Program PWSCF v.5.4.0 starts on 3Aug2017 at 20:15: 1 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./CrxB3H8x2.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 59 59 16 3699 3607 544 Max 60 60 17 3710 3636 553 Sum 2151 2125 605 133387 130359 19775 bravais-lattice index = 14 lattice parameter (alat) = 8.2955 a.u. unit-cell volume = 1348.2674 (a.u.)^3 number of atoms/cell = 23 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.295519 celldm(2)= 1.297098 celldm(3)= 2.055447 celldm(4)= -0.262054 celldm(5)= -0.066448 celldm(6)= -0.360029 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.466993 1.210116 0.000000 ) a(3) = ( -0.136580 -0.630063 1.951724 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.385908 0.194560 ) b(2) = ( 0.000000 0.826367 0.266771 ) b(3) = ( 0.000000 0.000000 0.512367 ) PseudoPot. # 1 for Cr read from file: /users/gautes/Pseudo/Cr.rel-pbe-oncvpsp.UPF MD5 check sum: 05b5af6f30ea3763d55f309fcccb1da3 Pseudo is Norm-conserving, Zval = 14.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1638 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 PseudoPot. # 2 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cr 14.00 51.99610 Cr( 1.00) H 1.00 1.00790 H( 1.00) B 3.00 10.81100 B( 1.00) 2 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 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 266 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.4131836 -0.1333856), wk = 0.0037594 k( 2) = ( 0.0000000 -0.4002716 -0.1292173), wk = 0.0037594 k( 3) = ( 0.0000000 -0.3873597 -0.1250490), wk = 0.0037594 k( 4) = ( 0.0000000 -0.3744477 -0.1208807), wk = 0.0037594 k( 5) = ( 0.0000000 -0.3615357 -0.1167124), wk = 0.0037594 k( 6) = ( 0.0000000 -0.3486237 -0.1125441), wk = 0.0037594 k( 7) = ( 0.0000000 -0.3357117 -0.1083758), wk = 0.0037594 k( 8) = ( 0.0000000 -0.3227997 -0.1042075), wk = 0.0037594 k( 9) = ( 0.0000000 -0.3098877 -0.1000392), wk = 0.0037594 k( 10) = ( 0.0000000 -0.2969757 -0.0958709), wk = 0.0037594 k( 11) = ( 0.0000000 -0.2840637 -0.0917026), wk = 0.0037594 k( 12) = ( 0.0000000 -0.2711518 -0.0875343), wk = 0.0037594 k( 13) = ( 0.0000000 -0.2582398 -0.0833660), wk = 0.0037594 k( 14) = ( 0.0000000 -0.2453278 -0.0791977), wk = 0.0037594 k( 15) = ( 0.0000000 -0.2324158 -0.0750294), wk = 0.0037594 k( 16) = ( 0.0000000 -0.2195038 -0.0708611), wk = 0.0037594 k( 17) = ( 0.0000000 -0.2065918 -0.0666928), wk = 0.0037594 k( 18) = ( 0.0000000 -0.1936798 -0.0625245), wk = 0.0037594 k( 19) = ( 0.0000000 -0.1807678 -0.0583562), wk = 0.0037594 k( 20) = ( 0.0000000 -0.1678559 -0.0541879), wk = 0.0037594 k( 21) = ( 0.0000000 -0.1549439 -0.0500196), wk = 0.0037594 k( 22) = ( 0.0000000 -0.1420319 -0.0458513), wk = 0.0037594 k( 23) = ( 0.0000000 -0.1291199 -0.0416830), wk = 0.0037594 k( 24) = ( 0.0000000 -0.1162079 -0.0375147), wk = 0.0037594 k( 25) = ( 0.0000000 -0.1032959 -0.0333464), wk = 0.0037594 k( 26) = ( 0.0000000 -0.0903839 -0.0291781), wk = 0.0037594 k( 27) = ( 0.0000000 -0.0774719 -0.0250098), wk = 0.0037594 k( 28) = ( 0.0000000 -0.0645599 -0.0208415), wk = 0.0037594 k( 29) = ( 0.0000000 -0.0516480 -0.0166732), wk = 0.0037594 k( 30) = ( 0.0000000 -0.0387360 -0.0125049), wk = 0.0037594 k( 31) = ( 0.0000000 -0.0258240 -0.0083366), wk = 0.0037594 k( 32) = ( 0.0000000 -0.0129120 -0.0041683), wk = 0.0037594 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 35) = ( 0.0128205 0.0049475 0.0024944), wk = 0.0037594 k( 36) = ( 0.0256410 0.0098951 0.0049887), wk = 0.0037594 k( 37) = ( 0.0384615 0.0148426 0.0074831), wk = 0.0037594 k( 38) = ( 0.0512821 0.0197902 0.0099774), wk = 0.0037594 k( 39) = ( 0.0641026 0.0247377 0.0124718), wk = 0.0037594 k( 40) = ( 0.0769231 0.0296852 0.0149661), wk = 0.0037594 k( 41) = ( 0.0897436 0.0346328 0.0174605), wk = 0.0037594 k( 42) = ( 0.1025641 0.0395803 0.0199548), wk = 0.0037594 k( 43) = ( 0.1153846 0.0445278 0.0224492), wk = 0.0037594 k( 44) = ( 0.1282051 0.0494754 0.0249436), wk = 0.0037594 k( 45) = ( 0.1410256 0.0544229 0.0274379), wk = 0.0037594 k( 46) = ( 0.1538461 0.0593705 0.0299323), wk = 0.0037594 k( 47) = ( 0.1666667 0.0643180 0.0324266), wk = 0.0037594 k( 48) = ( 0.1794872 0.0692655 0.0349210), wk = 0.0037594 k( 49) = ( 0.1923077 0.0742131 0.0374153), wk = 0.0037594 k( 50) = ( 0.2051282 0.0791606 0.0399097), wk = 0.0037594 k( 51) = ( 0.2179487 0.0841082 0.0424040), wk = 0.0037594 k( 52) = ( 0.2307692 0.0890557 0.0448984), wk = 0.0037594 k( 53) = ( 0.2435897 0.0940032 0.0473928), wk = 0.0037594 k( 54) = ( 0.2564103 0.0989508 0.0498871), wk = 0.0037594 k( 55) = ( 0.2692308 0.1038983 0.0523815), wk = 0.0037594 k( 56) = ( 0.2820513 0.1088458 0.0548758), wk = 0.0037594 k( 57) = ( 0.2948718 0.1137934 0.0573702), wk = 0.0037594 k( 58) = ( 0.3076923 0.1187409 0.0598645), wk = 0.0037594 k( 59) = ( 0.3205128 0.1236885 0.0623589), wk = 0.0037594 k( 60) = ( 0.3333333 0.1286360 0.0648532), wk = 0.0037594 k( 61) = ( 0.3461538 0.1335835 0.0673476), wk = 0.0037594 k( 62) = ( 0.3589744 0.1385311 0.0698419), wk = 0.0037594 k( 63) = ( 0.3717949 0.1434786 0.0723363), wk = 0.0037594 k( 64) = ( 0.3846154 0.1484261 0.0748307), wk = 0.0037594 k( 65) = ( 0.3974359 0.1533737 0.0773250), wk = 0.0037594 k( 66) = ( 0.4102564 0.1583212 0.0798194), wk = 0.0037594 k( 67) = ( 0.4230769 0.1632688 0.0823137), wk = 0.0037594 k( 68) = ( 0.4358974 0.1682163 0.0848081), wk = 0.0037594 k( 69) = ( 0.4487179 0.1731638 0.0873024), wk = 0.0037594 k( 70) = ( 0.4615385 0.1781114 0.0897968), wk = 0.0037594 k( 71) = ( 0.4743590 0.1830589 0.0922911), wk = 0.0037594 k( 72) = ( 0.4871795 0.1880065 0.0947855), wk = 0.0037594 k( 73) = ( 0.5000000 0.1929540 0.0972799), wk = 0.0037594 k( 74) = ( 0.5000000 -0.2202296 -0.0361057), wk = 0.0037594 k( 75) = ( 0.4875000 -0.2147239 -0.0352031), wk = 0.0037594 k( 76) = ( 0.4750000 -0.2092182 -0.0343004), wk = 0.0037594 k( 77) = ( 0.4625000 -0.2037124 -0.0333978), wk = 0.0037594 k( 78) = ( 0.4500000 -0.1982067 -0.0324951), wk = 0.0037594 k( 79) = ( 0.4375000 -0.1927009 -0.0315925), wk = 0.0037594 k( 80) = ( 0.4250000 -0.1871952 -0.0306899), wk = 0.0037594 k( 81) = ( 0.4125000 -0.1816895 -0.0297872), wk = 0.0037594 k( 82) = ( 0.4000000 -0.1761837 -0.0288846), wk = 0.0037594 k( 83) = ( 0.3875000 -0.1706780 -0.0279819), wk = 0.0037594 k( 