 -47.6764 -47.6330 -47.6330 -21.9775 -21.9775 -21.8330 -21.8330 -14.3967 -14.3967 -14.1402 -14.1402 -14.0166 -14.0166 -13.9437 -13.9437 4.8683 4.8683 5.0051 5.0051 5.6583 5.6583 5.6927 5.6927 5.9529 5.9529 6.1376 6.1376 10.3344 10.3344 12.0367 12.0367 12.7119 12.7119 14.6978 14.6978 16.1165 16.1165 16.2819 16.2819 16.4893 16.4893 16.8640 16.8640 k = 0.0185 0.0072 0.0000 ( 2413 PWs) bands (ev): -47.6763 -47.6763 -47.6330 -47.6330 -21.9774 -21.9774 -21.8330 -21.8330 -14.3965 -14.3965 -14.1402 -14.1402 -14.0167 -14.0167 -13.9437 -13.9437 4.8683 4.8683 5.0051 5.0051 5.6584 5.6584 5.6928 5.6928 5.9530 5.9530 6.1396 6.1396 10.3255 10.3255 12.0422 12.0422 12.7122 12.7122 14.6975 14.6975 16.1122 16.1122 16.2817 16.2817 16.4832 16.4832 16.8691 16.8691 k = 0.0370 0.0144 0.0000 ( 2417 PWs) bands (ev): -47.6764 -47.6764 -47.6330 -47.6330 -21.9773 -21.9773 -21.8332 -21.8332 -14.3961 -14.3961 -14.1402 -14.1402 -14.0172 -14.0172 -13.9437 -13.9437 4.8682 4.8682 5.0049 5.0049 5.6583 5.6583 5.6928 5.6928 5.9529 5.9529 6.1455 6.1455 10.2991 10.2991 12.0582 12.0582 12.7131 12.7131 14.6965 14.6965 16.0998 16.0998 16.2814 16.2814 16.4659 16.4659 16.8844 16.8844 k = 0.0556 0.0216 0.0000 ( 2417 PWs) bands (ev): -47.6763 -47.6763 -47.6330 -47.6330 -21.9772 -21.9772 -21.8333 -21.8333 -14.3956 -14.3956 -14.1402 -14.1402 -14.0178 -14.0178 -13.9437 -13.9437 4.8682 4.8682 5.0045 5.0045 5.6582 5.6582 5.6927 5.6927 5.9529 5.9529 6.1553 6.1553 10.2565 10.2565 12.0834 12.0834 12.7147 12.7147 14.6949 14.6949 16.0801 16.0801 16.2816 16.2816 16.4390 16.4390 16.9097 16.9097 k = 0.0741 0.0288 0.0000 ( 2417 PWs) bands (ev): -47.6763 -47.6763 -47.6330 -47.6330 -21.9770 -21.9770 -21.8334 -21.8334 -14.3949 -14.3949 -14.1402 -14.1402 -14.0186 -14.0186 -13.9436 -13.9436 4.8681 4.8681 5.0041 5.0041 5.6581 5.6581 5.6927 5.6927 5.9529 5.9529 6.1690 6.1690 10.1996 10.1996 12.1162 12.1162 12.7168 12.7168 14.6926 14.6926 16.0543 16.0543 16.2831 16.2831 16.4049 16.4049 16.9442 16.9442 k = 0.0926 0.0360 0.0000 ( 2413 PWs) bands (ev): -47.6763 -47.6763 -47.6331 -47.6331 -21.9769 -21.9769 -21.8335 -21.8335 -14.3940 -14.3940 -14.1402 -14.1402 -14.0195 -14.0195 -13.9435 -13.9435 4.8682 4.8682 5.0036 5.0036 5.6579 5.6579 5.6927 5.6927 5.9529 5.9529 6.1867 6.1867 10.1303 10.1303 12.1547 12.1547 12.7195 12.7195 14.6898 14.6898 16.0238 16.0238 16.2868 16.2868 16.3658 16.3658 16.9873 16.9873 k = 0.1111 0.0433 0.0000 ( 2413 PWs) bands (ev): -47.6763 -47.6763 -47.6331 -47.6331 -21.9767 -21.9767 -21.8337 -21.8337 -14.3929 -14.3929 -14.1404 -14.1404 -14.0207 -14.0207 -13.9434 -13.9434 4.8681 4.8681 5.0030 5.0030 5.6577 5.6577 5.6926 5.6926 5.9529 5.9529 6.2082 6.2082 10.0508 10.0508 12.1968 12.1968 12.7228 12.7228 14.6863 14.6863 15.9898 15.9898 16.2935 16.2935 16.3236 16.3236 17.0380 17.0380 k = 0.1296 0.0505 0.0000 ( 2413 PWs) bands (ev): -47.6762 -47.6762 -47.6331 -47.6331 -21.9765 -21.9765 -21.8339 -21.8339 -14.3917 -14.3917 -14.1404 -14.1404 -14.0221 -14.0221 -13.9433 -13.9433 4.8679 4.8679 5.0022 5.0022 5.6575 5.6575 5.6926 5.6926 5.9529 5.9529 6.2334 6.2334 9.9628 9.9628 12.2410 12.2410 12.7265 12.7265 14.6824 14.6824 15.9537 15.9537 16.2798 16.2798 16.3038 16.3038 17.0952 17.0952 k = 0.1481 0.0577 0.0000 ( 2417 PWs) bands (ev): -47.6762 -47.6762 -47.6332 -47.6332 -21.9762 -21.9762 -21.8343 -21.8343 -14.3903 -14.3903 -14.1405 -14.1405 -14.0237 -14.0237 -13.9433 -13.9433 4.8677 4.8677 5.0014 5.0014 5.6571 5.6571 5.6925 5.6925 5.9529 5.9529 6.2625 6.2625 9.8681 9.8681 12.2858 12.2858 12.7307 12.7307 14.6780 14.6780 15.9164 15.9164 16.2353 16.2353 16.3178 16.3178 17.1580 17.1580 k = 0.1667 0.0649 0.0000 ( 2417 PWs) bands (ev): -47.6762 -47.6762 -47.6332 -47.6332 -21.9759 -21.9759 -21.8346 -21.8346 -14.3887 -14.3887 -14.1406 -14.1406 -14.0254 -14.0254 -13.9432 -13.9432 4.8676 4.8676 5.0005 5.0005 5.6568 5.6568 5.6924 5.6924 5.9529 5.9529 6.2952 6.2952 9.7680 9.7680 12.3300 12.3300 12.7354 12.7354 14.6731 14.6731 15.8786 15.8786 16.1912 16.1912 16.3359 16.3359 17.2256 17.2256 k = 0.1852 0.0721 0.0000 ( 2421 PWs) bands (ev): -47.6761 -47.6761 -47.6333 -47.6333 -21.9757 -21.9757 -21.8349 -21.8349 -14.3871 -14.3871 -14.1407 -14.1407 -14.0274 -14.0274 -13.9431 -13.9431 4.8674 4.8674 4.9994 4.9994 5.6564 5.6564 5.6924 5.6924 5.9528 5.9528 6.3316 6.3316 9.6639 9.6639 12.3728 12.3728 12.7403 12.7403 14.6679 14.6679 15.8411 15.8411 16.1478 16.1478 16.3579 16.3579 17.2970 17.2970 k = 0.2037 0.0793 0.0000 ( 2413 PWs) bands (ev): -47.6761 -47.6761 -47.6333 -47.6333 -21.9752 -21.9752 -21.8352 -21.8352 -14.3852 -14.3852 -14.1408 -14.1408 -14.0293 -14.0293 -13.9430 -13.9430 4.8673 4.8673 4.9986 4.9986 5.6561 5.6561 5.6923 5.6923 5.9529 5.9529 6.3715 6.3715 9.5569 9.5569 12.4136 12.4136 12.7456 12.7456 14.6624 14.6624 15.8043 15.8043 16.1058 16.1058 16.3836 16.3836 17.3714 17.3714 k = 0.2222 0.0865 0.0000 ( 2405 PWs) bands (ev): -47.6760 -47.6760 -47.6334 -47.6334 -21.9749 -21.9749 -21.8354 -21.8354 -14.3833 -14.3833 -14.1409 -14.1409 -14.0312 -14.0312 -13.9428 -13.9428 4.8672 4.8672 4.9976 4.9976 5.6558 5.6558 5.6924 5.6924 5.9529 5.9529 6.4148 6.4148 9.4477 9.4477 12.4518 12.4518 12.7510 12.7510 14.6566 14.6566 15.7686 15.7686 16.0654 16.0654 16.4127 16.4127 17.4481 17.4481 k = 0.2407 0.0937 0.0000 ( 2405 PWs) bands (ev): -47.6760 -47.6760 -47.6334 -47.6334 -21.9745 -21.9745 -21.8357 -21.8357 -14.3814 -14.3814 -14.1410 -14.1410 -14.0333 -14.0333 -13.9427 -13.9427 4.8670 4.8670 4.9965 4.9965 5.6553 5.6553 5.6923 5.6923 5.9529 5.9529 6.4613 6.4613 9.3374 9.3374 12.4872 12.4872 12.7566 12.7566 14.6507 14.6507 15.7344 15.7344 16.0269 16.0269 16.4448 16.4448 17.5263 17.5263 k = 0.2593 0.1009 0.0000 ( 2409 PWs) bands (ev): -47.6759 -47.6759 -47.6335 -47.6335 -21.9742 -21.9742 -21.8362 -21.8362 -14.3794 -14.3794 -14.1411 -14.1411 -14.0356 -14.0356 -13.9426 -13.9426 4.8668 4.8668 4.9953 4.9953 5.6548 5.6548 5.6922 5.6922 5.9529 5.9529 6.5109 6.5109 9.2265 9.2265 12.5195 12.5195 12.7623 12.7623 14.6447 14.6447 15.7018 15.7018 15.9905 15.9905 16.4791 16.4791 17.6053 17.6053 k = 0.2778 0.1081 0.0000 ( 2413 PWs) bands (ev): -47.6759 -47.6759 -47.6335 -47.6335 -21.9739 -21.9739 -21.8366 -21.8366 -14.3774 -14.3774 -14.1412 -14.1412 -14.0378 -14.0378 -13.9426 -13.9426 4.8666 4.8666 4.9942 4.9942 5.6543 5.6543 5.6921 5.6921 5.9528 5.9528 6.5633 6.5633 9.1159 9.1159 12.5488 12.5488 12.7680 12.7680 14.6387 14.6387 15.6712 15.6712 15.9564 15.9564 16.5152 16.5152 17.6842 17.6842 k = 0.2963 0.1153 0.0000 ( 2413 PWs) bands (ev): -47.6758 -47.6758 -47.6336 -47.6336 -21.9735 -21.9735 -21.8370 -21.8370 -14.3755 -14.3755 -14.1413 -14.1413 -14.0399 -14.0399 -13.9425 -13.9425 4.8664 4.8664 4.9931 4.9931 5.6538 5.6538 5.6920 5.6920 5.9528 5.9528 6.6183 6.6183 9.0061 9.0061 12.5751 12.5751 12.7736 12.7736 14.6328 14.6328 15.6426 15.6426 15.9247 15.9247 16.5523 16.5523 17.7622 17.7622 k = 0.3148 0.1225 0.0000 ( 2413 PWs) bands (ev): -47.6758 -47.6758 -47.6336 -47.6336 -21.9732 -21.9732 -21.8373 -21.8373 -14.3736 -14.3736 -14.1414 -14.1414 -14.0420 -14.0420 -13.9424 -13.9424 4.8663 4.8663 4.9921 4.9921 5.6533 5.6533 5.6919 5.6919 5.9528 5.9528 6.6755 6.6755 8.8980 8.8980 12.5984 12.5984 12.7791 12.7791 14.6270 14.6270 15.6162 15.6162 15.8956 15.8956 16.5897 16.5897 17.8386 17.8386 k = 0.3333 0.1298 0.0000 ( 2425 PWs) bands (ev): -47.6757 -47.6757 -47.6337 -47.6337 -21.9731 -21.9731 -21.8377 -21.8377 -14.3718 -14.3718 -14.1417 -14.1417 -14.0441 -14.0441 -13.9424 -13.9424 4.8660 4.8660 4.9910 4.9910 5.6528 5.6528 5.6918 5.6918 5.9526 5.9526 6.7345 6.7345 8.7922 8.7922 12.6189 12.6189 12.7843 12.7843 14.6215 14.6215 15.5920 15.5920 15.8690 15.8690 16.6265 16.6265 17.9123 17.9123 k = 0.3519 0.1370 0.0000 ( 2417 PWs) bands (ev): -47.6757 -47.6757 -47.6337 -47.6337 -21.9726 -21.9726 -21.8380 -21.8380 -14.3700 -14.3700 -14.1417 -14.1417 -14.0460 -14.0460 -13.9423 -13.9423 4.8659 4.8659 4.9901 4.9901 5.6525 5.6525 5.6918 5.6918 5.9527 5.9527 6.7946 6.7946 8.6896 8.6896 12.6366 12.6366 12.7892 12.7892 14.6163 14.6163 15.5702 15.5702 15.8450 15.8450 16.6622 16.6622 17.9825 17.9825 k = 0.3704 0.1442 0.0000 ( 2409 PWs) bands (ev): -47.6757 -47.6757 -47.6337 -47.6337 -21.9723 -21.9723 -21.8381 -21.8381 -14.3683 -14.3683 -14.1418 -14.1418 -14.0476 -14.0476 -13.9421 -13.9421 4.8658 4.8658 4.9894 4.9894 5.6522 5.6522 5.6918 5.6918 5.9527 5.9527 6.8551 6.8551 8.5912 8.5912 12.6518 12.6518 12.7937 12.7937 14.6116 14.6116 15.5509 15.5509 15.8238 15.8238 16.6957 16.6957 18.0481 18.0481 k = 0.3889 0.1514 0.0000 ( 2412 PWs) bands (ev): -47.6756 -47.6756 -47.6338 -47.6338 -21.9721 -21.9721 -21.8384 -21.8384 -14.3669 -14.3669 -14.1419 -14.1419 -14.0492 -14.0492 -13.9421 -13.9421 4.8657 4.8657 4.9886 4.9886 5.6518 5.6518 5.6918 5.6918 5.9527 5.9527 6.9149 6.9149 8.4982 8.4982 12.6647 12.6647 12.7978 12.7978 14.6073 14.6073 15.5340 15.5340 15.8053 15.8053 16.7265 16.7265 18.1080 18.1080 k = 0.4074 0.1586 0.0000 ( 2412 PWs) bands (ev): -47.6756 -47.6756 -47.6338 -47.6338 -21.9719 -21.9719 -21.8386 -21.8386 -14.3656 -14.3656 -14.1420 -14.1420 -14.0506 -14.0506 -13.9420 -13.9420 4.8655 4.8655 4.9879 4.9879 5.6515 5.6515 5.6917 5.6917 5.9528 5.9528 6.9725 6.9725 8.4122 8.4122 12.6752 12.6752 12.8013 12.8013 14.6035 14.6035 15.5197 15.5197 15.7896 15.7896 16.7538 16.7538 18.1201 18.1201 k = 0.4259 0.1658 0.0000 ( 2412 PWs) bands (ev): -47.6756 -47.6756 -47.6338 -47.6338 -21.9718 -21.9718 -21.8388 -21.8388 -14.3646 -14.3646 -14.1420 -14.1420 -14.0518 -14.0518 -13.9419 -13.9419 4.8654 4.8654 4.9873 4.9873 5.6513 5.6513 5.6917 5.6917 5.9528 5.9528 7.0261 7.0261 8.3353 8.3353 12.6837 12.6837 12.8043 12.8043 14.6003 14.6003 15.5079 15.5079 15.7768 15.7768 16.7771 16.7771 18.1187 18.1187 k = 0.4444 0.1730 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9716 -21.9716 -21.8389 -21.8389 -14.3637 -14.3637 -14.1421 -14.1421 -14.0528 -14.0528 -13.9419 -13.9419 4.8653 4.8653 4.9869 4.9869 5.6510 5.6510 5.6917 5.6917 5.9527 5.9527 7.0731 7.0731 8.2701 8.2701 12.6901 12.6901 12.8067 12.8067 14.5978 14.5978 15.4987 15.4987 15.7667 15.7667 16.7958 16.7958 18.1175 18.1175 k = 0.4630 0.1802 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9715 -21.9715 -21.8390 -21.8390 -14.3631 -14.3631 -14.1421 -14.1421 -14.0535 -14.0535 -13.9419 -13.9419 4.8653 4.8653 4.9866 4.9866 5.6509 5.6509 5.6916 5.6916 5.9527 5.9527 7.1103 7.1103 8.2197 8.2197 12.6946 12.6946 12.8084 12.8084 14.5960 14.5960 15.4921 15.4921 15.7596 15.7596 16.8094 16.8094 18.1167 18.1167 k = 0.4815 0.1874 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8391 -21.8391 -14.3627 -14.3627 -14.1421 -14.1421 -14.0539 -14.0539 -13.9419 -13.9419 4.8653 4.8653 4.9864 4.9864 5.6508 5.6508 5.6916 5.6916 5.9527 5.9527 7.1345 7.1345 8.1877 8.1877 12.6973 12.6973 12.8095 12.8095 14.5949 14.5949 15.4882 15.4882 15.7553 15.7553 16.8178 16.8178 18.1162 18.1162 k = 0.5000 0.1946 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8391 -21.8391 -14.3625 -14.3625 -14.1421 -14.1421 -14.0540 -14.0540 -13.9418 -13.9418 4.8652 4.8652 4.9863 4.9863 5.6508 5.6508 5.6916 5.6916 5.9527 5.9527 7.1429 7.1429 8.1766 8.1766 12.6982 12.6982 12.8098 12.8098 14.5945 14.5945 15.4868 15.4868 15.7538 15.7538 16.8206 16.8206 18.1160 18.1160 k = 0.5000 0.1946 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8391 -21.8391 -14.3625 -14.3625 -14.1421 -14.1421 -14.0540 -14.0540 -13.9418 -13.9418 4.8652 4.8652 4.9863 4.9863 5.6508 5.6508 5.6916 5.6916 5.9527 5.9527 7.1429 7.1429 8.1766 8.1766 12.6982 12.6982 12.8098 12.8098 14.5945 14.5945 15.4868 15.4868 15.7538 15.7538 16.8206 16.8206 18.1160 18.1160 k = 0.4949 0.2078 0.0142 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8392 -21.8392 -14.3625 -14.3625 -14.1424 -14.1424 -14.0539 -14.0539 -13.9421 -13.9421 4.8656 4.8656 4.9865 4.9865 5.6507 5.6507 5.6914 5.6914 5.9524 5.9524 7.1443 7.1443 8.1794 8.1794 12.6993 12.6993 12.8107 12.8107 14.5957 14.5957 15.4864 15.4864 15.7533 15.7533 16.8141 16.8141 18.1113 18.1113 k = 0.4897 0.2210 0.0283 ( 2408 PWs) bands (ev): -47.6754 -47.6754 -47.6339 -47.6339 -21.9715 -21.9715 -21.8394 -21.8394 -14.3625 -14.3625 -14.1434 -14.1434 -14.0537 -14.0537 -13.9426 -13.9426 4.8665 4.8665 4.9870 4.9870 5.6506 5.6506 5.6908 5.6908 5.9514 5.9514 7.1483 7.1483 8.1875 8.1875 12.7026 12.7026 12.8134 12.8134 14.5992 14.5992 15.4849 15.4849 15.7519 15.7519 16.7950 16.7950 18.0975 18.0975 k = 0.4846 0.2342 0.0425 ( 2404 PWs) bands (ev): -47.6753 -47.6753 -47.6338 -47.6338 -21.9715 -21.9715 -21.8398 -21.8398 -14.3624 -14.3624 -14.1449 -14.1449 -14.0534 -14.0534 -13.9436 -13.9436 4.8681 4.8681 4.9878 4.9878 5.6505 5.6505 5.6899 5.6899 5.9498 5.9498 7.1551 7.1551 8.2011 8.2011 12.7081 12.7081 12.8178 12.8178 14.6050 14.6050 15.4821 15.4821 15.7499 15.7499 16.7640 16.7640 18.0750 18.0750 k = 0.4795 0.2474 0.0566 ( 2404 PWs) bands (ev): -47.6751 -47.6751 -47.6338 -47.6338 -21.9716 -21.9716 -21.8404 -21.8404 -14.3623 -14.3623 -14.1471 -14.1471 -14.0530 -14.0530 -13.9450 -13.9450 4.8702 4.8702 4.9889 4.9889 5.6501 5.6501 5.6885 5.6885 5.9475 5.9475 7.1645 7.1645 8.2200 8.2200 12.7156 12.7156 12.8242 12.8242 14.6129 14.6129 15.4774 15.4774 15.7478 15.7478 16.7220 16.7220 18.0449 18.0449 k = 0.4743 0.2606 0.0708 ( 2404 PWs) bands (ev): -47.6749 -47.6749 -47.6338 -47.6338 -21.9717 -21.9717 -21.8412 -21.8412 -14.3622 -14.3622 -14.1499 -14.1499 -14.0526 -14.0526 -13.9468 -13.9468 4.8728 4.8728 4.9904 4.9904 5.6497 5.6497 5.6869 5.6869 5.9445 5.9445 7.1766 7.1766 8.2441 8.2441 12.7250 12.7250 12.8324 12.8324 14.6230 14.6230 15.4702 15.4702 15.7462 15.7462 16.6704 16.6704 18.0081 18.0081 k = 0.4692 0.2738 0.0849 ( 2400 PWs) bands (ev): -47.6746 -47.6746 -47.6338 -47.6338 -21.9719 -21.9719 -21.8421 -21.8421 -14.3621 -14.3621 -14.1531 -14.1531 -14.0521 -14.0521 -13.9489 -13.9489 4.8758 4.8758 4.9921 4.9921 5.6492 5.6492 5.6852 5.6852 5.9411 5.9411 7.1915 7.1915 8.2735 8.2735 12.7361 12.7361 12.8425 12.8425 14.6348 14.6348 15.4597 15.4597 15.7460 15.7460 16.6107 16.6107 17.9657 17.9657 k = 0.4641 0.2870 0.0991 ( 2396 PWs) bands (ev): -47.6743 -47.6743 -47.6337 -47.6337 -21.9721 -21.9721 -21.8431 -21.8431 -14.3619 -14.3619 -14.1568 -14.1568 -14.0518 -14.0518 -13.9513 -13.9513 4.8793 4.8793 4.9942 4.9942 5.6486 5.6486 5.6832 5.6832 5.9372 5.9372 7.2090 7.2090 8.3080 8.3080 12.7489 12.7489 12.8546 12.8546 14.6483 14.6483 15.4452 15.4452 15.7476 15.7476 16.5446 16.5446 17.9185 17.9185 k = 0.4589 0.3002 0.1132 ( 2396 PWs) bands (ev): -47.6739 -47.6739 -47.6337 -47.6337 -21.9723 -21.9723 -21.8444 -21.8444 -14.3618 -14.3618 -14.1609 -14.1609 -14.0516 -14.0516 -13.9540 -13.9540 4.8831 4.8831 4.9965 4.9965 5.6477 5.6477 5.6813 5.6813 5.9327 5.9327 7.2293 7.2293 8.3474 8.3474 12.7630 12.7630 12.8688 12.8688 14.6632 14.6632 15.4262 15.4262 15.7516 15.7516 16.4736 16.4736 17.8675 17.8675 k = 0.4538 0.3133 0.1274 ( 2396 PWs) bands (ev): -47.6735 -47.6735 -47.6337 -47.6337 -21.9726 -21.9726 -21.8459 -21.8459 -14.3618 -14.3618 -14.1653 -14.1653 -14.0516 -14.0516 -13.9569 -13.9569 4.8871 4.8871 4.9990 4.9990 5.6468 5.6468 5.6793 5.6793 5.9278 5.9278 7.2523 7.2523 8.3916 8.3916 12.7784 12.7784 12.8849 12.8849 14.6790 14.6790 15.4022 15.4022 15.7580 15.7580 16.3995 16.3995 17.8132 17.8132 k = 0.4487 0.3265 0.1415 ( 2392 PWs) bands (ev): -47.6731 -47.6731 -47.6336 -47.6336 -21.9728 -21.9728 -21.8474 -21.8474 -14.3617 -14.3617 -14.1700 -14.1700 -14.0517 -14.0517 -13.9600 -13.9600 4.8913 4.8913 5.0019 5.0019 5.6457 5.6457 5.6775 5.6775 5.9225 5.9225 7.2779 7.2779 8.4406 8.4406 12.7946 12.7946 12.9032 12.9032 14.6954 14.6954 15.3733 15.3733 15.7667 15.7667 16.3239 16.3239 17.7562 17.7562 k = 0.4435 0.3397 0.1557 ( 2398 PWs) bands (ev): -47.6726 -47.6726 -47.6336 -47.6336 -21.9732 -21.9732 -21.8492 -21.8492 -14.3618 -14.3618 -14.1751 -14.1751 -14.0523 -14.0523 -13.9632 -13.9632 4.8956 4.8956 5.0048 5.0048 5.6445 5.6445 5.6758 5.6758 5.9169 5.9169 7.3063 7.3063 8.4941 8.4941 12.8117 12.8117 12.9233 12.9233 14.7118 14.7118 15.3395 15.3395 15.7771 15.7771 16.2487 16.2487 17.6969 17.6969 k = 0.4384 0.3529 0.1699 ( 2400 PWs) bands (ev): -47.6720 -47.6720 -47.6335 -47.6335 -21.9735 -21.9735 -21.8511 -21.8511 -14.3620 -14.3620 -14.1803 -14.1803 -14.0530 -14.0530 -13.9665 -13.9665 4.8999 4.8999 5.0079 5.0079 5.6432 5.6432 5.6743 5.6743 5.9110 5.9110 7.3374 7.3374 8.5520 8.5520 12.8295 12.8295 12.9453 12.9453 14.7274 14.7274 15.3010 15.3010 15.7881 15.7881 16.1758 16.1758 17.6359 17.6359 k = 0.4332 0.3661 0.1840 ( 2402 PWs) bands (ev): -47.6715 -47.6715 -47.6335 -47.6335 -21.9739 -21.9739 -21.8532 -21.8532 -14.3622 -14.3622 -14.1857 -14.1857 -14.0542 -14.0542 -13.9698 -13.9698 4.9042 4.9042 5.0111 5.0111 5.6420 5.6420 5.6730 5.6730 5.9050 5.9050 7.3712 7.3712 8.6142 8.6142 12.8477 12.8477 12.9688 12.9688 14.7416 14.7416 15.2581 15.2581 15.7977 15.7977 16.1083 16.1083 17.5735 17.5735 k = 0.4281 0.3793 0.1982 ( 2402 PWs) bands (ev): -47.6708 -47.6708 -47.6335 -47.6335 -21.9742 -21.9742 -21.8554 -21.8554 -14.3625 -14.3625 -14.1912 -14.1912 -14.0556 -14.0556 -13.9730 -13.9730 4.9084 4.9084 5.0142 5.0142 5.6411 5.6411 5.6720 5.6720 5.8989 5.8989 7.4077 7.4077 8.6804 8.6804 12.8664 12.8664 12.9935 12.9935 14.7533 14.7533 15.2109 15.2109 15.8023 15.8023 16.0506 16.0506 17.5100 17.5100 k = 0.4230 0.3925 0.2123 ( 2402 PWs) bands (ev): -47.6702 -47.6702 -47.6334 -47.6334 -21.9744 -21.9744 -21.8577 -21.8577 -14.3630 -14.3630 -14.1968 -14.1968 -14.0575 -14.0575 -13.9762 -13.9762 4.9126 4.9126 5.0173 5.0173 5.6403 5.6403 5.6711 5.6711 5.8927 5.8927 7.4469 7.4469 8.7506 8.7506 12.8855 12.8855 13.0192 13.0192 14.7614 14.7614 15.1597 15.1597 15.7965 15.7965 16.0093 16.0093 17.4457 17.4457 k = 0.4178 0.4057 0.2265 ( 2402 PWs) bands (ev): -47.6695 -47.6695 -47.6334 -47.6334 -21.9748 -21.9748 -21.8602 -21.8602 -14.3636 -14.3636 -14.2026 -14.2026 -14.0596 -14.0596 -13.9792 -13.9792 4.9166 4.9166 5.0202 5.0202 5.6400 5.6400 5.6703 5.6703 5.8866 5.8866 7.4888 7.4888 8.8246 8.8246 12.9047 12.9047 13.0455 13.0455 14.7646 14.7646 15.1049 15.1049 15.7757 15.7757 15.9898 15.9898 17.3811 17.3811 k = 0.4127 0.4189 0.2406 ( 2398 PWs) bands (ev): -47.6688 -47.6688 -47.6333 -47.6333 -21.9750 -21.9750 -21.8627 -21.8627 -14.3643 -14.3643 -14.2084 -14.2084 -14.0621 -14.0621 -13.9821 -13.9821 4.9204 4.9204 5.0229 5.0229 5.6401 5.6401 5.6697 5.6697 5.8806 5.8806 7.5334 7.5334 8.9022 8.9022 12.9240 12.9240 13.0719 13.0719 14.7614 14.7614 15.0469 15.0469 15.7435 15.7435 15.9894 15.9894 17.3162 17.3162 k = 0.4076 0.4321 0.2548 ( 2394 PWs) bands (ev): -47.6680 -47.6680 -47.6333 -47.6333 -21.9753 -21.9753 -21.8653 -21.8653 -14.3653 -14.3653 -14.2143 -14.2143 -14.0648 -14.0648 -13.9847 -13.9847 4.9241 4.9241 5.0252 5.0252 5.6407 5.6407 5.6692 5.6692 5.8748 5.8748 7.5807 7.5807 8.9832 8.9832 12.9430 12.9430 13.0981 13.0981 14.7505 14.7505 14.9860 14.9860 15.7082 15.7082 16.0006 16.0006 17.2514 17.2514 k = 0.4024 0.4453 0.2689 ( 2395 PWs) bands (ev): -47.6672 -47.6672 -47.6333 -47.6333 -21.9756 -21.9756 -21.8681 -21.8681 -14.3665 -14.3665 -14.2203 -14.2203 -14.0678 -14.0678 -13.9872 -13.9872 4.9275 4.9275 5.0271 5.0271 5.6418 5.6418 5.6687 5.6687 5.8692 5.8692 7.6307 7.6307 9.0675 9.0675 12.9615 12.9615 13.1236 13.1236 14.7307 14.7307 14.9232 14.9232 15.6758 15.6758 16.0174 16.0174 17.1868 17.1868 k = 0.3973 0.4584 0.2831 ( 2395 PWs) bands (ev): -47.6664 -47.6664 -47.6333 -47.6333 -21.9759 -21.9759 -21.8710 -21.8710 -14.3678 -14.3678 -14.2262 -14.2262 -14.0709 -14.0709 -13.9896 -13.9896 4.9307 4.9307 5.0284 5.0284 5.6433 5.6433 5.6683 5.6683 5.8639 5.8639 7.6833 7.6833 9.1549 9.1549 12.9789 12.9789 13.1481 13.1481 14.7011 14.7011 14.8593 14.8593 15.6493 15.6493 16.0368 16.0368 17.1228 17.1228 k = 0.3922 0.4716 0.2972 ( 2397 PWs) bands (ev): -47.6656 -47.6656 -47.6333 -47.6333 -21.9761 -21.9761 -21.8739 -21.8739 -14.3694 -14.3694 -14.2324 -14.2324 -14.0741 -14.0741 -13.9918 -13.9918 4.9338 4.9338 5.0292 5.0292 5.6453 5.6453 5.6679 5.6679 5.8590 5.8590 7.7386 7.7386 9.2452 9.2452 12.9945 12.9945 13.1712 13.1712 14.6614 14.6614 14.7956 14.7956 15.6295 15.6295 16.0566 16.0566 17.0595 17.0595 k = 0.3870 0.4848 0.3114 ( 2401 PWs) bands (ev): -47.6647 -47.6647 -47.6333 -47.6333 -21.9764 -21.9764 -21.8770 -21.8770 -14.3712 -14.3712 -14.2386 -14.2386 -14.0773 -14.0773 -13.9940 -13.9940 4.9366 4.9366 5.0295 5.0295 5.6477 5.6477 5.6676 5.6676 5.8546 5.8546 7.7965 7.7965 9.3382 9.3382 13.0073 13.0073 13.1929 13.1929 14.6122 14.6122 14.7329 14.7329 15.6162 15.6162 16.0757 16.0757 16.9970 16.9970 k = 0.3819 0.4980 0.3256 ( 2403 PWs) bands (ev): -47.6639 -47.6639 -47.6333 -47.6333 -21.9765 -21.9765 -21.8802 -21.8802 -14.3732 -14.3732 -14.2449 -14.2449 -14.0803 -14.0803 -13.9961 -13.9961 4.9393 4.9393 5.0291 5.0291 5.6501 5.6501 5.6675 5.6675 5.8509 5.8509 7.8571 7.8571 9.4337 9.4337 13.0159 13.0159 13.2133 13.2133 14.5555 14.5555 14.6718 14.6718 15.6082 15.6082 16.0928 16.0928 16.9356 16.9356 k = 0.3768 0.5112 0.3397 ( 2403 PWs) bands (ev): -47.6630 -47.6630 -47.6334 -47.6334 -21.9767 -21.9767 -21.8833 -21.8833 -14.3754 -14.3754 -14.2513 -14.2513 -14.0831 -14.0831 -13.9981 -13.9981 4.9418 4.9418 5.0282 5.0282 5.6523 5.6523 5.6678 5.6678 5.8478 5.8478 7.9202 7.9202 9.5316 9.5316 13.0185 13.0185 13.2326 13.2326 14.4942 14.4942 14.6118 14.6118 15.6042 15.6042 16.1070 16.1070 16.8754 16.8754 k = 0.3716 0.5244 0.3539 ( 2399 PWs) bands (ev): -47.6620 -47.6620 -47.6334 -47.6334 -21.9768 -21.9768 -21.8865 -21.8865 -14.3777 -14.3777 -14.2577 -14.2577 -14.0856 -14.0856 -14.0000 -14.0000 4.9442 4.9442 5.0268 5.0268 5.6541 5.6541 5.6688 5.6688 5.8456 5.8456 7.9859 7.9859 9.6316 9.6316 13.0130 13.0130 13.2513 13.2513 14.4315 14.4315 14.5527 14.5527 15.6027 15.6027 16.1175 16.1175 16.8167 16.8167 k = 0.3665 0.5376 0.3680 ( 2399 PWs) bands (ev): -47.6611 -47.6611 -47.6335 -47.6335 -21.9768 -21.9768 -21.8898 -21.8898 -14.3801 -14.3801 -14.2644 -14.2644 -14.0879 -14.0879 -14.0020 -14.0020 4.9464 4.9464 5.0248 5.0248 5.6548 5.6548 5.6706 5.6706 5.8443 5.8443 8.0542 8.0542 9.7336 9.7336 12.9971 12.9971 13.2701 13.2701 14.3702 14.3702 14.4943 14.4943 15.6024 15.6024 16.1236 16.1236 16.7594 16.7594 k = 0.3614 0.5508 0.3822 ( 2401 PWs) bands (ev): -47.6602 -47.6602 -47.6336 -47.6336 -21.9768 -21.9768 -21.8931 -21.8931 -14.3826 -14.3826 -14.2711 -14.2711 -14.0898 -14.0898 -14.0039 -14.0039 4.9485 4.9485 5.0224 5.0224 5.6547 5.6547 5.6731 5.6731 5.8438 5.8438 8.1249 8.1249 9.8372 9.8372 12.9688 12.9688 13.2892 13.2892 14.3125 14.3125 14.4373 14.4373 15.6021 15.6021 16.1246 16.1246 16.7038 16.7038 k = 0.3562 0.5640 0.3963 ( 2405 PWs) bands (ev): -47.6592 -47.6592 -47.6337 -47.6337 -21.9768 -21.9768 -21.8965 -21.8965 -14.3852 -14.3852 -14.2780 -14.2780 -14.0914 -14.0914 -14.0060 -14.0060 4.9503 4.9503 5.0196 5.0196 5.6538 5.6538 5.6760 5.6760 5.8442 5.8442 8.1981 8.1981 9.9423 9.9423 12.9269 12.9269 13.3090 13.3090 14.2598 14.2598 14.3825 14.3825 15.6008 15.6008 16.1205 16.1205 16.6500 16.6500 k = 0.3511 0.5772 0.4105 ( 2409 PWs) bands (ev): -47.6583 -47.6583 -47.6338 -47.6338 -21.9766 -21.9766 -21.8999 -21.8999 -14.3878 -14.3878 -14.2850 -14.2850 -14.0925 -14.0925 -14.0080 -14.0080 4.9520 4.9520 5.0164 5.0164 5.6524 5.6524 5.6790 5.6790 5.8456 5.8456 8.2737 8.2737 10.0486 10.0486 12.8705 12.8705 13.3292 13.3292 14.2123 14.2123 14.3315 14.3315 15.5979 15.5979 16.1110 16.1110 16.5980 16.5980 k = 0.3460 0.5904 0.4246 ( 2409 PWs) bands (ev): -47.6573 -47.6573 -47.6340 -47.6340 -21.9764 -21.9764 -21.9033 -21.9033 -14.3904 -14.3904 -14.2920 -14.2920 -14.0931 -14.0931 -14.0101 -14.0101 4.9536 4.9536 5.0130 5.0130 5.6507 5.6507 5.6819 5.6819 5.8480 5.8480 8.3516 8.3516 10.1559 10.1559 12.7998 12.7998 13.3496 13.3496 14.1688 14.1688 14.2865 14.2865 15.5927 15.5927 16.0965 16.0965 16.5478 16.5478 k = 0.3408 0.6035 0.4388 ( 2409 PWs) bands (ev): -47.6563 -47.6563 -47.6341 -47.6341 -21.9762 -21.9762 -21.9066 -21.9066 -14.3930 -14.3930 -14.2991 -14.2991 -14.0934 -14.0934 -14.0123 -14.0123 4.9551 4.9551 5.0095 5.0095 5.6487 5.6487 5.6847 5.6847 5.8511 5.8511 8.4318 8.4318 10.2639 10.2639 12.7157 12.7157 13.3698 13.3698 14.1270 14.1270 14.2502 14.2502 15.5848 15.5848 16.0775 16.0775 16.4996 