84) = ( 0.3750000 -0.1651722 -0.0270793), wk = 0.0037594 k( 85) = ( 0.3625000 -0.1596665 -0.0261766), wk = 0.0037594 k( 86) = ( 0.3500000 -0.1541607 -0.0252740), wk = 0.0037594 k( 87) = ( 0.3375000 -0.1486550 -0.0243714), wk = 0.0037594 k( 88) = ( 0.3250000 -0.1431493 -0.0234687), wk = 0.0037594 k( 89) = ( 0.3125000 -0.1376435 -0.0225661), wk = 0.0037594 k( 90) = ( 0.3000000 -0.1321378 -0.0216634), wk = 0.0037594 k( 91) = ( 0.2875000 -0.1266320 -0.0207608), wk = 0.0037594 k( 92) = ( 0.2750000 -0.1211263 -0.0198581), wk = 0.0037594 k( 93) = ( 0.2625000 -0.1156206 -0.0189555), wk = 0.0037594 k( 94) = ( 0.2500000 -0.1101148 -0.0180529), wk = 0.0037594 k( 95) = ( 0.2375000 -0.1046091 -0.0171502), wk = 0.0037594 k( 96) = ( 0.2250000 -0.0991033 -0.0162476), wk = 0.0037594 k( 97) = ( 0.2125000 -0.0935976 -0.0153449), wk = 0.0037594 k( 98) = ( 0.2000000 -0.0880919 -0.0144423), wk = 0.0037594 k( 99) = ( 0.1875000 -0.0825861 -0.0135396), wk = 0.0037594 k( 100) = ( 0.1750000 -0.0770804 -0.0126370), wk = 0.0037594 k( 101) = ( 0.1625000 -0.0715746 -0.0117344), wk = 0.0037594 k( 102) = ( 0.1500000 -0.0660689 -0.0108317), wk = 0.0037594 k( 103) = ( 0.1375000 -0.0605632 -0.0099291), wk = 0.0037594 k( 104) = ( 0.1250000 -0.0550574 -0.0090264), wk = 0.0037594 k( 105) = ( 0.1125000 -0.0495517 -0.0081238), wk = 0.0037594 k( 106) = ( 0.1000000 -0.0440459 -0.0072211), wk = 0.0037594 k( 107) = ( 0.0875000 -0.0385402 -0.0063185), wk = 0.0037594 k( 108) = ( 0.0750000 -0.0330344 -0.0054159), wk = 0.0037594 k( 109) = ( 0.0625000 -0.0275287 -0.0045132), wk = 0.0037594 k( 110) = ( 0.0500000 -0.0220230 -0.0036106), wk = 0.0037594 k( 111) = ( 0.0375000 -0.0165172 -0.0027079), wk = 0.0037594 k( 112) = ( 0.0250000 -0.0110115 -0.0018053), wk = 0.0037594 k( 113) = ( 0.0125000 -0.0055057 -0.0009026), wk = 0.0037594 k( 114) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 116) = ( -0.0121951 -0.0047062 0.0038757), wk = 0.0037594 k( 117) = ( -0.0243902 -0.0094124 0.0077514), wk = 0.0037594 k( 118) = ( -0.0365854 -0.0141186 0.0116271), wk = 0.0037594 k( 119) = ( -0.0487805 -0.0188248 0.0155028), wk = 0.0037594 k( 120) = ( -0.0609756 -0.0235310 0.0193785), wk = 0.0037594 k( 121) = ( -0.0731707 -0.0282372 0.0232542), wk = 0.0037594 k( 122) = ( -0.0853658 -0.0329434 0.0271299), wk = 0.0037594 k( 123) = ( -0.0975610 -0.0376496 0.0310056), wk = 0.0037594 k( 124) = ( -0.1097561 -0.0423558 0.0348813), wk = 0.0037594 k( 125) = ( -0.1219512 -0.0470620 0.0387570), wk = 0.0037594 k( 126) = ( -0.1341463 -0.0517681 0.0426327), wk = 0.0037594 k( 127) = ( -0.1463415 -0.0564743 0.0465085), wk = 0.0037594 k( 128) = ( -0.1585366 -0.0611805 0.0503842), wk = 0.0037594 k( 129) = ( -0.1707317 -0.0658867 0.0542599), wk = 0.0037594 k( 130) = ( -0.1829268 -0.0705929 0.0581356), wk = 0.0037594 k( 131) = ( -0.1951219 -0.0752991 0.0620113), wk = 0.0037594 k( 132) = ( -0.2073171 -0.0800053 0.0658870), wk = 0.0037594 k( 133) = ( -0.2195122 -0.0847115 0.0697627), wk = 0.0037594 k( 134) = ( -0.2317073 -0.0894177 0.0736384), wk = 0.0037594 k( 135) = ( -0.2439024 -0.0941239 0.0775141), wk = 0.0037594 k( 136) = ( -0.2560976 -0.0988301 0.0813898), wk = 0.0037594 k( 137) = ( -0.2682927 -0.1035363 0.0852655), wk = 0.0037594 k( 138) = ( -0.2804878 -0.1082425 0.0891412), wk = 0.0037594 k( 139) = ( -0.2926829 -0.1129487 0.0930169), wk = 0.0037594 k( 140) = ( -0.3048781 -0.1176549 0.0968926), wk = 0.0037594 k( 141) = ( -0.3170732 -0.1223611 0.1007683), wk = 0.0037594 k( 142) = ( -0.3292683 -0.1270673 0.1046440), wk = 0.0037594 k( 143) = ( -0.3414634 -0.1317735 0.1085197), wk = 0.0037594 k( 144) = ( -0.3536585 -0.1364797 0.1123954), wk = 0.0037594 k( 145) = ( -0.3658537 -0.1411859 0.1162711), wk = 0.0037594 k( 146) = ( -0.3780488 -0.1458920 0.1201468), wk = 0.0037594 k( 147) = ( -0.3902439 -0.1505982 0.1240225), wk = 0.0037594 k( 148) = ( -0.4024390 -0.1553044 0.1278982), wk = 0.0037594 k( 149) = ( -0.4146341 -0.1600106 0.1317740), wk = 0.0037594 k( 150) = ( -0.4268293 -0.1647168 0.1356497), wk = 0.0037594 k( 151) = ( -0.4390244 -0.1694230 0.1395254), wk = 0.0037594 k( 152) = ( -0.4512195 -0.1741292 0.1434011), wk = 0.0037594 k( 153) = ( -0.4634146 -0.1788354 0.1472768), wk = 0.0037594 k( 154) = ( -0.4756098 -0.1835416 0.1511525), wk = 0.0037594 k( 155) = ( -0.4878049 -0.1882478 0.1550282), wk = 0.0037594 k( 156) = ( -0.5000000 -0.1929540 0.1589039), wk = 0.0037594 k( 157) = ( -0.5000000 -0.6061376 0.0255183), wk = 0.0037594 k( 158) = ( -0.4912281 -0.5955036 0.0250706), wk = 0.0037594 k( 159) = ( -0.4824561 -0.5848696 0.0246229), wk = 0.0037594 k( 160) = ( -0.4736842 -0.5742356 0.0241752), wk = 0.0037594 k( 161) = ( -0.4649123 -0.5636017 0.0237275), wk = 0.0037594 k( 162) = ( -0.4561404 -0.5529677 0.0232799), wk = 0.0037594 k( 163) = ( -0.4473684 -0.5423337 0.0228322), wk = 0.0037594 k( 164) = ( -0.4385965 -0.5316997 0.0223845), wk = 0.0037594 k( 165) = ( -0.4298246 -0.5210657 0.0219368), wk = 0.0037594 k( 166) = ( -0.4210526 -0.5104317 0.0214891), wk = 0.0037594 k( 167) = ( -0.4122807 -0.4997977 0.0210414), wk = 0.0037594 k( 168) = ( -0.4035088 -0.4891637 0.0205937), wk = 0.0037594 k( 169) = ( -0.3947368 -0.4785297 0.0201460), wk = 0.0037594 k( 170) = ( -0.3859649 -0.4678957 0.0196983), wk = 0.0037594 k( 171) = ( -0.3771930 -0.4572617 0.0192507), wk = 0.0037594 k( 172) = ( -0.3684211 -0.4466277 0.0188030), wk = 0.0037594 k( 173) = ( -0.3596491 -0.4359937 0.0183553), wk = 0.0037594 k( 174) = ( -0.3508772 -0.4253597 0.0179076), wk = 0.0037594 k( 175) = ( -0.3421053 -0.4147257 0.0174599), wk = 0.0037594 k( 176) = ( -0.3333333 -0.4040917 0.0170122), wk = 0.0037594 k( 177) = ( -0.3245614 -0.3934578 0.0165645), wk = 0.0037594 k( 178) = ( -0.3157895 -0.3828238 0.0161168), wk = 0.0037594 k( 179) = ( -0.3070175 -0.3721898 0.0156691), wk = 0.0037594 k( 180) = ( -0.2982456 -0.3615558 0.0152214), wk = 0.0037594 k( 181) = ( -0.2894737 -0.3509218 0.0147738), wk = 0.0037594 k( 182) = ( -0.2807018 -0.3402878 0.0143261), wk = 0.0037594 k( 183) = ( -0.2719298 -0.3296538 0.0138784), wk = 0.0037594 k( 184) = ( -0.2631579 -0.3190198 0.0134307), wk = 0.0037594 k( 185) = ( -0.2543860 -0.3083858 0.0129830), wk = 0.0037594 k( 186) = ( -0.2456140 -0.2977518 0.0125353), wk = 0.0037594 k( 187) = ( -0.2368421 -0.2871178 0.0120876), wk = 0.0037594 k( 188) = ( -0.2280702 -0.2764838 0.0116399), wk = 0.0037594 k( 189) = ( -0.2192983 -0.2658498 0.0111922), wk = 0.0037594 k( 190) = ( -0.2105263 -0.2552158 0.0107446), wk = 0.0037594 k( 191) = ( -0.2017544 -0.2445819 0.0102969), wk = 0.0037594 k( 192) = ( -0.1929825 -0.2339479 0.0098492), wk = 0.0037594 k( 193) = ( -0.1842105 -0.2233139 0.0094015), wk = 0.0037594 k( 194) = ( -0.1754386 -0.2126799 0.0089538), wk = 0.0037594 k( 195) = ( -0.1666667 -0.2020459 0.0085061), wk = 0.0037594 k( 196) = ( -0.1578947 -0.1914119 0.0080584), wk = 0.0037594 k( 197) = ( -0.1491228 -0.1807779 0.0076107), wk = 0.0037594 k( 198) = ( -0.1403509 -0.1701439 0.0071630), wk = 0.0037594 k( 199) = ( -0.1315790 -0.1595099 0.0067153), wk = 0.0037594 k( 200) = ( -0.1228070 -0.1488759 0.0062677), wk = 0.0037594 k( 201) = ( -0.1140351 -0.1382419 0.0058200), wk = 0.0037594 k( 202) = ( -0.1052632 -0.1276079 0.0053723), wk = 0.0037594 k( 203) = ( -0.0964912 -0.1169739 0.0049246), wk = 0.0037594 k( 204) = ( -0.0877193 -0.1063399 0.0044769), wk = 0.0037594 k( 205) = ( -0.0789474 -0.0957059 0.0040292), wk = 0.0037594 k( 206) = ( -0.0701754 -0.0850719 0.0035815), wk = 0.0037594 k( 207) = ( -0.0614035 -0.0744380 0.0031338), wk = 0.0037594 k( 208) = ( -0.0526316 -0.0638040 0.0026861), wk = 0.0037594 k( 209) = ( -0.0438597 -0.0531700 0.0022384), wk = 0.0037594 k( 210) = ( -0.0350877 -0.0425360 0.0017908), wk = 0.0037594 k( 211) = ( -0.0263158 -0.0319020 0.0013431), wk = 0.0037594 k( 212) = ( -0.0175439 -0.0212680 0.0008954), wk = 0.0037594 k( 213) = ( -0.0087719 -0.0106340 0.0004477), wk = 0.0037594 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 216) = ( 0.0000000 0.0000000 0.0134834), wk = 0.0037594 k( 217) = ( 0.0000000 0.0000000 0.0269667), wk = 0.0037594 k( 218) = ( 0.0000000 0.0000000 0.0404501), wk = 0.0037594 k( 219) = ( 0.0000000 0.0000000 0.0539334), wk = 0.0037594 k( 220) = ( 0.0000000 0.0000000 0.0674168), wk = 0.0037594 k( 221) = ( 0.0000000 0.0000000 0.0809001), wk = 0.0037594 k( 222) = ( 0.0000000 0.0000000 0.0943835), wk = 0.0037594 k( 223) = ( 0.0000000 0.0000000 0.1078668), wk = 0.0037594 k( 224) = ( 0.0000000 0.0000000 0.1213502), wk = 0.0037594 k( 225) = ( 0.0000000 0.0000000 0.1348335), wk = 0.0037594 k( 226) = ( 0.0000000 0.0000000 0.1483169), wk = 0.0037594 k( 227) = ( 0.0000000 0.0000000 0.1618003), wk = 0.0037594 k( 228) = ( 0.0000000 0.0000000 0.1752836), wk = 0.0037594 k( 229) = ( 0.0000000 0.0000000 0.1887670), wk = 0.0037594 k( 230) = ( 0.0000000 0.0000000 0.2022503), wk = 0.0037594 k( 231) = ( 0.0000000 0.0000000 0.2157337), wk = 0.0037594 k( 232) = ( 0.0000000 0.0000000 0.2292170), wk = 0.0037594 k( 233) = ( 0.0000000 0.0000000 0.2427004), wk = 0.0037594 k( 234) = ( 0.0000000 0.0000000 0.2561837), wk = 0.0037594 k( 235) = ( 0.0000000 -0.4131836 0.1227982), wk = 0.0037594 k( 236) = ( 0.0000000 -0.3998551 0.1188369), wk = 0.0037594 k( 237) = ( 0.0000000 -0.3865266 0.1148757), wk = 0.0037594 k( 238) = ( 0.0000000 -0.3731981 0.1109145), wk = 0.0037594 k( 239) = ( 0.0000000 -0.3598696 0.1069532), wk = 0.0037594 k( 240) = ( 