16.4996 k = 0.3357 0.6167 0.4530 ( 2399 PWs) bands (ev): -47.6554 -47.6554 -47.6343 -47.6343 -21.9756 -21.9756 -21.9099 -21.9099 -14.3954 -14.3954 -14.3062 -14.3062 -14.0931 -14.0931 -14.0145 -14.0145 4.9565 4.9565 5.0060 5.0060 5.6466 5.6466 5.6873 5.6873 5.8552 5.8552 8.5142 8.5142 10.3723 10.3723 12.6194 12.6194 13.3893 13.3893 14.0848 14.0848 14.2246 14.2246 15.5741 15.5741 16.0545 16.0545 16.4532 16.4532 k = 0.3306 0.6299 0.4671 ( 2399 PWs) bands (ev): -47.6544 -47.6544 -47.6345 -47.6345 -21.9752 -21.9752 -21.9133 -21.9133 -14.3977 -14.3977 -14.3134 -14.3134 -14.0925 -14.0925 -14.0168 -14.0168 4.9577 4.9577 5.0023 5.0023 5.6443 5.6443 5.6896 5.6896 5.8597 5.8597 8.5987 8.5987 10.4807 10.4807 12.5124 12.5124 13.4079 13.4079 14.0417 14.0417 14.2100 14.2100 15.5603 15.5603 16.0284 16.0284 16.4087 16.4087 k = 0.3254 0.6431 0.4813 ( 2401 PWs) bands (ev): -47.6534 -47.6534 -47.6348 -47.6348 -21.9747 -21.9747 -21.9167 -21.9167 -14.3998 -14.3998 -14.3205 -14.3205 -14.0916 -14.0916 -14.0192 -14.0192 4.9587 4.9587 4.9986 4.9986 5.6418 5.6418 5.6916 5.6916 5.8647 5.8647 8.6853 8.6853 10.5888 10.5888 12.3963 12.3963 13.4252 13.4252 13.9985 13.9985 14.2050 14.2050 15.5436 15.5436 15.9998 15.9998 16.3661 16.3661 k = 0.3203 0.6563 0.4954 ( 2401 PWs) bands (ev): -47.6525 -47.6525 -47.6350 -47.6350 -21.9740 -21.9740 -21.9200 -21.9200 -14.4017 -14.4017 -14.3276 -14.3276 -14.0904 -14.0904 -14.0216 -14.0216 4.9596 4.9596 4.9950 4.9950 5.6393 5.6393 5.6934 5.6934 5.8701 5.8701 8.7737 8.7737 10.6963 10.6963 12.2727 12.2727 13.4409 13.4409 13.9562 13.9562 14.2082 14.2082 15.5239 15.5239 15.9695 15.9695 16.3255 16.3255 k = 0.3152 0.6695 0.5096 ( 2395 PWs) bands (ev): -47.6515 -47.6515 -47.6353 -47.6353 -21.9732 -21.9732 -21.9231 -21.9231 -14.4034 -14.4034 -14.3345 -14.3345 -14.0888 -14.0888 -14.0242 -14.0242 4.9605 4.9605 4.9917 4.9917 5.6369 5.6369 5.6950 5.6950 5.8757 5.8757 8.8640 8.8640 10.8026 10.8026 12.1429 12.1429 13.4547 13.4547 13.9159 13.9159 14.2180 14.2180 15.5015 15.5015 15.9381 15.9381 16.2867 16.2867 k = 0.3100 0.6827 0.5237 ( 2395 PWs) bands (ev): -47.6506 -47.6506 -47.6357 -47.6357 -21.9724 -21.9724 -21.9263 -21.9263 -14.4048 -14.4048 -14.3413 -14.3413 -14.0869 -14.0869 -14.0268 -14.0268 4.9611 4.9611 4.9886 4.9886 5.6344 5.6344 5.6965 5.6965 5.8814 5.8814 8.9561 8.9561 10.9073 10.9073 12.0083 12.0083 13.4665 13.4665 13.8782 13.8782 14.2335 14.2335 15.4765 15.4765 15.9062 15.9062 16.2499 16.2499 k = 0.3049 0.6959 0.5379 ( 2397 PWs) bands (ev): -47.6497 -47.6497 -47.6360 -47.6360 -21.9715 -21.9715 -21.9295 -21.9295 -14.4060 -14.4060 -14.3480 -14.3480 -14.0849 -14.0849 -14.0296 -14.0296 4.9615 4.9615 4.9857 4.9857 5.6320 5.6320 5.6977 5.6977 5.8869 5.8869 9.0496 9.0496 11.0097 11.0097 11.8702 11.8702 13.4760 13.4760 13.8438 13.8438 14.2539 14.2539 15.4493 15.4493 15.8742 15.8742 16.2151 16.2151 k = 0.2997 0.7091 0.5520 ( 2399 PWs) bands (ev): -47.6488 -47.6488 -47.6364 -47.6364 -21.9705 -21.9705 -21.9327 -21.9327 -14.4069 -14.4069 -14.3546 -14.3546 -14.0826 -14.0826 -14.0324 -14.0324 4.9618 4.9618 4.9831 4.9831 5.6298 5.6298 5.6989 5.6989 5.8924 5.8924 9.1446 9.1446 11.1085 11.1085 11.7301 11.7301 13.4832 13.4832 13.8132 13.8132 14.2784 14.2784 15.4200 15.4200 15.8428 15.8428 16.1824 16.1824 k = 0.2946 0.7223 0.5662 ( 2399 PWs) bands (ev): -47.6479 -47.6479 -47.6368 -47.6368 -21.9693 -21.9693 -21.9357 -21.9357 -14.4073 -14.4073 -14.3609 -14.3609 -14.0801 -14.0801 -14.0352 -14.0352 4.9620 4.9620 4.9809 4.9809 5.6278 5.6278 5.6999 5.6999 5.8975 5.8975 9.2409 9.2409 11.2009 11.2009 11.5913 11.5913 13.4880 13.4880 13.7866 13.7866 14.3065 14.3065 15.3890 15.3890 15.8123 15.8123 16.1517 16.1517 k = 0.2895 0.7354 0.5803 ( 2403 PWs) bands (ev): -47.6470 -47.6470 -47.6373 -47.6373 -21.9681 -21.9681 -21.9387 -21.9387 -14.4075 -14.4075 -14.3669 -14.3669 -14.0774 -14.0774 -14.0381 -14.0381 4.9620 4.9620 4.9791 4.9791 5.6259 5.6259 5.7008 5.7008 5.9023 5.9023 9.3383 9.3383 11.2720 11.2720 11.4686 11.4686 13.4905 13.4905 13.7645 13.7645 14.3377 14.3377 15.3566 15.3566 15.7830 15.7830 16.1232 16.1232 k = 0.2843 0.7486 0.5945 ( 2403 PWs) bands (ev): -47.6461 -47.6461 -47.6377 -47.6377 -21.9667 -21.9667 -21.9416 -21.9416 -14.4073 -14.4073 -14.3727 -14.3727 -14.0747 -14.0747 -14.0411 -14.0411 4.9619 4.9619 4.9778 4.9778 5.6242 5.6242 5.7016 5.7016 5.9068 5.9068 9.4367 9.4367 11.2384 11.2384 11.4458 11.4458 13.4909 13.4909 13.7469 13.7469 14.3715 14.3715 15.3230 15.3230 15.7553 15.7553 16.0969 16.0969 k = 0.2792 0.7618 0.6087 ( 2403 PWs) bands (ev): -47.6453 -47.6453 -47.6383 -47.6383 -21.9652 -21.9652 -21.9445 -21.9445 -14.4067 -14.4067 -14.3780 -14.3780 -14.0718 -14.0718 -14.0440 -14.0440 4.9617 4.9617 4.9768 4.9768 5.6228 5.6228 5.7024 5.7024 5.9107 5.9107 9.5358 9.5358 11.1104 11.1104 11.5121 11.5121 13.4895 13.4895 13.7338 13.7338 14.4077 14.4077 15.2887 15.2887 15.7295 15.7295 16.0729 16.0729 k = 0.2741 0.7750 0.6228 ( 2407 PWs) bands (ev): -47.6445 -47.6445 -47.6388 -47.6388 -21.9636 -21.9636 -21.9472 -21.9472 -14.4059 -14.4059 -14.3830 -14.3830 -14.0690 -14.0690 -14.0470 -14.0470 4.9616 4.9616 4.9762 4.9762 5.6216 5.6216 5.7031 5.7031 5.9141 5.9141 9.6354 9.6354 10.9664 10.9664 11.5892 11.5892 13.4868 13.4868 13.7250 13.7250 14.4457 14.4457 15.2541 15.2541 15.7059 15.7059 16.0511 16.0511 k = 0.2689 0.7882 0.6370 ( 2403 PWs) bands (ev): -47.6437 -47.6437 -47.6393 -47.6393 -21.9618 -21.9618 -21.9498 -21.9498 -14.4046 -14.4046 -14.3875 -14.3875 -14.0662 -14.0662 -14.0497 -14.0497 4.9615 4.9615 4.9759 4.9759 5.6207 5.6207 5.7038 5.7038 5.9170 5.9170 9.7353 9.7353 10.8191 10.8191 11.6645 11.6645 13.4835 13.4835 13.7198 13.7198 14.4852 14.4852 15.2195 15.2195 15.6847 15.6847 16.0316 16.0316 k = 0.2689 0.7882 0.6370 ( 2403 PWs) bands (ev): -47.6437 -47.6437 -47.6393 -47.6393 -21.9618 -21.9618 -21.9498 -21.9498 -14.4046 -14.4046 -14.3875 -14.3875 -14.0662 -14.0662 -14.0497 -14.0497 4.9615 4.9615 4.9759 4.9759 5.6207 5.6207 5.7038 5.7038 5.9170 5.9170 9.7353 9.7353 10.8191 10.8191 11.6645 11.6645 13.4835 13.4835 13.7198 13.7198 14.4852 14.4852 15.2195 15.2195 15.6847 15.6847 16.0316 16.0316 k = 0.2497 0.7847 0.6407 ( 2405 PWs) bands (ev): -47.6435 -47.6435 -47.6395 -47.6395 -21.9613 -21.9613 -21.9505 -21.9505 -14.4043 -14.4043 -14.3886 -14.3886 -14.0656 -14.0656 -14.0504 -14.0504 4.9615 4.9615 4.9759 4.9759 5.6205 5.6205 5.7040 5.7040 5.9177 5.9177 9.7617 9.7617 10.7781 10.7781 11.6862 11.6862 13.4781 13.4781 13.7230 13.7230 14.4974 14.4974 15.2094 15.2094 15.6793 15.6793 16.0264 16.0264 k = 0.2305 0.7813 0.6444 ( 2405 PWs) bands (ev): -47.6433 -47.6433 -47.6396 -47.6396 -21.9609 -21.9609 -21.9511 -21.9511 -14.4041 -14.4041 -14.3896 -14.3896 -14.0650 -14.0650 -14.0510 -14.0510 4.9614 4.9614 4.9760 4.9760 5.6204 5.6204 5.7042 5.7042 5.9183 5.9183 9.7882 9.7882 10.7339 10.7339 11.7116 11.7116 13.4649 13.4649 13.7334 13.7334 14.5124 14.5124 15.1974 15.1974 15.6738 15.6738 16.0203 16.0203 k = 0.2113 0.7778 0.6482 ( 2406 PWs) bands (ev): -47.6431 -47.6431 -47.6398 -47.6398 -21.9605 -21.9605 -21.9517 -21.9517 -14.4039 -14.4039 -14.3904 -14.3904 -14.0646 -14.0646 -14.0514 -14.0514 4.9613 4.9613 4.9762 4.9762 5.6203 5.6203 5.7043 5.7043 5.9189 5.9189 9.8151 9.8151 10.6875 10.6875 11.7394 11.7394 13.4463 13.4463 13.7485 13.7485 14.5304 14.5304 15.1834 15.1834 15.6682 15.6682 16.0137 16.0137 k = 0.1921 0.7743 0.6519 ( 2406 PWs) bands (ev): -47.6429 -47.6429 -47.6399 -47.6399 -21.9602 -21.9602 -21.9522 -21.9522 -14.4038 -14.4038 -14.3912 -14.3912 -14.0642 -14.0642 -14.0518 -14.0518 4.9611 4.9611 4.9766 4.9766 5.6202 5.6202 5.7045 5.7045 5.9194 5.9194 9.8425 9.8425 10.6398 10.6398 11.7685 11.7685 13.4246 13.4246 13.7660 13.7660 14.5510 14.5510 15.1675 15.1675 15.6627 15.6627 16.0067 16.0067 k = 0.1729 0.7708 0.6556 ( 2403 PWs) bands (ev): -47.6427 -47.6427 -47.6401 -47.6401 -21.9598 -21.9598 -21.9526 -21.9526 -14.4037 -14.4037 -14.3918 -14.3918 -14.0639 -14.0639 -14.0520 -14.0520 4.9609 4.9609 4.9770 4.9770 5.6201 5.6201 5.7048 5.7048 5.9200 5.9200 9.8706 9.8706 10.5914 10.5914 11.7979 11.7979 13.4018 13.4018 13.7841 13.7841 14.5743 14.5743 15.1498 15.1498 15.6573 15.6573 15.9996 15.9996 k = 0.1537 0.7674 0.6593 ( 2402 PWs) bands (ev): -47.6426 -47.6426 -47.6402 -47.6402 -21.9596 -21.9596 -21.9530 -21.9530 -14.4036 -14.4036 -14.3923 -14.3923 -14.0636 -14.0636 -14.0522 -14.0522 4.9607 4.9607 4.9775 4.9775 5.6201 5.6201 5.7050 5.7050 5.9204 5.9204 9.8995 9.8995 10.5429 10.5429 11.8267 11.8267 13.3790 13.3790 13.8016 13.8016 14.5999 14.5999 15.1301 15.1301 15.6521 15.6521 15.9926 15.9926 k = 0.1345 0.7639 0.6631 ( 2400 PWs) bands (ev): -47.6424 -47.6424 -47.6403 -47.6403 -21.9593 -21.9593 -21.9533 -21.9533 -14.4036 -14.4036 -14.3928 -14.3928 -14.0634 -14.0634 -14.0524 -14.0524 4.9605 4.9605 4.9779 4.9779 5.6201 5.6201 5.7052 5.7052 5.9209 5.9209 9.9292 9.9292 10.4947 10.4947 11.8540 11.8540 13.3572 13.3572 13.8176 13.8176 14.6276 14.6276 15.1088 15.1088 15.6472 15.6472 15.9858 15.9858 k = 0.1153 0.7604 0.6668 ( 2396 PWs) bands (ev): -47.6422 -47.6422 -47.6404 -47.6404 -21.9591 -21.9591 -21.9536 -21.9536 -14.4036 -14.4036 -14.3931 -14.3931 -14.0633 -14.0633 -14.0525 -14.0525 4.9603 4.9603 4.9784 4.9784 5.6201 5.6201 5.7054 5.7054 5.9213 5.9213 9.9599 9.9599 10.4472 10.4472 11.8793 11.8793 13.3371 13.3371 13.8318 13.8318 14.6568 14.6568 15.0859 15.0859 15.6428 15.6428 15.9796 15.9796 k = 0.0961 0.7569 0.6705 ( 2397 PWs) bands (ev): -47.6421 -47.6421 -47.6406 -47.6406 -21.9589 -21.9589 -21.9539 -21.9539 -14.4036 -14.4036 -14.3935 -14.3935 -14.0632 -14.0632 -14.0525 -14.0525 4.9601 4.9601 4.9788 4.9788 5.6201 5.6201 5.7055 5.7055 5.9216 5.9216 9.9916 9.9916 10.4008 10.4008 11.9018 11.9018 13.3193 13.3193 13.8438 13.8438 14.6872 14.6872 15.0618 15.0618 15.6389 15.6389 15.9740 15.9740 k = 0.0768 0.7535 0.6743 ( 2403 PWs) bands (ev): -47.6420 -47.6420 -47.6407 -47.6407 -21.9588 -21.9588 -21.9542 -21.9542 -14.4036 -14.4036 -14.3938 -14.3938 -14.0631 -14.0631 -14.0526 -14.0526 4.9599 4.9599 4.9791 4.9791 5.6200 5.6200 5.7056 5.7056 5.9218 5.9218 10.0242 10.0242 10.3558 10.3558 11.9210 11.9210 13.3041 13.3041 13.8536 13.8536 14.7176 14.7176 15.0369 15.0369 15.6357 15.6357 15.9692 15.9692 k = 0.0576 0.7500 0.6780 ( 2406 PWs) bands (ev): -47.6419 -47.6419 -47.6408 -47.6408 -21.9587 -21.9587 -21.9544 -21.9544 -14.4037 -14.4037 -14.3940 -14.3940 -14.0631 -14.0631 -14.0527 -14.0527 4.9597 4.9597 4.9793 4.9793 5.6200 5.6200 5.7057 5.7057 5.9220 5.9220 10.0575 10.0575 10.3126 10.3126 11.9365 11.9365 13.2920 13.2920 13.8611 13.8611 14.7470 14.7470 15.0123 15.0123 15.6330 15.6330 15.9654 15.9654 k = 0.0384 0.7465 0.6817 ( 2407 PWs) bands (ev): -47.6418 -47.6418 -47.6409 -47.6409 -21.9587 -21.9587 -21.9544 -21.9544 -14.4037 -14.4037 -14.3941 -14.3941 -14.0631 -14.0631 -14.0527 -14.0527 4.9596 4.9596 4.9795 4.9795 5.6200 5.6200 5.7057 5.7057 5.9221 5.9221 10.0906 10.0906 10.2724 10.2724 11.9478 11.9478 13.2832 13.2832 13.8664 13.8664 14.7732 14.7732 14.9897 14.9897 15.6311 15.6311 15.9625 15.9625 k = 0.0192 0.7430 0.6854 ( 2408 PWs) bands (ev): -47.6417 -47.6417 -47.6409 -47.6409 -21.9586 -21.9586 -21.9545 -21.9545 -14.4037 -14.4037 -14.3942 -14.3942 -14.0631 -14.0631 -14.0527 -14.0527 4.9595 4.9595 4.9797 4.9797 5.6200 5.6200 5.7058 5.7058 5.9222 5.9222 10.1207 10.1207 10.2380 10.2380 11.9547 11.9547 13.2778 13.2778 13.8696 13.8696 14.7927 14.7927 14.9726 14.9726 15.6300 15.6300 15.9608 15.9608 k = 0.0000 0.7396 0.6892 ( 2408 PWs) bands (ev): -47.6417 -47.6417 -47.6410 -47.6410 -21.9587 -21.9587 -21.9545 -21.9545 -14.4038 -14.4038 -14.3942 -14.3942 -14.0631 -14.0631 -14.0527 -14.0527 4.9595 4.9595 4.9797 4.9797 5.6200 5.6200 5.7058 5.7058 5.9222 5.9222 10.1357 10.1357 10.2215 10.2215 11.9570 11.9570 13.2759 13.2759 13.8706 13.8706 14.8001 14.8001 14.9659 14.9659 15.6296 15.6296 15.9602 15.9602 k = 0.0000 0.7396 0.6892 ( 2408 PWs) bands (ev): -47.6417 -47.6417 -47.6410 -47.6410 -21.9587 -21.9587 -21.9545 -21.9545 -14.4038 -14.4038 -14.3942 -14.3942 -14.0631 -14.0631 -14.0527 -14.0527 4.9595 4.9595 4.9797 