0.0000000 -0.3465411 0.1029920), wk = 0.0037594 k( 241) = ( 0.0000000 -0.3332126 0.0990308), wk = 0.0037594 k( 242) = ( 0.0000000 -0.3198841 0.0950695), wk = 0.0037594 k( 243) = ( 0.0000000 -0.3065556 0.0911083), wk = 0.0037594 k( 244) = ( 0.0000000 -0.2932271 0.0871471), wk = 0.0037594 k( 245) = ( 0.0000000 -0.2798986 0.0831859), wk = 0.0037594 k( 246) = ( 0.0000000 -0.2665701 0.0792246), wk = 0.0037594 k( 247) = ( 0.0000000 -0.2532416 0.0752634), wk = 0.0037594 k( 248) = ( 0.0000000 -0.2399131 0.0713022), wk = 0.0037594 k( 249) = ( 0.0000000 -0.2265846 0.0673409), wk = 0.0037594 k( 250) = ( 0.0000000 -0.2132561 0.0633797), wk = 0.0037594 k( 251) = ( 0.0000000 -0.1999276 0.0594185), wk = 0.0037594 k( 252) = ( 0.0000000 -0.1865991 0.0554572), wk = 0.0037594 k( 253) = ( 0.0000000 -0.1732706 0.0514960), wk = 0.0037594 k( 254) = ( 0.0000000 -0.1599421 0.0475348), wk = 0.0037594 k( 255) = ( 0.0000000 -0.1466135 0.0435735), wk = 0.0037594 k( 256) = ( 0.0000000 -0.1332850 0.0396123), wk = 0.0037594 k( 257) = ( 0.0000000 -0.1199565 0.0356511), wk = 0.0037594 k( 258) = ( 0.0000000 -0.1066280 0.0316898), wk = 0.0037594 k( 259) = ( 0.0000000 -0.0932995 0.0277286), wk = 0.0037594 k( 260) = ( 0.0000000 -0.0799710 0.0237674), wk = 0.0037594 k( 261) = ( 0.0000000 -0.0666425 0.0198062), wk = 0.0037594 k( 262) = ( 0.0000000 -0.0533140 0.0158449), wk = 0.0037594 k( 263) = ( 0.0000000 -0.0399855 0.0118837), wk = 0.0037594 k( 264) = ( 0.0000000 -0.0266570 0.0079225), wk = 0.0037594 k( 265) = ( 0.0000000 -0.0133285 0.0039612), wk = 0.0037594 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 -0.0000000), wk = 0.0037594 k( 2) = ( 0.0000000 -0.4843750 0.0000000), wk = 0.0037594 k( 3) = ( 0.0000000 -0.4687500 0.0000000), wk = 0.0037594 k( 4) = ( 0.0000000 -0.4531250 0.0000000), wk = 0.0037594 k( 5) = ( 0.0000000 -0.4375000 -0.0000000), wk = 0.0037594 k( 6) = ( 0.0000000 -0.4218750 -0.0000000), wk = 0.0037594 k( 7) = ( 0.0000000 -0.4062500 0.0000000), wk = 0.0037594 k( 8) = ( 0.0000000 -0.3906250 -0.0000000), wk = 0.0037594 k( 9) = ( 0.0000000 -0.3750000 0.0000000), wk = 0.0037594 k( 10) = ( 0.0000000 -0.3593750 0.0000000), wk = 0.0037594 k( 11) = ( 0.0000000 -0.3437500 -0.0000000), wk = 0.0037594 k( 12) = ( 0.0000000 -0.3281250 0.0000000), wk = 0.0037594 k( 13) = ( 0.0000000 -0.3125000 0.0000000), wk = 0.0037594 k( 14) = ( 0.0000000 -0.2968750 -0.0000000), wk = 0.0037594 k( 15) = ( 0.0000000 -0.2812500 0.0000000), wk = 0.0037594 k( 16) = ( 0.0000000 -0.2656250 0.0000000), wk = 0.0037594 k( 17) = ( 0.0000000 -0.2500000 -0.0000000), wk = 0.0037594 k( 18) = ( 0.0000000 -0.2343750 0.0000000), wk = 0.0037594 k( 19) = ( 0.0000000 -0.2187500 -0.0000000), wk = 0.0037594 k( 20) = ( 0.0000000 -0.2031250 0.0000000), wk = 0.0037594 k( 21) = ( 0.0000000 -0.1875000 0.0000000), wk = 0.0037594 k( 22) = ( 0.0000000 -0.1718750 -0.0000000), wk = 0.0037594 k( 23) = ( 0.0000000 -0.1562500 0.0000000), wk = 0.0037594 k( 24) = ( 0.0000000 -0.1406250 0.0000000), wk = 0.0037594 k( 25) = ( 0.0000000 -0.1250000 -0.0000000), wk = 0.0037594 k( 26) = ( 0.0000000 -0.1093750 -0.0000000), wk = 0.0037594 