4.9797 5.6200 5.6200 5.7058 5.7058 5.9222 5.9222 10.1357 10.1357 10.2215 10.2215 11.9570 11.9570 13.2759 13.2759 13.8706 13.8706 14.8001 14.8001 14.9659 14.9659 15.6296 15.6296 15.9602 15.9602 k = 0.0051 0.7264 0.7032 ( 2408 PWs) bands (ev): -47.6417 -47.6417 -47.6409 -47.6409 -21.9587 -21.9587 -21.9546 -21.9546 -14.4042 -14.4042 -14.3938 -14.3938 -14.0637 -14.0637 -14.0525 -14.0525 4.9597 4.9597 4.9799 4.9799 5.6199 5.6199 5.7056 5.7056 5.9221 5.9221 10.1380 10.1380 10.2222 10.2222 11.9586 11.9586 13.2755 13.2755 13.8685 13.8685 14.8006 14.8006 14.9640 14.9640 15.6306 15.6306 15.9619 15.9619 k = 0.0102 0.7133 0.7173 ( 2406 PWs) bands (ev): -47.6416 -47.6416 -47.6409 -47.6409 -21.9588 -21.9588 -21.9547 -21.9547 -14.4052 -14.4052 -14.3926 -14.3926 -14.0655 -14.0655 -14.0521 -14.0521 4.9604 4.9604 4.9804 4.9804 5.6196 5.6196 5.7053 5.7053 5.9218 5.9218 10.1446 10.1446 10.2242 10.2242 11.9633 11.9633 13.2741 13.2741 13.8623 13.8623 14.8022 14.8022 14.9584 14.9584 15.6334 15.6334 15.9669 15.9669 k = 0.0153 0.7002 0.7314 ( 2402 PWs) bands (ev): -47.6416 -47.6416 -47.6408 -47.6408 -21.9590 -21.9590 -21.9548 -21.9548 -14.4066 -14.4066 -14.3910 -14.3910 -14.0682 -14.0682 -14.0517 -14.0517 4.9614 4.9614 4.9813 4.9813 5.6191 5.6191 5.7046 5.7046 5.9213 5.9213 10.1555 10.1555 10.2278 10.2278 11.9710 11.9710 13.2718 13.2718 13.8519 13.8519 14.8047 14.8047 14.9495 14.9495 15.6379 15.6379 15.9752 15.9752 k = 0.0204 0.6871 0.7454 ( 2404 PWs) bands (ev): -47.6415 -47.6415 -47.6407 -47.6407 -21.9594 -21.9594 -21.9552 -21.9552 -14.4082 -14.4082 -14.3891 -14.3891 -14.0715 -14.0715 -14.0515 -14.0515 4.9626 4.9626 4.9826 4.9826 5.6182 5.6182 5.7038 5.7038 5.9205 5.9205 10.1704 10.1704 10.2331 10.2331 11.9817 11.9817 13.2685 13.2685 13.8375 13.8375 14.8080 14.8080 14.9382 14.9382 15.6439 15.6439 15.9865 15.9865 k = 0.0255 0.6740 0.7595 ( 2404 PWs) bands (ev): -47.6414 -47.6414 -47.6406 -47.6406 -21.9598 -21.9598 -21.9555 -21.9555 -14.4098 -14.4098 -14.3871 -14.3871 -14.0755 -14.0755 -14.0517 -14.0517 4.9641 4.9641 4.9842 4.9842 5.6172 5.6172 5.7027 5.7027 5.9195 5.9195 10.1885 10.1885 10.2408 10.2408 11.9954 11.9954 13.2639 13.2639 13.8192 13.8192 14.8115 14.8115 14.9257 14.9257 15.6510 15.6510 16.0009 16.0009 k = 0.0306 0.6609 0.7736 ( 2400 PWs) bands (ev): -47.6412 -47.6412 -47.6405 -47.6405 -21.9603 -21.9603 -21.9560 -21.9560 -14.4115 -14.4115 -14.3850 -14.3850 -14.0799 -14.0799 -14.0522 -14.0522 4.9658 4.9658 4.9864 4.9864 5.6160 5.6160 5.7016 5.7016 5.9185 5.9185 10.2082 10.2082 10.2526 10.2526 12.0118 12.0118 13.2581 13.2581 13.7971 13.7971 14.8139 14.8139 14.9142 14.9142 15.6588 15.6588 16.0182 16.0182 k = 0.0357 0.6478 0.7876 ( 2398 PWs) bands (ev): -47.6410 -47.6410 -47.6403 -47.6403 -21.9608 -21.9608 -21.9565 -21.9565 -14.4132 -14.4132 -14.3828 -14.3828 -14.0847 -14.0847 -14.0531 -14.0531 4.9675 4.9675 4.9889 4.9889 5.6146 5.6146 5.7003 5.7003 5.9173 5.9173 10.2265 10.2265 10.2713 10.2713 12.0308 12.0308 13.2509 13.2509 13.7716 13.7716 14.8126 14.8126 14.9072 14.9072 15.6672 15.6672 16.0382 16.0382 k = 0.0408 0.6347 0.8017 ( 2402 PWs) bands (ev): -47.6408 -47.6408 -47.6401 -47.6401 -21.9616 -21.9616 -21.9572 -21.9572 -14.4149 -14.4149 -14.3805 -14.3805 -14.0901 -14.0901 -14.0544 -14.0544 4.9691 4.9691 4.9918 4.9918 5.6129 5.6129 5.6990 5.6990 5.9160 5.9160 10.2413 10.2413 10.2987 10.2987 12.0522 12.0522 13.2421 13.2421 13.7429 13.7429 14.8048 14.8048 14.9084 14.9084 15.6759 15.6759 16.0609 16.0609 k = 0.0459 0.6216 0.8158 ( 2398 PWs) bands (ev): -47.6406 -47.6406 -47.6399 -47.6399 -21.9622 -21.9622 -21.9579 -21.9579 -14.4165 -14.4165 -14.3782 -14.3782 -14.0958 -14.0958 -14.0560 -14.0560 4.9707 4.9707 4.9951 4.9951 5.6111 5.6111 5.6979 5.6979 5.9147 5.9147 10.2542 10.2542 10.3335 10.3335 12.0758 12.0758 13.2316 13.2316 13.7113 13.7113 14.7903 14.7903 14.9186 14.9186 15.6846 15.6846 16.0860 16.0860 k = 0.0510 0.6085 0.8298 ( 2396 PWs) bands (ev): -47.6404 -47.6404 -47.6396 -47.6396 -21.9630 -21.9630 -21.9587 -21.9587 -14.4182 -14.4182 -14.3759 -14.3759 -14.1018 -14.1018 -14.0580 -14.0580 4.9722 4.9722 4.9986 4.9986 5.6089 5.6089 5.6970 5.6970 5.9135 5.9135 10.2666 10.2666 10.3737 10.3737 12.1013 12.1013 13.2192 13.2192 13.6773 13.6773 14.7713 14.7713 14.9362 14.9362 15.6933 15.6933 16.1136 16.1136 k = 0.0561 0.5954 0.8439 ( 2396 PWs) bands (ev): -47.6401 -47.6401 -47.6394 -47.6394 -21.9639 -21.9639 -21.9595 -21.9595 -14.4198 -14.4198 -14.3735 -14.3735 -14.1083 -14.1083 -14.0603 -14.0603 4.9735 4.9735 5.0021 5.0021 5.6064 5.6064 5.6965 5.6965 5.9123 5.9123 10.2794 10.2794 10.4185 10.4185 12.1285 12.1285 13.2047 13.2047 13.6412 13.6412 14.7500 14.7500 14.9599 14.9599 15.7019 15.7019 16.1436 16.1436 k = 0.0612 0.5823 0.8580 ( 2396 PWs) bands (ev): -47.6398 -47.6398 -47.6391 -47.6391 -21.9649 -21.9649 -21.9604 -21.9604 -14.4215 -14.4215 -14.3712 -14.3712 -14.1151 -14.1151 -14.0630 -14.0630 4.9747 4.9747 5.0056 5.0056 5.6035 5.6035 5.6966 5.6966 5.9113 5.9113 10.2929 10.2929 10.4673 10.4673 12.1569 12.1569 13.1882 13.1882 13.6036 13.6036 14.7279 14.7279 14.9885 14.9885 15.7105 15.7105 16.1760 16.1760 k = 0.0663 0.5692 0.8720 ( 2398 PWs) bands (ev): -47.6395 -47.6395 -47.6388 -47.6388 -21.9660 -21.9660 -21.9615 -21.9615 -14.4231 -14.4231 -14.3688 -14.3688 -14.1222 -14.1222 -14.0659 -14.0659 4.9759 4.9759 5.0089 5.0089 5.6002 5.6002 5.6973 5.6973 5.9105 5.9105 10.3074 10.3074 10.5197 10.5197 12.1863 12.1863 13.1694 13.1694 13.5650 13.5650 14.7057 14.7057 15.0217 15.0217 15.7193 15.7193 16.2106 16.2106 k = 0.0714 0.5561 0.8861 ( 2398 PWs) bands (ev): -47.6392 -47.6392 -47.6385 -47.6385 -21.9670 -21.9670 -21.9626 -21.9626 -14.4247 -14.4247 -14.3664 -14.3664 -14.1295 -14.1295 -14.0692 -14.0692 4.9769 4.9769 5.0119 5.0119 5.5964 5.5964 5.6988 5.6988 5.9100 5.9100 10.3229 10.3229 10.5753 10.5753 12.2162 12.2162 13.1483 13.1483 13.5259 13.5259 14.6841 14.6841 15.0591 15.0591 15.7286 15.7286 16.2476 16.2476 k = 0.0765 0.5429 0.9001 ( 2398 PWs) bands (ev): -47.6389 -47.6389 -47.6381 -47.6381 -21.9682 -21.9682 -21.9637 -21.9637 -14.4263 -14.4263 -14.3641 -14.3641 -14.1371 -14.1371 -14.0727 -14.0727 4.9778 4.9778 5.0145 5.0145 5.5920 5.5920 5.7013 5.7013 5.9097 5.9097 10.3395 10.3395 10.6339 10.6339 12.2463 12.2463 13.1250 13.1250 13.4868 13.4868 14.6634 14.6634 15.1005 15.1005 15.7388 15.7388 16.2867 16.2867 k = 0.0816 0.5298 0.9142 ( 2400 PWs) bands (ev): -47.6385 -47.6385 -47.6378 -47.6378 -21.9694 -21.9694 -21.9649 -21.9649 -14.4279 -14.4279 -14.3617 -14.3617 -14.1449 -14.1449 -14.0765 -14.0765 4.9786 4.9786 5.0165 5.0165 5.5871 5.5871 5.7047 5.7047 5.9099 5.9099 10.3572 10.3572 10.6952 10.6952 12.2760 12.2760 13.0993 13.0993 13.4482 13.4482 14.6439 14.6439 15.1455 15.1455 15.7503 15.7503 16.3281 16.3281 k = 0.0867 0.5167 0.9283 ( 2404 PWs) bands (ev): -47.6381 -47.6381 -47.6374 -47.6374 -21.9707 -21.9707 -21.9662 -21.9662 -14.4295 -14.4295 -14.3595 -14.3595 -14.1528 -14.1528 -14.0805 -14.0805 4.9791 4.9791 5.0180 5.0180 5.5816 5.5816 5.7092 5.7092 5.9106 5.9106 10.3761 10.3761 10.7586 10.7586 12.3050 12.3050 13.0714 13.0714 13.4107 13.4107 14.6258 14.6258 15.1940 15.1940 15.7639 15.7639 16.3717 16.3717 k = 0.0918 0.5036 0.9423 ( 2406 PWs) bands (ev): -47.6378 -47.6378 -47.6370 -47.6370 -21.9720 -21.9720 -21.9675 -21.9675 -14.4311 -14.4311 -14.3573 -14.3573 -14.1608 -14.1608 -14.0846 -14.0846 4.9795 4.9795 5.0188 5.0188 5.5756 5.5756 5.7146 5.7146 5.9118 5.9118 10.3961 10.3961 10.8240 10.8240 12.3328 12.3328 13.0415 13.0415 13.3748 13.3748 14.6091 14.6091 15.2455 15.2455 15.7802 15.7802 16.4174 16.4174 k = 0.0969 0.4905 0.9564 ( 2406 PWs) bands (ev): -47.6374 -47.6374 -47.6366 -47.6366 -21.9734 -21.9734 -21.9688 -21.9688 -14.4326 -14.4326 -14.3551 -14.3551 -14.1689 -14.1689 -14.0889 -14.0889 4.9797 4.9797 5.0190 5.0190 5.5692 5.5692 5.7209 5.7209 5.9137 5.9137 10.4173 10.4173 10.8908 10.8908 12.3591 12.3591 13.0097 13.0097 13.3410 13.3410 14.5939 14.5939 15.2998 15.2998 15.7999 15.7999 16.4652 16.4652 k = 0.1020 0.4774 0.9705 ( 2412 PWs) bands (ev): -47.6370 -47.6370 -47.6362 -47.6362 -21.9748 -21.9748 -21.9702 -21.9702 -14.4342 -14.4342 -14.3531 -14.3531 -14.1770 -14.1770 -14.0934 -14.0934 4.9796 4.9796 5.0186 5.0186 5.5623 5.5623 5.7278 5.7278 5.9163 5.9163 10.4397 10.4397 10.9586 10.9586 12.3833 12.3833 12.9763 12.9763 13.3096 13.3096 14.5798 14.5798 15.3563 15.3563 15.8237 15.8237 16.5149 16.5149 k = 0.1071 0.4643 0.9845 ( 2422 PWs) bands (ev): -47.6366 -47.6366 -47.6358 -47.6358 -21.9763 -21.9763 -21.9717 -21.9717 -14.4358 -14.4358 -14.3513 -14.3513 -14.1852 -14.1852 -14.0981 -14.0981 4.9792 4.9792 5.0174 5.0174 5.5551 5.5551 5.7351 5.7351 5.9199 5.9199 10.4633 10.4633 11.0268 11.0268 12.4053 12.4053 12.9416 12.9416 13.2812 13.2812 14.5668 14.5668 15.4149 15.4149 15.8525 15.8525 16.5666 16.5666 k = 0.1122 0.4512 0.9986 ( 2418 PWs) bands (ev): -47.6362 -47.6362 -47.6354 -47.6354 -21.9777 -21.9777 -21.9731 -21.9731 -14.4372 -14.4372 -14.3496 -14.3496 -14.1930 -14.1930 -14.1027 -14.1027 4.9785 4.9785 5.0159 5.0159 5.5477 5.5477 5.7429 5.7429 5.9245 5.9245 10.4881 10.4881 11.0948 11.0948 12.4247 12.4247 12.9062 12.9062 13.2561 13.2561 14.5547 14.5547 15.4750 15.4750 15.8868 15.8868 16.6202 16.6202 k = 0.1173 0.4381 1.0127 ( 2422 PWs) bands (ev): -47.6358 -47.6358 -47.6350 -47.6350 -21.9791 -21.9791 -21.9746 -21.9746 -14.4387 -14.4387 -14.3482 -14.3482 -14.2008 -14.2008 -14.1075 -14.1075 4.9774 4.9774 5.0139 5.0139 5.5401 5.5401 5.7507 5.7507 5.9303 5.9303 10.5142 10.5142 11.1621 11.1621 12.4412 12.4412 12.8703 12.8703 13.2349 13.2349 14.5430 14.5430 15.5363 15.5363 15.9270 15.9270 16.6755 16.6755 k = 0.1224 0.4250 1.0267 ( 2424 PWs) bands (ev): -47.6354 -47.6354 -47.6346 -47.6346 -21.9806 -21.9806 -21.9761 -21.9761 -14.4401 -14.4401 -14.3470 -14.3470 -14.2083 -14.2083 -14.1123 -14.1123 4.9759 4.9759 5.0115 5.0115 5.5324 5.5324 5.7582 5.7582 5.9374 5.9374 10.5414 10.5414 11.2277 11.2277 12.4548 12.4548 12.8343 12.8343 13.2180 13.2180 14.5315 14.5315 15.5985 15.5985 15.9734 15.9734 16.7325 16.7325 k = 0.1276 0.4119 1.0408 ( 2424 PWs) bands (ev): -47.6349 -47.6349 -47.6342 -47.6342 -21.9820 -21.9820 -21.9775 -21.9775 -14.4415 -14.4415 -14.3461 -14.3461 -14.2154 -14.2154 -14.1171 -14.1171 4.9738 4.9738 5.0089 5.0089 5.5246 5.5246 5.7655 5.7655 5.9458 5.9458 10.5698 10.5698 11.2911 11.2911 12.4653 12.4653 12.7987 12.7987 13.2059 13.2059 14.5200 14.5200 15.6613 15.6613 16.0260 16.0260 16.7912 16.7912 k = 0.1327 0.3988 1.0549 ( 2422 PWs) bands (ev): -47.6345 -47.6345 -47.6337 -47.6337 -21.9835 -21.9835 -21.9789 -21.9789 -14.4428 -14.4428 -14.3457 -14.3457 -14.2220 -14.2220 -14.1219 -14.1219 4.9711 4.9711 5.0063 5.0063 5.5168 5.5168 5.7722 5.7722 5.9555 5.9555 10.5994 10.5994 11.3514 11.3514 12.4727 12.4727 12.7638 12.7638 13.1994 13.1994 14.5082 14.5082 15.7243 15.7243 16.0845 16.0845 16.8514 16.8514 k = 0.1378 0.3857 1.0689 ( 2420 PWs) bands (ev): -47.6341 -47.6341 -47.6333 -47.6333 -21.9849 -21.9849 -21.9803 -21.9803 -14.4441 -14.4441 -14.3458 -14.3458 -14.2281 -14.2281 -14.1266 -14.1266 4.9678 4.9678 5.0037 5.0037 5.5091 5.5091 5.7782 5.7782 5.9665 5.9665 10.6301 10.6301 11.4077 11.4077 12.4771 12.4771 12.7298 12.7298 13.1990 13.1990 14.4960 14.4960 15.7871 15.7871 16.1486 16.1486 16.9132 16.9132 k = 0.1429 0.3726 1.0830 ( 2420 PWs) bands (ev): -47.6337 -47.6337 -47.6329 -47.6329 -21.9864 -21.9864 -21.9817 -21.9817 -14.4454 -14.4454 -14.3464 -14.3464 -14.2336 -14.2336 -14.1314 -14.1314 4.9639 4.9639 5.0012 5.0012 5.5015 5.5015 5.7834 5.7834 5.9788 5.9788 10.6618 10.6618 11.4594 11.4594 12.4786 12.4786 12.6971 12.6971 13.2054 13.2054 14.4832 14.4832 15.8489 15.8489 16.2179 16.2179 16.9764 16.9764 k = 0.1480 0.3595 1.0971 ( 2420 PWs) bands (ev): -47.6333 -47.6333 -47.6325 -47.6325 -21.9878 -21.9878 -21.9831 -21.9831 -14.4465 -14.4465 -14.3476 -14.3476 -14.2383 -14.2383 -14.1362 -14.1362 4.9594 4.9594 4.9989 4.9989 5.4940 5.4940 5.7880 5.7880 5.9920 5.9920 10.6945 10.6945 11.5057 11.5057 12.4772 12.4772 12.6658 12.6658 13.2192 13.2192 14.4698 14.4698 15.9087 15.9087 16.2921 16.2921 17.0410 17.0410 k = 0.1531 0.3463 1.1111 ( 2418 PWs) bands (ev): -47.6329 -47.6329 -47.6321 -47.6321 -21.9892 -21.9892 -21.9844 -21.9844 -14.4476 -14.4476 -14.3495 -14.3495 -14.2423 -14.2423 -14.1409 -14.1409 4.9544 4.9544 4.9967 4.9967 5.4867 5.4867 5.7919 5.7919 6.0061 6.0061 10.7282 10.7282 11.5461 11.5461 12.4732 12.4732 12.6360 12.6360 13.2407 13.2407 14.4560 14.4560 15.9653 15.9653 16.3709 16.3709 17.1065 17.1065 k = 0.1582 0.3332 1.1252 ( 2420 PWs) bands (ev): -47.6325 -47.6325 -47.6317 -47.6317 -21.9905 -21.9905 -21.9858 -21.9858 -14.4486 -14.4486 -14.3521 -14.3521 -14.2454 -14.2454 -14.1455 -14.1455 4.9491 4.9491 4.9946 4.9946 5.4796 5.4796 5.7951 5.7951 6.0208 6.0208 10.7627 10.7627 11.5803 11.5803 12.4667 12.4667 12.6078 12.6078 13.2701 13.2701 14.4418 14.4418 16.0171 16.0171 16.4540 16.4540 17.1721 17.1721 k = 0.1633 0.3201 1.1393 ( 2418 PWs) bands (ev): -47.6321 -47.6321 -47.6313 -47.6313 -21.9919 -21.9919 -21.9871 -21.9871 -14.4494 -14.4494 -14.3553 -14.3553 -14.2477 -14.2477 -14.1501 -14.1501 4.9435 4.9435 4.9927 4.9927 5.4728 5.4728 5.7978 5.7978 6.0359 6.0359 10.7978 10.7978 11.6083 11.6083 12.4579 12.4579 12.5813 12.5813 13.3074 13.3074 14.4273 14.4273 16.0627 16.0627 16.5409 16.5409 17.2356 17.2356 k = 0.1684 0.3070 1.1533 ( 2418 PWs) bands (ev): -47.6317 -47.6317 -47.6309 -47.6309 -21.9932 -21.9932 -21.9884 -21.9884 -14.4502 -14.4502 -14.3591 -14.3591 -14.2492 -14.2492 -14.1546 -14.1546 4.9377 4.9377 4.9908 4.9908 5.4663 5.4663 5.8001 5.8001 6.0512 6.0512 10.8335 10.8335 11.6303 11.6303 12.4470 12.4470 12.5565 12.5565 13.3523 13.3523 14.4128 14.4128 16.1010 16.1010 16.6309 16.6309 17.2883 17.2883 k = 0.1735 0.2939 1.1674 ( 2414 PWs) bands (ev): -47.6314 -47.6314 -47.6306 -47.6306 -21.9944 -21.9944 -21.9895 -21.9895 -14.4507 -14.4507 -14.3634 -14.3634 -14.2500 -14.2500 -14.1590 -14.1590 4.9319 4.9319 4.9891 4.9891 5.4601 5.4601 5.8020 5.8020 6.0665 6.0665 10.8696 10.8696 11.6467 11.6467 12.4345 12.4345 12.5333 12.5333 13.4041 13.4041 14.3983 14.3983 16.1309 16.1309 16.7226 16.7226 17.3047 17.3047 k = 0.1786 0.2808 1.1814 ( 2414 PWs) bands (ev): -47.6310 -47.6310 -47.6303 -47.6303 -21.9956 -21.9956 -21.9907 -21.9907 -14.4512 -14.4512 -14.3681 -14.3681 -14.2502 -14.2502 -14.1633 -14.1633 4.9260 4.9260 4.9874 4.9874 5.4542 5.4542 5.8035 5.8035 6.0815 6.0815 10.9058 10.9058 11.6582 11.6582 12.4206 12.4206 12.5115 12.5115 13.4621 13.4621 14.3843 14.3843 16.1518 16.1518 16.8137 16.8137 17.2789 17.2789 k = 0.1837 0.2677 1.1955 ( 2416 PWs) bands (ev): -47.6307 -47.6307 -47.6299 -47.6299 -21.9967 -21.9967 -21.9918 -21.9918 -14.4515 -14.4515 -14.3731 -14.3731 -14.2499 -14.2499 -14.1675 -14.1675 4.9203 4.9203 4.9857 4.9857 5.4487 5.4487 5.8047 5.8047 6.0961 6.0961 10.9420 10.9420 11.6654 11.6654 12.4058 12.4058 12.4909 12.4909 13.5250 13.5250 14.3708 14.3708 16.1635 16.1635 16.8996 16.8996 17.2423 17.2423 k = 0.1888 0.2546 1.2096 ( 2416 PWs) bands (ev): -47.6304 -47.6304 -47.6296 -47.6296 -21.9978 -21.9978 -21.9928 -21.9928 -14.4516 -14.4516 -14.3783 -14.3783 -14.2491 -14.2491 -14.1716 -14.1716 4.9148 4.9148 4.9841 4.9841 5.4435 5.4435 5.8057 5.8057 6.1102 6.1102 10.9779 10.9779 11.6690 11.6690 12.3906 12.3906 12.4715 12.4715 13.5918 13.5918 14.3583 14.3583 16.1662 16.1662 16.9685 16.9685 17.2181 17.2181 k = 0.1939 0.2415 1.2236 ( 2414 PWs) bands (ev): -47.6301 -47.6301 -47.6293 -47.6293 -21.9988 -21.9988 -21.9938 -21.9938 -14.4515 -14.4515 -14.3835 -14.3835 -14.2480 -14.2480 -14.1756 -14.1756 4.9095 4.9095 4.9826 4.9826 5.4387 5.4387 5.8065 5.8065 6.1238 6.1238 11.0132 11.0132 11.6699 11.6699 12.3752 12.3752 12.4530 12.4530 13.6612 13.6612 14.3468 14.3468 16.1603 16.1603 16.9977 16.9977 17.2316 17.2316 k = 0.1990 0.2284 1.2377 ( 2416 PWs) bands (ev): -47.6299 -47.6299 -47.6291 -47.6291 -21.9998 -21.9998 -21.9947 -21.9947 -14.4513 -14.4513 -14.3889 -14.3889 -14.2465 -14.2465 -14.1795 -14.1795 4.9045 4.9045 4.9811 4.9811 5.4343 5.4343 5.8071 5.8071 6.1364 6.1364 11.0476 11.0476 11.6686 11.6686 12.3601 12.3601 12.4354 12.4354 13.7316 13.7316 14.3369 14.3369 16.1466 16.1466 16.9828 16.9828 17.2872 17.2872 k = 0.2041 0.2153 1.2518 ( 2414 PWs) bands (ev): -47.6296 -47.6296 -47.6288 -47.6288 -22.0006 -22.0006 -21.9955 -21.9955 -14.4507 -14.4507 -14.3941 -14.3941 -14.2448 -14.2448 -14.1832 -14.1832 4.8998 4.8998 4.9798 4.9798 5.4303 5.4303 5.8077 5.8077 6.1483 6.1483 11.0806 11.0806 11.6658 11.6658 12.3457 12.3457 12.4188 12.4188 13.8016 13.8016 14.3289 14.3289 16.1262 16.1262 16.9478 16.9478 17.3609 17.3609 k = 0.2092 0.2022 1.2658 ( 2412 PWs) bands (ev): -47.6294 -47.6294 -47.6286 -47.6286 -22.0014 -22.0014 -21.9963 -21.9963 -14.4500 -14.4500 -14.3993 -14.3993 -14.2429 -14.2429 -14.1868 -14.1868 4.8956 4.8956 4.9785 4.9785 5.4268 5.4268 5.8081 5.8081 6.1591 6.1591 11.1120 11.1120 11.6620 11.6620 12.3320 12.3320 12.4031 12.4031 13.8693 13.8693 14.3233 14.3233 16.1004 16.1004 16.9074 16.9074 17.4373 17.4373 k = 0.2143 0.1891 1.2799 ( 2414 PWs) bands (ev): -47.6292 -47.6292 -47.6284 -47.6284 -22.0021 -22.0021 -21.9970 -21.9970 -14.4491 -14.4491 -14.4043 -14.4043 -14.2410 -14.2410 -14.1903 -14.1903 4.8917 4.8917 4.9773 4.9773 5.4236 5.4236 5.8084 5.8084 6.1687 6.1687 11.1413 11.1413 11.6577 11.6577 12.3195 12.3195 12.3885 12.3885 13.9328 13.9328 14.3208 14.3208 16.0706 16.0706 16.8674 16.8674 17.5100 17.5100 k = 0.2194 0.1760 1.2940 ( 2416 PWs) bands (ev): -47.6290 -47.6290 -47.6283 -47.6283 -22.0027 -22.0027 -21.9976 -21.9976 -14.4479 -14.4479 -14.4091 -14.4091 -14.2389 -14.2389 -14.1936 -14.1936 4.8882 4.8882 4.9763 4.9763 5.4208 5.4208 5.8087 5.8087 6.1773 6.1773 11.1680 11.1680 11.6533 11.6533 12.3081 12.3081 12.3752 12.3752 13.9896 13.9896 14.3222 14.3222 16.0387 16.0387 16.8302 16.8302 17.5762 17.5762 k = 0.2245 0.1629 1.3080 ( 2418 PWs) bands (ev): -47.6289 -47.6289 -47.6281 -47.6281 -22.0032 -22.0032 -21.9982 -21.9982 -14.4464 -14.4464 -14.4137 -14.4137 -14.2368 -14.2368 -14.1967 -14.1967 4.8853 4.8853 4.9754 4.9754 5.4184 5.4184 5.8088 5.8088 6.1846 6.1846 11.1916 11.1916 11.6490 11.6490 12.2981 12.2981 12.3635 12.3635 14.0375 14.0375 14.3281 14.3281 16.0065 16.0065 16.7972 16.7972 17.6340 17.6340 k = 0.2296 0.1497 1.3221 ( 2418 PWs) bands (ev): -47.6288 -47.6288 -47.6280 -47.6280 -22.0036 -22.0036 -21.9986 -21.9986 -14.4447 -14.4447 -14.4180 -14.4180 -14.2348 -14.2348 -14.1995 -14.1995 4.8829 4.8829 4.9746 4.9746 5.4165 5.4165 5.8090 5.8090 6.1906 6.1906 11.2117 11.2117 11.6452 11.6452 12.2896 12.2896 12.3536 12.3536 14.0749 14.0749 14.3385 14.3385 15.9760 15.9760 16.7692 16.7692 17.6823 17.6823 k = 0.2347 0.1366 1.3362 ( 2420 PWs) bands (ev): -47.6287 -47.6287 -47.6279 -47.6279 -22.0039 -22.0039 -21.9989 -21.9989 -14.4428 -14.4428 -14.4219 -14.4219 -14.2330 -14.2330 -14.2020 -14.2020 4.8810 4.8810 4.9740 4.9740 5.4150 5.4150 5.8091 5.8091 6.1954 6.1954 11.2279 11.2279 11.6420 11.6420 12.2828 12.2828 12.3457 12.3457 14.1013 14.1013 14.3518 14.3518 15.9494 15.9494 16.7469 16.7469 17.7205 17.7205 k = 0.2398 0.1235 1.3502 ( 2420 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0042 -22.0042 -21.9992 -21.9992 -14.4408 -14.4408 -14.4254 -14.4254 -14.2315 -14.2315 -14.2039 -14.2039 4.8796 4.8796 4.9736 4.9736 5.4139 5.4139 5.8091 5.8091 6.1989 6.1989 11.2398 11.2398 11.6397 11.6397 12.2778 12.2778 12.3399 12.3399 14.1181 14.1181 14.3650 14.3650 15.9286 15.9286 16.7307 16.7307 17.7481 17.7481 k = 0.2449 0.1104 1.3643 ( 2426 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9993 -21.9993 -14.4390 -14.4390 -14.4281 -14.4281 -14.2305 -14.2305 -14.2052 -14.2052 4.8788 4.8788 4.9732 4.9732 5.4132 5.4132 5.8091 5.8091 6.2009 6.2009 11.2471 11.2471 11.6382 11.6382 12.2747 12.2747 12.3363 12.3363 14.1271 14.1271 14.3747 14.3747 15.9154 15.9154 16.7208 16.7208 17.7647 17.7647 k = 0.2500 0.0973 1.3784 ( 2416 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0044 -22.0044 -21.9993 -21.9993 -14.4381 -14.4381 -14.4292 -14.4292 -14.2300 -14.2300 -14.2056 -14.2056 4.8785 4.8785 4.9733 4.9733 5.4131 5.4131 5.8092 5.8092 6.2017 6.2017 11.2495 11.2495 11.6377 11.6377 12.2737 12.2737 12.3352 12.3352 14.1300 14.1300 14.3782 14.3782 15.9108 15.9108 16.7175 16.7175 17.7702 17.7702 k = 0.2500 0.0973 1.3784 ( 2416 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0044 -22.0044 -21.9993 -21.9993 -14.4381 -14.4381 -14.4292 -14.4292 -14.2300 -14.2300 -14.2056 -14.2056 4.8785 4.8785 4.9733 4.9733 5.4131 5.4131 5.8092 5.8092 6.2017 6.2017 11.2495 11.2495 11.6377 11.6377 12.2737 12.2737 12.3352 12.3352 14.1300 14.1300 14.3782 14.3782 15.9108 15.9108 16.7175 16.7175 17.7702 17.7702 k = 0.2667 0.1038 1.3714 ( 2420 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0044 -22.0044 -21.9993 -21.9993 -14.4382 -14.4382 -14.4291 -14.4291 -14.2300 -14.2300 -14.2057 -14.2057 4.8785 4.8785 4.9732 4.9732 5.4131 5.4131 5.8092 5.8092 6.2016 6.2016 11.2489 11.2489 11.6384 11.6384 12.2616 12.2616 12.3492 12.3492 14.1107 14.1107 14.3965 14.3965 15.9011 15.9011 16.7331 16.7331 17.7598 17.7598 k = 0.2833 0.1103 1.3644 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9993 -21.9993 -14.4385 -14.4385 -14.4287 -14.4287 -14.2300 -14.2300 -14.2055 -14.2055 4.8787 4.8787 4.9733 4.9733 5.4132 5.4132 5.8092 5.8092 6.2013 6.2013 11.2474 11.2474 11.6402 11.6402 12.2386 12.2386 12.3777 12.3777 14.0640 14.0640 14.4402 14.4402 15.8744 15.8744 16.7775 16.7775 17.7306 17.7306 k = 0.3000 0.1168 1.3575 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9993 -21.9993 -14.4390 -14.4390 -14.4281 -14.4281 -14.2302 -14.2302 -14.2054 -14.2054 4.8788 4.8788 4.9734 4.9734 5.4134 5.4134 5.8093 5.8093 6.2009 6.2009 11.2451 11.2451 11.6430 11.6430 12.2146 12.2146 12.4103 12.4103 14.0044 14.0044 14.4950 14.4950 15.8363 15.8363 16.8451 16.8451 17.6882 17.6882 k = 0.3167 0.1233 1.3505 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0042 -22.0042 -21.9992 -21.9992 -14.4395 -14.4395 -14.4273 -14.4273 -14.2303 -14.2303 -14.2051 -14.2051 4.8790 4.8790 4.9735 4.9735 5.4135 5.4135 5.8093 5.8093 6.2003 6.2003 11.2424 11.2424 11.6468 11.6468 12.1919 12.1919 12.4440 12.4440 13.9392 13.9392 14.5535 14.5535 15.7926 15.7926 16.9301 16.9301 17.6379 17.6379 k = 0.3333 0.1298 1.3435 ( 2420 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0042 -22.0042 -21.9993 -21.9993 -14.4401 -14.4401 -14.4264 -14.4264 -14.2306 -14.2306 -14.2048 -14.2048 4.8792 4.8792 4.9736 4.9736 5.4137 5.4137 5.8093 5.8093 6.1995 6.1995 11.2394 11.2394 11.6514 11.6514 12.1712 12.1712 12.4776 12.4776 13.8718 13.8718 14.6123 14.6123 15.7480 15.7480 17.0274 17.0274 17.5843 17.5843 k = 0.3500 0.1362 1.3366 ( 2419 PWs) bands (ev): -47.6286 -47.6286 -47.6279 -47.6279 -22.0041 -22.0041 -21.9992 -21.9992 -14.4408 -14.4408 -14.4254 -14.4254 -14.2309 -14.2309 -14.2044 -14.2044 4.8795 4.8795 4.9738 4.9738 5.4141 5.4141 5.8093 5.8093 6.1986 6.1986 11.2364 11.2364 11.6567 11.6567 12.1528 12.1528 12.5100 12.5100 13.8044 13.8044 14.6695 14.6695 15.7055 15.7055 17.1326 17.1326 17.5315 17.5315 k = 0.3667 0.1427 1.3296 ( 2419 PWs) bands (ev): -47.6286 -47.6286 -47.6279 -47.6279 -22.0040 -22.0040 -21.9992 -21.9992 -14.4414 -14.4414 -14.4243 -14.4243 -14.2313 -14.2313 -14.2039 -14.2039 4.8799 4.8799 4.9740 4.9740 5.4144 5.4144 5.8093 5.8093 6.1975 6.1975 11.2335 11.2335 11.6625 11.6625 12.1368 12.1368 12.5403 12.5403 13.7383 13.7383 14.7239 14.7239 15.6673 15.6673 17.2388 17.2388 17.4864 17.4864 k = 0.3833 0.1492 1.3227 ( 2421 PWs) bands (ev): -47.6286 -47.6286 -47.6279 -47.6279 -22.0038 -22.0038 -21.9992 -21.9992 -14.4421 -14.4421 -14.4231 -14.4231 -14.2316 -14.2316 -14.2033 -14.2033 4.8804 4.8804 4.9742 4.9742 5.4148 5.4148 5.8094 5.8094 6.1962 6.1962 11.2308 11.2308 11.6687 11.6687 12.1233 12.1233 12.5674 12.5674 13.6751 13.6751 14.7742 14.7742 15.6349 15.6349 17.3197 17.3197 17.4752 17.4752 k = 0.4000 0.1557 1.3157 ( 2424 PWs) bands (ev): -47.6286 -47.6286 -47.6280 -47.6280 -22.0037 -22.0037 -21.9992 -21.9992 -14.4427 -14.4427 -14.4219 -14.4219 -14.2321 -14.2321 -14.2028 -14.2028 4.8809 4.8809 4.9744 4.9744 5.4153 5.4153 5.8093 5.8093 6.1948 6.1948 11.2285 11.2285 11.6749 11.6749 12.1123 12.1123 12.5902 12.5902 13.6161 13.6161 14.8195 14.8195 15.6092 15.6092 17.3240 17.3240 17.5495 17.5495 k = 0.4167 0.1622 1.3087 ( 2427 PWs) bands (ev): -47.6286 -47.6286 -47.6280 -47.6280 -22.0035 -22.0035 -21.9993 -21.9993 -14.4433 -14.4433 -14.4206 -14.4206 -14.2326 -14.2326 -14.2022 -14.2022 4.8815 4.8815 4.9746 4.9746 5.4157 5.4157 5.8093 5.8093 6.1933 6.1933 11.2265 11.2265 11.6812 11.6812 12.1039 12.1039 12.6074 12.6074 13.5628 13.5628 14.8588 14.8588 15.5908 15.5908 17.2929 17.2929 17.6678 17.6678 k = 0.4333 0.1687 1.3018 ( 2425 PWs) bands (ev): -47.6286 -47.6286 -47.6281 -47.6281 -22.0032 -22.0032 -21.9992 -21.9992 -14.4439 -14.4439 -14.4192 -14.4192 -14.2330 -14.2330 -14.2014 -14.2014 4.8822 4.8822 4.9750 4.9750 5.4163 5.4163 5.8093 5.8093 6.1916 6.1916 11.2248 11.2248 11.6872 11.6872 12.0981 12.0981 12.6179 12.6179 13.5169 13.5169 14.8913 14.8913 15.5801 15.5801 17.2593 17.2593 17.7969 17.7969 k = 0.4500 0.1752 1.2948 ( 2429 PWs) bands (ev): -47.6286 -47.6286 -47.6282 -47.6282 -22.0030 -22.0030 -21.9993 -21.9993 -14.4446 -14.4446 -14.4178 -14.4178 -14.2336 -14.2336 -14.2007 -14.2007 4.8830 4.8830 4.9752 4.9752 5.4170 5.4170 5.8092 5.8092 6.1897 6.1897 11.2235 11.2235 11.6927 11.6927 12.0949 12.0949 12.6208 12.6208 13.4795 13.4795 14.9161 14.9161 15.5772 15.5772 17.2301 17.2301 17.9285 17.9285 k = 0.4667 0.1817 1.2878 ( 2425 PWs) bands (ev): -47.6286 -47.6286 -47.6283 -47.6283 -22.0027 -22.0027 -21.9992 -21.9992 -14.4451 -14.4451 -14.4163 -14.4163 -14.2342 -14.2342 -14.1999 -14.1999 4.8839 4.8839 4.9756 4.9756 5.4177 5.4177 5.8093 5.8093 6.1876 6.1876 11.2225 11.2225 11.6975 11.6975 12.0944 12.0944 12.6157 12.6157 13.4518 13.4518 14.9327 14.9327 15.5821 15.5821 17.2073 17.2073 18.0569 18.0569 k = 0.4833 0.1881 1.2809 ( 2428 PWs) bands (ev): -47.6286 -47.6286 -47.6284 -47.6284 -22.0025 -22.0025 -21.9992 -21.9992 -14.4457 -14.4457 -14.4148 -14.4148 -14.2348 -14.2348 -14.1990 -14.1990 4.8848 4.8848 4.9759 4.9759 5.4185 5.4185 5.8092 5.8092 6.1854 6.1854 11.2215 11.2215 11.7014 11.7014 12.0965 12.0965 12.6027 12.6027 13.4339 13.4339 14.9407 14.9407 15.5946 15.5946 17.1919 17.1919 18.1698 18.1698 k = 0.5000 0.1946 1.2739 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6285 -47.6285 -22.0022 -22.0022 -21.9992 -21.9992 -14.4462 -14.4462 -14.4132 -14.4132 -14.2355 -14.2355 -14.1981 -14.1981 4.8858 4.8858 4.9763 4.9763 5.4193 5.4193 5.8091 5.8091 6.1830 6.1830 11.2205 11.2205 11.7041 11.7041 12.1012 12.1012 12.5830 12.5830 13.4256 13.4256 14.9400 14.9400 15.6143 15.6143 17.1841 17.1841 18.2208 18.2208 k = 0.5000 0.1946 1.2739 ( 2430 PWs) bands (ev): -47.6286 -47.6286 -47.6285 -47.6285 -22.0022 -22.0022 -21.9992 -21.9992 -14.4462 -14.4462 -14.4132 -14.4132 -14.2355 -14.2355 -14.1981 -14.1981 4.8858 4.8858 4.9763 4.9763 5.4193 5.4193 5.8091 5.8091 6.1830 6.1830 11.2205 11.2205 11.7041 11.7041 12.1012 12.1012 12.5830 12.5830 13.4256 13.4256 14.9400 14.9400 15.6143 15.6143 17.1841 17.1841 18.2208 18.2208 k = 0.5000 0.1946 1.2537 ( 2426 PWs) bands (ev): -47.6287 -47.6287 -47.6287 -47.6287 -22.0012 -22.0012 -21.9990 -21.9990 -14.4476 -14.4476 -14.4083 -14.4083 -14.2375 -14.2375 -14.1951 -14.1951 4.8893 4.8893 4.9774 4.9774 5.4220 5.4220 5.8089 5.8089 6.1753 6.1753 11.2156 11.2156 11.7104 11.7104 12.1204 12.1204 12.5151 12.5151 13.4135 13.4135 14.9243 14.9243 15.6842 15.6842 17.1711 17.1711 18.1831 18.1831 k = 0.5000 0.1946 1.2335 ( 2432 PWs) bands (ev): -47.6291 -47.6291 -47.6287 -47.6287 -22.0001 -22.0001 -21.9989 -21.9989 -14.4486 -14.4486 -14.4033 -14.4033 -14.2395 -14.2395 -14.1921 -14.1921 4.8932 4.8932 4.9787 4.9787 5.4251 5.4251 5.8086 5.8086 6.1661 6.1661 11.2066 11.2066 11.7172 11.7172 12.1427 12.1427 12.4453 12.4453 13.4000 13.4000 14.9062 14.9062 15.7569 15.7569 17.1555 17.1555 18.1320 18.1320 k = 0.5000 0.1946 1.2133 ( 2436 PWs) bands (ev): -47.6295 -47.6295 -47.6288 -47.6288 -21.9990 -21.9990 -21.9987 -21.9987 -14.4493 -14.4493 -14.3980 -14.3980 -14.2416 -14.2416 -14.1888 -14.1888 4.8976 4.8976 4.9802 4.9802 5.4286 5.4286 5.8083 5.8083 6.1558 6.1558 11.1919 11.1919 11.7243 11.7243 12.1680 12.1680 12.3773 12.3773 13.3853 13.3853 14.8859 14.8859 15.8295 15.8295 17.1373 17.1373 18.0672 18.0672 k = 0.5000 0.1946 1.1930 ( 2440 PWs) bands (ev): -47.6299 -47.6299 -47.6288 -47.6288 -21.9986 -21.9986 -21.9974 -21.9974 -14.4498 -14.4498 -14.3924 -14.3924 -14.2437 -14.2437 -14.1854 -14.1854 4.9025 4.9025 4.9818 4.9818 5.4326 5.4326 5.8079 5.8079 6.1442 6.1442 11.1694 11.1694 11.7312 11.7312 12.1958 12.1958 12.3151 12.3151 13.3698 13.3698 14.8635 14.8635 15.8995 15.8995 17.1164 17.1164 17.9906 17.9906 k = 0.5000 0.1946 1.1728 ( 2436 PWs) bands (ev): -47.6303 -47.6303 -47.6289 -47.6289 -21.9983 -21.9983 -21.9958 -21.9958 -14.4498 -14.4498 -14.3865 -14.3865 -14.2456 -14.2456 -14.1818 -14.1818 4.9079 4.9079 4.9837 4.9837 5.4371 5.4371 5.8075 5.8075 6.1317 6.1317 11.1370 11.1370 11.7376 11.7376 12.2219 12.2219 12.2664 12.2664 13.3540 13.3540 14.8388 14.8388 15.9644 15.9644 17.0925 17.0925 17.9048 17.9048 k = 0.5000 0.1946 1.1526 ( 2436 PWs) bands (ev): -47.6309 -47.6309 -47.6289 -47.6289 -21.9980 -21.9980 -21.9941 -21.9941 -14.4496 -14.4496 -14.3804 -14.3804 -14.2476 -14.2476 -14.1781 -14.1781 4.9137 4.9137 4.9857 4.9857 5.4421 5.4421 5.8069 5.8069 6.1181 6.1181 11.0930 11.0930 11.7430 11.7430 12.2090 12.2090 12.2710 12.2710 13.3384 13.3384 14.8120 14.8120 16.0223 16.0223 17.0655 17.0655 17.8131 17.8131 k = 0.5000 0.1946 1.1324 ( 2428 PWs) bands (ev): -47.6314 -47.6314 -47.6290 -47.6290 -21.9977 -21.9977 -21.9920 -21.9920 -14.4490 -14.4490 -14.3741 -14.3741 -14.2494 -14.2494 -14.1742 -14.1742 4.9199 4.9199 4.9880 4.9880 5.4476 5.4476 5.8062 5.8062 6.1036 6.1036 11.0367 11.0367 11.7466 11.7466 12.1819 12.1819 12.3061 12.3061 13.3236 13.3236 14.7832 14.7832 16.0717 16.0717 17.0353 17.0353 17.7180 17.7180 k = 0.5000 0.1946 1.1122 ( 2428 PWs) bands (ev): -47.6320 -47.6320 -47.6290 -47.6290 -21.9974 -21.9974 -21.9899 -21.9899 -14.4482 -14.4482 -14.3676 -14.3676 -14.2512 -14.2512 -14.1702 -14.1702 4.9264 4.9264 4.9902 4.9902 5.4534 5.4534 5.8053 5.8053 6.0882 6.0882 10.9679 10.9679 11.7480 11.7480 12.1665 12.1665 12.3460 12.3460 13.3101 13.3101 14.7524 14.7524 16.1114 16.1114 17.0016 17.0016 17.6219 17.6219 k = 0.5000 0.1946 1.0919 ( 2420 PWs) bands (ev): -47.6327 -47.6327 -47.6291 -47.6291 -21.9969 -21.9969 -21.9877 -21.9877 -14.4469 -14.4469 -14.3608 -14.3608 -14.2529 -14.2529 -14.1662 -14.1662 4.9333 4.9333 4.9926 4.9926 5.4596 5.4596 5.8044 5.8044 6.0723 6.0723 10.8879 10.8879 11.7463 11.7463 12.1642 12.1642 12.3892 12.3892 13.2986 13.2986 14.7196 14.7196 16.1409 16.1409 16.9642 16.9642 17.5265 17.5265 k = 0.5000 0.1946 1.0717 ( 2420 PWs) bands (ev): -47.6334 -47.6334 -47.6292 -47.6292 -21.9966 -21.9966 -21.9853 -21.9853 -14.4455 -14.4455 -14.3540 -14.3540 -14.2544 -14.2544 -14.1620 -14.1620 4.9403 4.9403 4.9951 4.9951 5.4663 5.4663 5.8031 5.8031 6.0555 6.0555 10.7983 10.7983 11.7407 11.7407 12.1739 12.1739 12.4351 12.4351 13.2897 13.2897 14.6851 14.6851 16.1600 16.1600 16.9232 16.9232 17.4332 17.4332 k = 0.5000 0.1946 1.0515 ( 2420 PWs) bands (ev): -47.6341 -47.6341 -47.6292 -47.6292 -21.9962 -21.9962 -21.9828 -21.9828 -14.4438 -14.4438 -14.3471 -14.3471 -14.2558 -14.2558 -14.1578 -14.1578 4.9476 4.9476 4.9976 4.9976 5.4733 5.4733 5.8017 5.8017 6.0380 6.0380 10.7009 10.7009 11.7307 11.7307 12.1944 12.1944 12.4837 12.4837 13.2843 13.2843 14.6488 14.6488 16.1688 16.1688 16.8783 16.8783 17.3431 17.3431 k = 0.5000 0.1946 1.0313 ( 2416 PWs) bands (ev): -47.6348 -47.6348 -47.6293 -47.6293 -21.9957 -21.9957 -21.9802 -21.9802 -14.4417 -14.4417 -14.3401 -14.3401 -14.2570 -14.2570 -14.1535 -14.1535 4.9550 4.9550 5.0002 5.0002 5.4807 5.4807 5.8001 5.8001 6.0201 6.0201 10.5976 10.5976 11.7154 11.7154 12.2240 12.2240 12.5346 12.5346 13.2828 13.2828 14.6110 14.6110 16.1680 16.1680 16.8300 16.8300 17.2569 17.2569 k = 0.5000 0.1946 1.0111 ( 2416 PWs) bands (ev): -47.6356 -47.6356 -47.6294 -47.6294 -21.9953 -21.9953 -21.9775 -21.9775 -14.4394 -14.4394 -14.3332 -14.3332 -14.2579 -14.2579 -14.1491 -14.1491 4.9623 4.9623 5.0029 5.0029 5.4885 5.4885 5.7982 5.7982 6.0017 6.0017 10.4900 10.4900 11.6943 11.6943 12.2616 12.2616 12.5879 12.5879 13.2859 13.2859 14.5717 14.5717 16.1583 16.1583 16.7783 16.7783 17.1748 17.1748 k = 0.5000 0.1946 0.9908 ( 2416 PWs) bands (ev): -47.6365 -47.6365 -47.6295 -47.6295 -21.9948 -21.9948 -21.9747 -21.9747 -14.4369 -14.4369 -14.3264 -14.3264 -14.2584 -14.2584 -14.1447 -14.1447 4.9697 4.9697 5.0056 5.0056 5.4967 5.4967 5.7961 5.7961 5.9830 5.9830 10.3793 10.3793 11.6669 11.6669 12.3057 12.3057 12.6433 12.6433 13.2942 13.2942 14.5312 14.5312 16.1407 16.1407 16.7240 16.7240 17.0969 17.0969 k = 0.5000 0.1946 0.9706 ( 2416 PWs) bands (ev): -47.6373 -47.6373 -47.6296 -47.6296 -21.9944 -21.9944 -21.9717 -21.9717 -14.4341 -14.4341 -14.3198 -14.3198 -14.2585 -14.2585 -14.1402 -14.1402 4.9770 4.9770 5.0084 5.0084 5.5052 5.5052 5.7937 5.7937 5.9643 5.9643 10.2667 10.2667 11.6327 11.6327 12.3554 12.3554 12.7008 12.7008 13.3078 13.3078 14.4895 14.4895 16.1164 16.1164 16.6677 16.6677 17.0230 17.0230 k = 0.5000 0.1946 0.9504 ( 2416 PWs) bands (ev): -47.6382 -47.6382 -47.6297 -47.6297 -21.9939 -21.9939 -21.9687 -21.9687 -14.4311 -14.4311 -14.3138 -14.3138 -14.2578 -14.2578 -14.1356 -14.1356 4.9842 4.9842 5.0112 5.0112 5.5141 5.5141 5.7911 5.7911 5.9453 5.9453 10.1529 10.1529 11.5917 11.5917 12.4099 12.4099 12.7602 12.7602 13.3270 13.3270 14.4468 14.4468 16.0866 16.0866 16.6103 16.6103 16.9528 16.9528 k = 0.5000 0.1946 0.9302 ( 2424 PWs) bands (ev): -47.6392 -47.6392 -47.6298 -47.6298 -21.9935 -21.9935 -21.9655 -21.9655 -14.4278 -14.4278 -14.3085 -14.3085 -14.2563 -14.2563 -14.1311 -14.1311 4.9910 4.9910 5.0140 5.0140 5.5233 5.5233 5.7880 5.7880 5.9262 5.9262 10.0387 10.0387 11.5438 11.5438 12.4683 12.4683 12.8212 12.8212 13.3518 13.3518 14.4034 14.4034 16.0522 16.0522 16.5524 16.5524 16.8860 16.8860 k = 0.5000 0.1946 0.9099 ( 2420 PWs) bands (ev): -47.6401 -47.6401 -47.6299 -47.6299 -21.9930 -21.9930 -21.9622 -21.9622 -14.4243 -14.4243 -14.3039 -14.3039 -14.2536 -14.2536 -14.1265 -14.1265 4.9975 4.9975 5.0170 5.0170 5.5329 5.5329 5.7847 5.7847 5.9075 5.9075 9.9246 9.9246 11.4891 11.4891 12.5299 12.5299 12.8839 12.8839 13.3823 13.3823 14.3594 14.3594 16.0144 16.0144 16.4947 16.4947 16.8227 16.8227 k = 0.5000 0.1946 0.8897 ( 2416 PWs) bands (ev): -47.6411 -47.6411 -47.6300 -47.6300 -21.9924 -21.9924 -21.9589 -21.9589 -14.4206 -14.4206 -14.3003 -14.3003 -14.2496 -14.2496 -14.1218 -14.1218 5.0036 5.0036 5.0201 5.0201 5.5428 5.5428 5.7809 5.7809 5.8891 5.8891 9.8110 9.8110 11.4279 11.4279 12.5941 12.5941 12.9478 12.9478 13.4181 13.4181 14.3151 14.3151 15.9742 15.9742 16.4377 16.4377 16.7629 16.7629 k = 0.5000 0.1946 0.8695 ( 2410 PWs) bands (ev): -47.6421 -47.6421 -47.6301 -47.6301 -21.9917 -21.9917 -21.9554 -21.9554 -14.4168 -14.4168 -14.2977 -14.2977 -14.2445 -14.2445 -14.1171 -14.1171 5.0091 5.0091 5.0234 5.0234 5.5530 5.5530 5.7768 5.7768 5.8712 5.8712 9.6984 9.6984 11.3605 11.3605 12.6601 12.6601 13.0129 13.0129 13.4590 13.4590 14.2707 14.2707 15.9325 15.9325 16.3815 16.3815 16.7071 16.7071 k = 0.5000 0.1946 0.8493 ( 2418 PWs) bands (ev): -47.6431 -47.6431 -47.6302 -47.6302 -21.9912 -21.9912 -21.9521 -21.9521 -14.4128 -14.4128 -14.2960 -14.2960 -14.2384 -14.2384 -14.1125 -14.1125 5.0138 5.0138 5.0267 5.0267 5.5634 5.5634 5.7720 5.7720 5.8537 5.8537 9.5870 9.5870 11.2874 11.2874 12.7271 12.7271 13.0788 13.0788 13.5047 13.5047 14.2266 14.2266 15.8902 15.8902 16.3262 16.3262 16.6559 16.6559 k = 0.5000 0.1946 0.8291 ( 2418 PWs) bands (ev): -47.6442 -47.6442 -47.6303 -47.6303 -21.9907 -21.9907 -21.9485 -21.9485 -14.4087 -14.4087 -14.2949 -14.2949 -14.2313 -14.2313 -14.1078 -14.1078 5.0179 5.0179 5.0302 5.0302 5.5740 5.5740 5.7665 5.7665 5.8372 5.8372 9.4770 9.4770 11.2091 11.2091 12.7946 12.7946 13.1451 13.1451 13.5548 13.5548 14.1833 14.1833 15.8484 15.8484 16.2714 16.2714 16.6102 16.6102 k = 0.5000 0.1946 0.8088 ( 2418 PWs) bands (ev): -47.6452 -47.6452 -47.6304 -47.6304 -21.9900 -21.9900 -21.9449 -21.9449 -14.4045 -14.4045 -14.2942 -14.2942 -14.2237 -14.2237 -14.1032 -14.1032 5.0212 5.0212 5.0337 5.0337 5.5849 5.5849 5.7602 5.7602 5.8219 5.8219 9.3687 9.3687 11.1260 11.1260 12.8615 12.8615 13.2115 13.2115 13.6090 13.6090 14.1412 14.1412 15.8079 15.8079 16.2169 16.2169 16.5710 16.5710 k = 0.5000 0.1946 0.7886 ( 2416 PWs) bands (ev): -47.6463 -47.6463 -47.6305 -47.6305 -21.9894 -21.9894 -21.9412 -21.9412 -14.4002 -14.4002 -14.2937 -14.2937 -14.2155 -14.2155 -14.0985 -14.0985 5.0241 5.0241 5.0369 5.0369 5.5960 5.5960 5.7530 5.7530 5.8081 5.8081 9.2622 9.2622 11.0387 11.0387 12.9270 12.9270 13.2771 13.2771 13.6667 13.6667 14.1012 14.1012 15.7698 15.7698 16.1622 16.1622 16.5390 16.5390 k = 0.5000 0.1946 0.7684 ( 2410 PWs) bands (ev): -47.6473 -47.6473 -47.6307 -47.6307 -21.9888 -21.9888 -21.9374 -21.9374 -14.3959 -14.3959 -14.2933 -14.2933 -14.2069 -14.2069 -14.0939 -14.0939 5.0265 5.0265 5.0399 5.0399 5.6072 5.6072 5.7447 5.7447 5.7960 5.7960 9.1577 9.1577 10.9476 10.9476 12.9901 12.9901 13.3411 13.3411 13.7274 13.7274 14.0645 14.0645 15.7353 15.7353 16.1070 16.1070 16.5149 16.5149 k = 0.5000 0.1946 0.7482 ( 2414 PWs) bands (ev): -47.6484 -47.6484 -47.6308 -47.6308 -21.9881 -21.9881 -21.9338 -21.9338 -14.3917 -14.3917 -14.2928 -14.2928 -14.1984 -14.1984 -14.0893 -14.0893 5.0286 5.0286 5.0421 5.0421 5.6183 5.6183 5.7354 5.7354 5.7855 5.7855 9.0553 9.0553 10.8534 10.8534 13.0498 13.0498 13.4019 13.4019 13.7902 13.7902 14.0334 14.0334 15.7054 15.7054 16.0515 16.0515 16.4988 16.4988 k = 0.5000 0.1946 0.7280 ( 2414 PWs) bands (ev): -47.6495 -47.6495 -47.6309 -47.6309 -21.9875 -21.9875 -21.9301 -21.9301 -14.3875 -14.3875 -14.2922 -14.2922 -14.1895 -14.1895 -14.0848 -14.0848 5.0303 5.0303 5.0437 5.0437 5.6296 5.6296 5.7253 5.7253 5.7767 5.7767 8.9551 8.9551 10.7565 10.7565 13.1050 13.1050 13.4572 13.4572 13.8531 13.8531 14.0118 14.0118 15.6812 15.6812 15.9961 15.9961 16.4907 16.4907 k = 0.5000 0.1946 0.7077 ( 2414 PWs) bands (ev): -47.6506 -47.6506 -47.6310 -47.6310 -21.9869 -21.9869 -21.9263 -21.9263 -14.3834 -14.3834 -14.2913 -14.2913 -14.1806 -14.1806 -14.0803 -14.0803 5.0318 5.0318 5.0446 5.0446 5.6406 5.6406 5.7149 5.7149 5.7692 5.7692 8.8573 8.8573 10.6574 10.6574 13.1545 13.1545 13.5034 13.5034 13.9096 13.9096 14.0095 14.0095 15.6631 15.6631 15.9418 15.9418 16.4902 16.4902 k = 0.5000 0.1946 0.6875 ( 2414 PWs) bands (ev): -47.6517 -47.6517 -47.6311 -47.6311 -21.9862 -21.9862 -21.9225 -21.9225 -14.3796 -14.3796 -14.2902 -14.2902 -14.1716 -14.1716 -14.0758 -14.0758 5.0330 5.0330 5.0448 5.0448 5.6512 5.6512 5.7049 5.7049 5.7627 5.7627 8.7618 8.7618 10.5565 10.5565 13.1973 13.1973 13.5363 13.5363 13.9469 13.9469 14.0435 14.0435 15.6508 15.6508 15.8904 15.8904 16.4968 16.4968 k = 0.5000 0.1946 0.6673 ( 2414 PWs) bands (ev): -47.6528 -47.6528 -47.6313 -47.6313 -21.9856 -21.9856 -21.9186 -21.9186 -14.3760 -14.3760 -14.2887 -14.2887 -14.1626 -14.1626 -14.0714 -14.0714 5.0340 5.0340 5.0442 5.0442 5.6608 5.6608 5.6961 5.6961 5.7573 5.7573 8.6687 8.6687 10.4542 10.4542 13.2326 13.2326 13.5524 13.5524 13.9756 13.9756 14.1064 14.1064 15.6418 15.6418 15.8456 15.8456 16.5099 16.5099 k = 0.5000 0.1946 0.6471 ( 2406 PWs) bands (ev): -47.6539 -47.6539 -47.6314 -47.6314 -21.9848 -21.9848 -21.9148 -21.9148 -14.3726 -14.3726 -14.2867 -14.2867 -14.1536 -14.1536 -14.0670 -14.0670 5.0347 5.0347 5.0429 5.0429 5.6672 5.6672 5.6906 5.6906 5.7529 5.7529 8.5782 8.5782 10.3511 10.3511 13.2597 13.2597 13.5518 13.5518 14.0136 14.0136 14.1799 14.1799 15.6298 15.6298 15.8146 15.8146 16.5286 16.5286 k = 0.5000 0.1946 0.6269 ( 2410 PWs) bands (ev): -47.6550 -47.6550 -47.6315 -47.6315 -21.9842 -21.9842 -21.9111 -21.9111 -14.3696 -14.3696 -14.2843 -14.2843 -14.1449 -14.1449 -14.0627 -14.0627 5.0348 5.0348 5.0408 5.0408 5.6667 5.6667 5.6916 5.6916 5.7496 5.7496 8.4902 8.4902 10.2474 10.2474 13.2782 13.2782 13.5379 13.5379 14.0632 14.0632 14.2583 14.2583 15.6060 15.6060 15.8063 15.8063 16.5519 16.5519 k = 0.5000 0.1946 0.6066 ( 2412 PWs) bands (ev): -47.6561 -47.6561 -47.6316 -47.6316 -21.9836 -21.9836 -21.9073 -21.9073 -14.3671 -14.3671 -14.2814 -14.2814 -14.1362 -14.1362 -14.0584 -14.0584 5.0339 5.0339 5.0387 5.0387 5.6614 5.6614 5.6965 5.6965 5.7483 5.7483 8.4049 8.4049 10.1435 10.1435 13.2881 13.2881 13.5150 13.5150 14.1215 14.1215 14.3399 14.3399 15.5684 15.5684 15.8225 15.8225 16.5785 16.5785 k = 0.5000 0.1946 0.5864 ( 2408 PWs) bands (ev): -47.6572 -47.6572 -47.6317 -47.6317 -21.9829 -21.9829 -21.9035 -21.9035 -14.3648 -14.3648 -14.2780 -14.2780 -14.1277 -14.1277 -14.0540 -14.0540 5.0313 5.0313 5.0375 5.0375 5.6554 5.6554 5.7007 5.7007 5.7499 5.7499 8.3222 8.3222 10.0398 10.0398 13.2899 13.2899 13.4866 13.4866 14.1855 14.1855 14.4240 14.4240 15.5220 15.5220 15.8568 15.8568 16.6067 16.6067 k = 0.5000 0.1946 0.5662 ( 2404 PWs) bands (ev): -47.6582 -47.6582 -47.6319 -47.6319 -21.9822 -21.9822 -21.8997 -21.8997 -14.3630 -14.3630 -14.2741 -14.2741 -14.1194 -14.1194 -14.0497 -14.0497 5.0271 5.0271 5.0369 5.0369 5.6497 5.6497 5.7025 5.7025 5.7546 5.7546 8.2422 8.2422 9.9365 9.9365 13.2842 13.2842 13.4548 13.4548 14.2530 14.2530 14.5103 14.5103 15.4717 15.4717 15.9022 15.9022 16.6339 16.6339 k = 0.5000 0.1946 0.5460 ( 2404 PWs) bands (ev): -47.6593 -47.6593 -47.6320 -47.6320 -21.9815 -21.9815 -21.8961 -21.8961 -14.3615 -14.3615 -14.2697 -14.2697 -14.1116 -14.1116 -14.0453 -14.0453 5.0219 5.0219 5.0362 5.0362 5.6446 5.6446 5.7020 5.7020 5.7618 5.7618 8.1649 8.1649 9.8340 9.8340 13.2720 13.2720 13.4210 13.4210 14.3226 14.3226 14.5986 14.5986 15.4200 15.4200 15.9528 15.9528 16.6579 16.6579 k = 0.5000 0.1946 0.5257 ( 2400 PWs) bands (ev): -47.6603 -47.6603 -47.6321 -47.6321 -21.9810 -21.9810 -21.8924 -21.8924 -14.3604 -14.3604 -14.2650 -14.2650 -14.1039 -14.1039 -14.0409 -14.0409 5.0159 5.0159 5.0355 5.0355 5.6403 5.6403 5.7001 5.7001 5.7709 5.7709 8.0904 8.0904 9.7327 9.7327 13.2543 13.2543 13.3859 13.3859 14.3933 14.3933 14.6888 14.6888 15.3681 15.3681 16.0024 16.0024 16.6802 16.6802 k = 0.5000 0.1946 0.5055 ( 2396 PWs) bands (ev): -47.6613 -47.6613 -47.6322 -47.6322 -21.9803 -21.9803 -21.8888 -21.8888 -14.3595 -14.3595 -14.2598 -14.2598 -14.0967 -14.0967 -14.0364 -14.0364 5.0094 5.0094 5.0345 5.0345 5.6369 5.6369 5.6974 5.6974 5.7810 5.7810 8.0186 8.0186 9.6327 9.6327 13.2323 13.2323 13.3500 13.3500 14.4642 14.4642 14.7807 14.7807 15.3170 15.3170 16.0443 16.0443 16.7086 16.7086 k = 0.5000 0.1946 0.4853 ( 2408 PWs) bands (ev): -47.6623 -47.6623 -47.6323 -47.6323 -21.9798 -21.9798 -21.8855 -21.8855 -14.3590 -14.3590 -14.2544 -14.2544 -14.0901 -14.0901 -14.0319 -14.0319 5.0022 5.0022 5.0333 5.0333 5.6341 5.6341 5.6943 5.6943 5.7913 5.7913 7.9496 7.9496 9.5342 9.5342 13.2069 13.2069 13.3137 13.3137 14.5348 14.5348 14.8741 14.8741 15.2671 15.2671 16.0729 16.0729 16.7526 16.7526 k = 0.5000 0.1946 0.4651 ( 2404 PWs) bands (ev): -47.6633 -47.6633 -47.6324 -47.6324 -21.9792 -21.9792 -21.8820 -21.8820 -14.3586 -14.3586 -14.2487 -14.2487 -14.0839 -14.0839 -14.0271 -14.0271 4.9947 4.9947 5.0319 5.0319 5.6323 5.6323 5.6912 5.6912 5.8020 5.8020 7.8834 7.8834 9.4376 9.4376 13.1792 13.1792 13.2773 13.2773 14.6046 14.6046 14.9687 14.9687 15.2191 15.2191 16.0854 16.0854 16.8175 16.8175 k = 0.5000 0.1946 0.4449 ( 2406 PWs) bands (ev): -47.6643 -47.6643 -47.6326 -47.6326 -21.9786 -21.9786 -21.8787 -21.8787 -14.3583 -14.3583 -14.2428 -14.2428 -14.0784 -14.0784 -14.0223 -14.0223 4.9869 4.9869 5.0303 5.0303 5.6311 5.6311 5.6881 5.6881 5.8126 5.8126 7.8200 7.8200 9.3431 9.3431 13.1498 13.1498 13.2409 13.2409 14.6729 14.6729 15.0629 15.0629 15.1750 15.1750 16.0832 16.0832 16.9032 16.9032 k = 0.5000 0.1946 0.4246 ( 2402 PWs) bands (ev): -47.6652 -47.6652 -47.6327 -47.6327 -21.9780 -21.9780 -21.8754 -21.8754 -14.3583 -14.3583 -14.2368 -14.2368 -14.0733 -14.0733 -14.0172 -14.0172 4.9788 4.9788 5.0285 5.0285 5.6305 5.6305 5.6853 5.6853 5.8233 5.8233 7.7594 7.7594 9.2509 9.2509 13.1195 13.1195 13.2050 13.2050 14.7389 14.7389 15.1166 15.1166 15.1753 15.1753 16.0697 16.0697 17.0059 17.0059 k = 0.5000 0.1946 0.4044 ( 2402 PWs) bands (ev): -47.6661 -47.6661 -47.6328 -47.6328 -21.9774 -21.9774 -21.8723 -21.8723 -14.3583 -14.3583 -14.2306 -14.2306 -14.0689 -14.0689 -14.0120 -14.0120 4.9707 4.9707 5.0265 5.0265 5.6306 5.6306 5.6827 5.6827 5.8336 5.8336 7.7017 7.7017 9.1612 9.1612 13.0885 13.0885 13.1698 13.1698 14.8011 14.8011 15.0839 15.0839 15.2672 15.2672 16.0486 16.0486 17.1188 17.1188 k = 0.5000 0.1946 0.3842 ( 2402 PWs) bands (ev): -47.6669 -47.6669 -47.6329 -47.6329 -21.9769 -21.9769 -21.8693 -21.8693 -14.3584 -14.3584 -14.2244 -14.2244 -14.0651 -14.0651 -14.0066 -14.0066 4.9624 4.9624 5.0243 5.0243 5.6312 5.6312 5.6804 5.6804 5.8438 5.8438 7.6469 7.6469 9.0742 9.0742 13.0574 13.0574 13.1356 13.1356 14.8558 14.8558 15.0525 15.0525 15.3661 15.3661 16.0229 16.0229 17.2044 17.2044 k = 0.5000 0.1946 0.3640 ( 2402 PWs) bands (ev): -47.6678 -47.6678 -47.6330 -47.6330 -21.9764 -21.9764 -21.8664 -21.8664 -14.3586 -14.3586 -14.2181 -14.2181 -14.0619 -14.0619 -14.0013 -14.0013 4.9541 4.9541 5.0220 5.0220 5.6322 5.6322 5.6784 5.6784 5.8538 5.8538 7.5948 7.5948 8.9901 8.9901 13.0263 13.0263 13.1026 13.1026 14.8927 14.8927 15.0381 15.0381 15.4663 15.4663 15.9948 15.9948 17.2660 17.2660 k = 0.5000 0.1946 0.3438 ( 2402 PWs) bands (ev): -47.6685 -47.6685 -47.6331 -47.6331 -21.9759 -21.9759 -21.8635 -21.8635 -14.3589 -14.3589 -14.2119 -14.2119 -14.0591 -14.0591 -13.9959 -13.9959 4.9459 4.9459 5.0195 5.0195 5.6335 5.6335 5.6767 5.6767 5.8634 5.8634 7.5457 7.5457 8.9092 8.9092 12.9956 12.9956 13.0712 13.0712 14.8970 14.8970 15.0558 15.0558 15.5669 15.5669 15.9659 15.9659 17.3257 17.3257 k = 0.5000 0.1946 0.3235 ( 2402 PWs) bands (ev): -47.6693 -47.6693 -47.6332 -47.6332 -21.9755 -21.9755 -21.8608 -21.8608 -14.3592 -14.3592 -14.2056 -14.2056 -14.0568 -14.0568 -13.9905 -13.9905 4.9379 4.9379 5.0169 5.0169 5.6352 5.6352 5.6755 5.6755 5.8728 5.8728 7.4993 7.4993 8.8315 8.8315 12.9654 12.9654 13.0414 13.0414 14.8771 14.8771 15.0970 15.0970 15.6670 15.6670 15.9379 15.9379 17.3849 17.3849 k = 0.5000 0.1946 0.3033 ( 2402 PWs) bands (ev): -47.6700 -47.6700 -47.6332 -47.6332 -21.9750 -21.9750 -21.8583 -21.8583 -14.3595 -14.3595 -14.1995 -14.1995 -14.0550 -14.0550 -13.9853 -13.9853 4.9300 4.9300 5.0142 5.0142 5.6370 5.6370 5.6747 5.6747 5.8817 5.8817 7.4559 7.4559 8.7573 8.7573 12.9360 12.9360 13.0134 13.0134 14.8492 14.8492 15.1454 15.1454 15.7640 15.7640 15.9138 15.9138 17.4434 17.4434 k = 0.5000 0.1946 0.2831 ( 2402 PWs) bands (ev): -47.6707 -47.6707 -47.6333 -47.6333 -21.9745 -21.9745 -21.8559 -21.8559 -14.3598 -14.3598 -14.1934 -14.1934 -14.0536 -14.0536 -13.9802 -13.9802 4.9224 4.9224 5.0115 5.0115 5.6388 5.6388 5.6743 5.6743 5.8902 5.8902 7.4153 7.4153 8.6867 8.6867 12.9077 12.9077 12.9871 12.9871 14.8196 14.8196 15.1943 15.1943 15.8378 15.8378 15.9139 15.9139 17.5012 17.5012 k = 0.5000 0.1946 0.2629 ( 2400 PWs) bands (ev): -47.6713 -47.6713 -47.6334 -47.6334 -21.9741 -21.9741 -21.8537 -21.8537 -14.3601 -14.3601 -14.1875 -14.1875 -14.0526 -14.0526 -13.9753 -13.9753 4.9152 4.9152 5.0088 5.0088 5.6407 5.6407 5.6745 5.6745 5.8983 5.8983 7.3775 7.3775 8.6201 8.6201 12.8806 12.8806 12.9627 12.9627 14.7905 14.7905 15.2414 15.2414 15.8393 15.8393 15.9872 15.9872 17.5582 17.5582 k = 0.5000 0.1946 0.2427 ( 2398 PWs) bands (ev): -47.6719 -47.6719 -47.6335 -47.6335 -21.9737 -21.9737 -21.8515 -21.8515 -14.3604 -14.3604 -14.1818 -14.1818 -14.0517 -14.0517 -13.9706 -13.9706 4.9083 4.9083 5.0061 5.0061 5.6425 5.6425 5.6751 5.6751 5.9059 5.9059 7.3426 7.3426 8.5574 8.5574 12.8549 12.8549 12.9401 12.9401 14.7627 14.7627 15.2855 15.2855 15.8206 15.8206 16.0817 16.0817 17.6143 17.6143 k = 0.5000 0.1946 0.2224 ( 2398 PWs) bands (ev): -47.6725 -47.6725 -47.6335 -47.6335 -21.9733 -21.9733 -21.8495 -21.8495 -14.3608 -14.3608 -14.1763 -14.1763 -14.0513 -14.0513 -13.9662 -13.9662 4.9018 4.9018 5.0034 5.0034 5.6441 5.6441 5.6761 5.6761 5.9131 5.9131 7.3106 7.3106 8.4989 8.4989 12.8308 12.8308 12.9193 12.9193 14.7366 14.7366 15.3260 15.3260 15.8014 15.8014 16.1772 16.1772 17.6697 17.6697 k = 0.5000 0.1946 0.2022 ( 2396 PWs) bands (ev): -47.6730 -47.6730 -47.6336 -47.6336 -21.9730 -21.9730 -21.8477 -21.8477 -14.3610 -14.3610 -14.1711 -14.1711 -14.0511 -14.0511 -13.9621 -13.9621 4.8958 4.8958 5.0008 5.0008 5.6456 5.6456 5.6775 5.6775 5.9197 5.9197 7.2813 7.2813 8.4448 8.4448 12.8085 12.8085 12.9003 12.9003 14.7125 14.7125 15.3621 15.3621 15.7844 15.7844 16.2707 16.2707 17.7243 17.7243 k = 0.5000 0.1946 0.1820 ( 2392 PWs) bands (ev): -47.6735 -47.6735 -47.6336 -47.6336 -21.9726 -21.9726 -21.8460 -21.8460 -14.3612 -14.3612 -14.1660 -14.1660 -14.0511 -14.0511 -13.9584 -13.9584 4.8903 4.8903 4.9984 4.9984 5.6468 5.6468 5.6792 5.6792 5.9259 5.9259 7.2549 7.2549 8.3952 8.3952 12.7880 12.7880 12.8831 12.8831 14.6904 14.6904 15.3936 15.3936 15.7703 15.7703 16.3609 16.3609 17.7782 17.7782 k = 0.5000 0.1946 0.1618 ( 2396 PWs) bands (ev): -47.6739 -47.6739 -47.6337 -47.6337 -21.9723 -21.9723 -21.8446 -21.8446 -14.3615 -14.3615 -14.1614 -14.1614 -14.0513 -14.0513 -13.9550 -13.9550 4.8851 4.8851 4.9961 4.9961 5.6478 5.6478 5.6811 5.6811 5.9313 5.9313 7.2313 7.2313 8.3504 8.3504 12.7695 12.7695 12.8677 12.8677 14.6705 14.6705 15.4199 15.4199 15.7596 15.7596 16.4465 16.4465 17.8316 17.8316 k = 0.5000 0.1946 0.1415 ( 2396 PWs) bands (ev): -47.6743 -47.6743 -47.6337 -47.6337 -21.9721 -21.9721 -21.8433 -21.8433 -14.3617 -14.3617 -14.1572 -14.1572 -14.0516 -14.0516 -13.9519 -13.9519 4.8806 4.8806 4.9939 4.9939 5.6486 5.6486 5.6831 5.6831 5.9363 5.9363 7.2106 7.2106 8.3103 8.3103 12.7530 12.7530 12.8542 12.8542 14.6529 14.6529 15.4411 15.4411 15.7525 15.7525 16.5263 16.5263 17.8843 17.8843 k = 0.5000 0.1946 0.1213 ( 2396 PWs) bands (ev): -47.6746 -47.6746 -47.6338 -47.6338 -21.9719 -21.9719 -21.8421 -21.8421 -14.3619 -14.3619 -14.1534 -14.1534 -14.0520 -14.0520 -13.9492 -13.9492 4.8767 4.8767 4.9920 4.9920 5.6493 5.6493 5.6851 5.6851 5.9406 5.9406 7.1926 7.1926 8.2753 8.2753 12.7386 12.7386 12.8424 12.8424 14.6375 14.6375 15.4573 15.4573 15.7485 15.7485 16.5991 16.5991 17.9360 17.9360 k = 0.5000 0.1946 0.1011 ( 2396 PWs) bands (ev): -47.6749 -47.6749 -47.6338 -47.6338 -21.9717 -21.9717 -21.8412 -21.8412 -14.3621 -14.3621 -14.1500 -14.1500 -14.0525 -14.0525 -13.9469 -13.9469 4.8733 4.8733 4.9904 4.9904 5.6498 5.6498 5.6869 5.6869 5.9444 5.9444 7.1774 7.1774 8.2455 8.2455 12.7263 12.7263 12.8325 12.8325 14.6244 14.6244 15.4690 15.4690 15.7474 15.7474 16.6635 16.6635 17.9854 17.9854 k = 0.5000 0.1946 0.0809 ( 2408 PWs) bands (ev): -47.6751 -47.6751 -47.6338 -47.6338 -21.9716 -21.9716 -21.8405 -21.8405 -14.3623 -14.3623 -14.1473 -14.1473 -14.0530 -14.0530 -13.9452 -13.9452 4.8703 4.8703 4.9889 4.9889 5.6501 5.6501 5.6885 5.6885 5.9473 5.9473 7.1649 7.1649 8.2208 8.2208 12.7162 12.7162 12.8243 12.8243 14.6137 14.6137 15.4769 15.4769 15.7481 15.7481 16.7183 16.7183 18.0307 18.0307 k = 0.5000 0.1946 0.0607 ( 2404 PWs) bands (ev): -47.6753 -47.6753 -47.6338 -47.6338 -21.9715 -21.9715 -21.8399 -21.8399 -14.3623 -14.3623 -14.1450 -14.1450 -14.0534 -14.0534 -13.9437 -13.9437 4.8682 4.8682 4.9878 4.9878 5.6504 5.6504 5.6899 5.6899 5.9497 5.9497 7.1553 7.1553 8.2016 8.2016 12.7084 12.7084 12.8180 12.8180 14.6053 14.6053 15.4819 15.4819 15.7499 15.7499 16.7623 16.7623 18.0684 18.0684 k = 0.5000 0.1946 0.0404 ( 2408 PWs) bands (ev): -47.6754 -47.6754 -47.6339 -47.6339 -21.9715 -21.9715 -21.8394 -21.8394 -14.3625 -14.3625 -14.1434 -14.1434 -14.0537 -14.0537 -13.9426 -13.9426 4.8666 4.8666 4.9870 4.9870 5.6506 5.6506 5.6908 5.6908 5.9514 5.9514 7.1484 7.1484 8.1877 8.1877 12.7027 12.7027 12.8134 12.8134 14.5993 14.5993 15.4849 15.4849 15.7519 15.7519 16.7944 16.7944 18.0956 18.0956 k = 0.5000 0.1946 0.0202 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8392 -21.8392 -14.3625 -14.3625 -14.1425 -14.1425 -14.0539 -14.0539 -13.9421 -13.9421 4.8656 4.8656 4.9865 4.9865 5.6507 5.6507 5.6914 5.6914 5.9524 5.9524 7.1443 7.1443 8.1794 8.1794 12.6994 12.6994 12.8107 12.8107 14.5957 14.5957 15.4864 15.4864 15.7533 15.7533 16.8140 16.8140 18.1111 18.1111 k = 0.5000 0.1946 0.0000 ( 2412 PWs) bands (ev): -47.6755 -47.6755 -47.6339 -47.6339 -21.9714 -21.9714 -21.8391 -21.8391 -14.3625 -14.3625 -14.1421 -14.1421 -14.0540 -14.0540 -13.9418 -13.9418 4.8652 4.8652 4.9863 4.9863 5.6508 5.6508 5.6916 5.6916 5.9527 5.9527 7.1429 7.1429 8.1766 8.1766 12.6982 12.6982 12.8098 12.8098 14.5945 14.5945 15.4868 15.4868 15.7538 15.7538 16.8206 16.8206 18.1160 18.1160 k = 0.0000 0.0000 1.3784 ( 2438 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9996 -21.9996 -14.4357 -14.4357 -14.4320 -14.4320 -14.2300 -14.2300 -14.2059 -14.2059 4.8776 4.8776 4.9735 4.9735 5.4129 5.4129 5.8095 5.8095 6.2015 6.2015 11.2232 11.2232 11.6874 11.6874 12.0546 12.0546 12.7798 12.7798 13.4573 13.4573 14.9799 14.9799 15.4115 15.4115 17.2132 17.2132 18.2955 18.2955 k = 0.0179 0.0070 1.3784 ( 2436 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9996 -21.9996 -14.4357 -14.4357 -14.4319 -14.4319 -14.2300 -14.2300 -14.2059 -14.2059 4.8776 4.8776 4.9735 4.9735 5.4129 5.4129 5.8095 5.8095 6.2015 6.2015 11.2235 11.2235 11.6868 11.6868 12.0559 12.0559 12.7740 12.7740 13.4648 13.4648 14.9748 14.9748 15.4156 15.4156 17.2182 17.2182 18.1637 18.1637 k = 0.0357 0.0139 1.3784 ( 2436 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0045 -22.0045 -21.9996 -21.9996 -14.4359 -14.4359 -14.4318 -14.4318 -14.2300 -14.2300 -14.2059 -14.2059 4.8777 4.8777 4.9735 4.9735 5.4129 5.4129 5.8094 5.8094 6.2016 6.2016 11.2244 11.2244 11.6850 11.6850 12.0597 12.0597 12.7572 12.7572 13.4864 13.4864 14.9594 14.9594 15.4278 15.4278 17.2330 17.2330 18.0217 18.0217 k = 0.0536 0.0209 1.3784 ( 2432 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0044 -22.0044 -21.9996 -21.9996 -14.4360 -14.4360 -14.4316 -14.4316 -14.2300 -14.2300 -14.2058 -14.2058 4.8777 4.8777 4.9735 4.9735 5.4129 5.4129 5.8095 5.8095 6.2016 6.2016 11.2258 11.2258 11.6822 11.6822 12.0662 12.0662 12.7315 12.7315 13.5203 13.5203 14.9344 14.9344 15.4480 15.4480 17.2567 17.2567 17.8793 17.8793 k = 0.0714 0.0278 1.3784 ( 2432 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0044 -22.0044 -21.9996 -21.9996 -14.4363 -14.4363 -14.4314 -14.4314 -14.2300 -14.2300 -14.2058 -14.2058 4.8778 4.8778 4.9734 4.9734 5.4129 5.4129 5.8094 5.8094 6.2016 6.2016 11.2278 11.2278 11.6784 11.6784 12.0753 12.0753 12.6991 12.6991 13.5641 13.5641 14.9005 14.9005 15.4758 15.4758 17.2875 17.2875 17.7396 17.7396 k = 0.0893 0.0348 1.3784 ( 2428 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0044 -22.0044 -21.9995 -21.9995 -14.4365 -14.4365 -14.4311 -14.4311 -14.2300 -14.2300 -14.2058 -14.2058 4.8778 4.8778 4.9735 4.9735 5.4130 5.4130 5.8095 5.8095 6.2016 6.2016 11.2301 11.2301 11.6738 11.6738 12.0868 12.0868 12.6622 12.6622 13.6155 13.6155 14.8588 14.8588 15.5109 15.5109 17.3209 17.3209 17.6074 17.6074 k = 0.1071 0.0417 1.3784 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9994 -21.9994 -14.4367 -14.4367 -14.4306 -14.4306 -14.2300 -14.2300 -14.2056 -14.2056 4.8780 4.8780 4.9735 4.9735 5.4131 5.4131 5.8095 5.8095 6.2017 6.2017 11.2328 11.2328 11.6686 11.6686 12.1009 12.1009 12.6226 12.6226 13.6727 13.6727 14.8102 14.8102 15.5527 15.5527 17.3377 17.3377 17.5020 17.5020 k = 0.1250 0.0487 1.3784 ( 2416 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0043 -22.0043 -21.9994 -21.9994 -14.4370 -14.4370 -14.4303 -14.4303 -14.2300 -14.2300 -14.2056 -14.2056 4.8781 4.8781 4.9735 4.9735 5.4131 5.4131 5.8095 5.8095 6.2017 6.2017 11.2357 11.2357 11.6631 11.6631 12.1175 12.1175 12.5815 12.5815 13.7341 13.7341 14.7560 14.7560 15.6004 15.6004 17.2785 17.2785 17.4824 17.4824 k = 0.1429 0.0556 1.3784 ( 2416 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0043 -22.0043 -21.9994 -21.9994 -14.4372 -14.4372 -14.4301 -14.4301 -14.2301 -14.2301 -14.2056 -14.2056 4.8782 4.8782 4.9734 4.9734 5.4131 5.4131 5.8094 5.8094 6.2017 6.2017 11.2386 11.2386 11.6576 11.6576 12.1365 12.1365 12.5399 12.5399 13.7985 13.7985 14.6973 14.6973 15.6528 15.6528 17.1697 17.1697 17.5219 17.5219 k = 0.1607 0.0626 1.3784 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9994 -21.9994 -14.4374 -14.4374 -14.4299 -14.4299 -14.2301 -14.2301 -14.2056 -14.2056 4.8783 4.8783 4.9734 4.9734 5.4131 5.4131 5.8094 5.8094 6.2017 6.2017 11.2415 11.2415 11.6522 11.6522 12.1578 12.1578 12.4987 12.4987 13.8649 13.8649 14.6353 14.6353 15.7086 15.7086 17.0572 17.0572 17.5746 17.5746 k = 0.1786 0.0695 1.3784 ( 2416 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9994 -21.9994 -14.4376 -14.4376 -14.4297 -14.4297 -14.2301 -14.2301 -14.2056 -14.2056 4.8784 4.8784 4.9734 4.9734 5.4131 5.4131 5.8093 5.8093 6.2017 6.2017 11.2441 11.2441 11.6474 11.6474 12.1813 12.1813 12.4585 12.4585 13.9320 13.9320 14.5715 14.5715 15.7653 15.7653 16.9518 16.9518 17.6297 17.6297 k = 0.1964 0.0765 1.3784 ( 2414 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0043 -22.0043 -21.9993 -21.9993 -14.4378 -14.4378 -14.4295 -14.4295 -14.2301 -14.2301 -14.2055 -14.2055 4.8785 4.8785 4.9734 4.9734 5.4131 5.4131 5.8093 5.8093 6.2017 6.2017 11.2464 11.2464 11.6434 11.6434 12.2067 12.2067 12.4197 12.4197 13.9980 13.9980 14.5077 14.5077 15.8195 15.8195 16.8590 16.8590 17.6823 17.6823 k = 0.2143 0.0834 1.3784 ( 2414 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0043 -22.0043 -21.9993 -21.9993 -14.4379 -14.4379 -14.4294 -14.4294 -14.2301 -14.2301 -14.2056 -14.2056 4.8785 4.8785 4.9733 4.9733 5.4131 5.4131 5.8093 5.8093 6.2017 6.2017 11.2481 11.2481 11.6403 11.6403 12.2334 12.2334 12.3833 12.3833 14.0596 14.0596 14.4475 14.4475 15.8663 15.8663 16.7844 16.7844 17.7273 17.7273 k = 0.2321 0.0904 1.3784 ( 2418 PWs) bands (ev): -47.6286 -47.6286 -47.6278 -47.6278 -22.0043 -22.0043 -21.9993 -21.9993 -14.4380 -14.4380 -14.4293 -14.4293 -14.2300 -14.2300 -14.2056 -14.2056 4.8785 4.8785 4.9733 4.9733 5.4131 5.4131 5.8092 5.8092 6.2016 6.2016 11.2491 11.2491 11.6384 11.6384 12.2592 12.2592 12.3516 12.3516 14.1092 14.1092 14.3988 14.3988 15.8989 15.8989 16.7350 16.7350 17.7587 17.7587 k = 0.2500 0.0973 1.3784 ( 2416 PWs) bands (ev): -47.6285 -47.6285 -47.6278 -47.6278 -22.0044 -22.0044 -21.9993 -21.9993 -14.4381 -14.4381 -14.4292 -14.4292 -14.2300 -14.2300 -14.2056 -14.2056 4.8785 4.8785 4.9733 4.9733 5.4131 5.4131 5.8092 5.8092 6.2017 6.2017 11.2495 11.2495 11.6377 11.6377 12.2737 12.2737 12.3352 12.3352 14.1300 14.1300 14.3782 14.3782 15.9108 15.9108 16.7175 16.7175 17.7702 17.7702 Writing output data file Hf2Cd.save init_run : 0.57s CPU 0.86s WALL ( 1 calls) electrons : 196.14s CPU 199.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.06s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 196.13s CPU 199.75s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.08s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.05s WALL ( 409 calls) cegterg : 176.96s CPU 178.87s WALL ( 464 calls) Called by sum_band: Called by *egterg: h_psi : 135.03s CPU 136.00s WALL ( 7828 calls) s_psi : 3.33s CPU 3.36s WALL ( 7828 calls) g_psi : 0.09s CPU 0.14s WALL ( 6955 calls) cdiaghg : 45.96s CPU 46.38s WALL ( 7364 calls) cegterg:over : 3.66s CPU 3.97s WALL ( 6955 calls) cegterg:upda : 2.80s CPU 3.16s WALL ( 6955 calls) cegterg:last : 1.39s CPU 1.47s WALL ( 1286 calls) cdiaghg:chol : 2.54s CPU 2.61s WALL ( 7364 calls) cdiaghg:inve : 1.68s CPU 1.56s WALL ( 7364 calls) cdiaghg:para : 2.65s CPU 2.72s WALL ( 14728 calls) Called by h_psi: h_psi:vloc : 127.05s CPU 128.40s WALL ( 7828 calls) h_psi:vnl : 7.88s CPU 7.46s WALL ( 7828 calls) add_vuspsi : 4.27s CPU 4.02s WALL ( 7828 calls) General routines calbec : 3.59s CPU 3.42s WALL ( 7828 calls) fft : 0.03s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 110.87s CPU 112.17s WALL ( 798412 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.15s CPU 0.37s WALL ( 818 calls) Parallel routines fft_scatter : 30.74s CPU 30.75s WALL ( 798435 calls) PWSCF : 3m31.15s CPU 4m 4.95s WALL This run was terminated on: 16:57:10 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=