k( 27) = ( 0.0000000 -0.0937500 0.0000000), wk = 0.0037594 k( 28) = ( 0.0000000 -0.0781250 0.0000000), wk = 0.0037594 k( 29) = ( 0.0000000 -0.0625000 -0.0000000), wk = 0.0037594 k( 30) = ( 0.0000000 -0.0468750 0.0000000), wk = 0.0037594 k( 31) = ( 0.0000000 -0.0312500 -0.0000000), wk = 0.0037594 k( 32) = ( 0.0000000 -0.0156250 -0.0000000), wk = 0.0037594 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 35) = ( 0.0128205 0.0000000 -0.0000000), wk = 0.0037594 k( 36) = ( 0.0256410 0.0000000 0.0000000), wk = 0.0037594 k( 37) = ( 0.0384615 0.0000000 -0.0000000), wk = 0.0037594 k( 38) = ( 0.0512821 0.0000000 0.0000000), wk = 0.0037594 k( 39) = ( 0.0641026 0.0000000 0.0000000), wk = 0.0037594 k( 40) = ( 0.0769231 0.0000000 -0.0000000), wk = 0.0037594 k( 41) = ( 0.0897436 0.0000000 0.0000000), wk = 0.0037594 k( 42) = ( 0.1025641 0.0000000 0.0000000), wk = 0.0037594 k( 43) = ( 0.1153846 0.0000000 -0.0000000), wk = 0.0037594 k( 44) = ( 0.1282051 0.0000000 0.0000000), wk = 0.0037594 k( 45) = ( 0.1410256 0.0000000 0.0000000), wk = 0.0037594 k( 46) = ( 0.1538461 0.0000000 -0.0000000), wk = 0.0037594 k( 47) = ( 0.1666667 -0.0000000 0.0000000), wk = 0.0037594 k( 48) = ( 0.1794872 0.0000000 0.0000000), wk = 0.0037594 k( 49) = ( 0.1923077 0.0000000 0.0000000), wk = 0.0037594 k( 50) = ( 0.2051282 0.0000000 0.0000000), wk = 0.0037594 k( 51) = ( 0.2179487 0.0000000 -0.0000000), wk = 0.0037594 k( 52) = ( 0.2307692 0.0000000 -0.0000000), wk = 0.0037594 k( 53) = ( 0.2435897 0.0000000 0.0000000), wk = 0.0037594 k( 54) = ( 0.2564103 0.0000000 0.0000000), wk = 0.0037594 k( 55) = ( 0.2692308 0.0000000 0.0000000), wk = 0.0037594 k( 56) = ( 0.2820513 0.0000000 0.0000000), wk = 0.0037594 k( 57) = ( 0.2948718 0.0000000 0.0000000), wk = 0.0037594 k( 58) = ( 0.3076923 0.0000000 0.0000000), wk = 0.0037594 k( 59) = ( 0.3205128 0.0000000 0.0000000), wk = 0.0037594 k( 60) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0037594 k( 61) = ( 0.3461538 0.0000000 -0.0000000), wk = 0.0037594 k( 62) = ( 0.3589744 0.0000000 0.0000000), wk = 0.0037594 k( 63) = ( 0.3717949 0.0000000 -0.0000000), wk = 0.0037594 k( 64) = ( 0.3846154 0.0000000 0.0000000), wk = 0.0037594 k( 65) = ( 0.3974359 0.0000000 0.0000000), wk = 0.0037594 k( 66) = ( 0.4102564 0.0000000 0.0000000), wk = 0.0037594 k( 67) = ( 0.4230769 0.0000000 -0.0000000), wk = 0.0037594 k( 68) = ( 0.4358974 0.0000000 -0.0000000), wk = 0.0037594 k( 69) = ( 0.4487179 0.0000000 -0.0000000), wk = 0.0037594 k( 70) = ( 0.4615385 0.0000000 -0.0000000), wk = 0.0037594 k( 71) = ( 0.4743590 0.0000000 0.0000000), wk = 0.0037594 k( 72) = ( 0.4871795 0.0000000 0.0000000), wk = 0.0037594 k( 73) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037594 k( 74) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0037594 k( 75) = ( 0.4875000 -0.4875000 0.0000000), wk = 0.0037594 k( 76) = ( 0.4750000 -0.4750000 -0.0000000), wk = 0.0037594 k( 77) = ( 0.4625000 -0.4625000 0.0000000), wk = 0.0037594 k( 78) = ( 0.4500000 -0.4500000 0.0000000), wk = 0.0037594 k( 79) = ( 0.4375000 -0.4375000 0.0000000), wk = 0.0037594 k( 80) = ( 0.4250000 -0.4250000 -0.0000000), wk = 0.0037594 k( 81) = ( 0.4125000 -0.4125000 -0.0000000), wk = 0.0037594 k( 82) = ( 0.4000000 -0.4000000 0.0000000), wk = 0.0037594 k( 83) = ( 0.3875000 -0.3875000 0.0000000), wk = 0.0037594 k( 84) = ( 0.3750000 -0.3750000 0.0000000), wk = 0.0037594 k( 85) = ( 0.3625000 -0.3625000 0.0000000), wk = 0.0037594 k( 86) = ( 0.3500000 -0.3500000 -0.0000000), wk = 0.0037594 k( 87) = ( 0.3375000 -0.3375000 0.0000000), wk = 0.0037594 k( 88) = ( 0.3250000 -0.3250000 0.0000000), wk = 0.0037594 k( 89) = ( 0.3125000 -0.3125000 0.0000000), wk = 0.0037594 k( 90) = ( 0.3000000 -0.3000000 -0.0000000), wk = 0.0037594 k( 91) = ( 0.2875000 -0.2875000 0.0000000), wk = 0.0037594 k( 92) = ( 0.2750000 -0.2750000 0.0000000), wk = 0.0037594 k( 93) = ( 0.2625000 -0.2625000 0.0000000), wk = 0.0037594 k( 94) = ( 0.2500000 -0.2500000 0.0000000), wk = 0.0037594 k( 95) = ( 0.2375000 -0.2375000 -0.0000000), wk = 0.0037594 k( 96) = ( 0.2250000 -0.2250000 0.0000000), wk = 0.0037594 k( 97) = ( 0.2125000 -0.2125000 -0.0000000), wk = 0.0037594 k( 98) = ( 0.2000000 -0.2000000 0.0000000), wk = 0.0037594 k( 99) = ( 0.1875000 -0.1875000 0.0000000), wk = 0.0037594 k( 100) = ( 0.1750000 -0.1750000 -0.0000000), wk = 0.0037594 k( 101) = ( 0.1625000 -0.1625000 0.0000000), wk = 0.0037594 k( 102) = ( 0.1500000 -0.1500000 -0.0000000), wk = 0.0037594 k( 103) = ( 0.1375000 -0.1375000 0.0000000), wk = 0.0037594 k( 104) = ( 0.1250000 -0.1250000 0.0000000), wk = 0.0037594 k( 105) = ( 0.1125000 -0.1125000 0.0000000), wk = 0.0037594 k( 106) = ( 0.1000000 -0.1000000 0.0000000), wk = 0.0037594 k( 107) = ( 0.0875000 -0.0875000 -0.0000000), wk = 0.0037594 k( 108) = ( 0.0750000 -0.0750000 -0.0000000), wk = 0.0037594 k( 109) = ( 0.0625000 -0.0625000 0.0000000), wk = 0.0037594 k( 110) = ( 0.0500000 -0.0500000 0.0000000), wk = 0.0037594 k( 111) = ( 0.0375000 -0.0375000 -0.0000000), wk = 0.0037594 k( 112) = ( 0.0250000 -0.0250000 0.0000000), wk = 0.0037594 k( 113) = ( 0.0125000 -0.0125000 0.0000000), wk = 0.0037594 k( 114) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 116) = ( -0.0121951 -0.0000000 0.0121951), wk = 0.0037594 k( 117) = ( -0.0243902 -0.0000000 0.0243902), wk = 0.0037594 k( 118) = ( -0.0365854 -0.0000000 0.0365854), wk = 0.0037594 k( 119) = ( -0.0487805 -0.0000000 0.0487805), wk = 0.0037594 k( 120) = ( -0.0609756 -0.0000000 0.0609756), wk = 0.0037594 k( 121) = ( -0.0731707 -0.0000000 0.0731707), wk = 0.0037594 k( 122) = ( -0.0853658 -0.0000000 0.0853658), wk = 0.0037594 k( 123) = ( -0.0975610 -0.0000000 0.0975610), wk = 0.0037594 k( 124) = ( -0.1097561 -0.0000000 0.1097561), wk = 0.0037594 k( 125) = ( -0.1219512 -0.0000000 0.1219512), wk = 0.0037594 k( 126) = ( -0.1341463 -0.0000000 0.1341463), wk = 0.0037594 k( 127) = ( -0.1463415 -0.0000000 0.1463415), wk = 0.0037594 k( 128) = ( -0.1585366 -0.0000000 0.1585366), wk = 0.0037594 k( 129) = ( -0.1707317 -0.0000000 0.1707317), wk = 0.0037594 k( 130) = ( -0.1829268 -0.0000000 0.1829268), wk = 0.0037594 k( 131) = ( -0.1951219 -0.0000000 0.1951219), wk = 0.0037594 k( 132) = ( -0.2073171 -0.0000000 0.2073171), wk = 0.0037594 k( 133) = ( -0.2195122 -0.0000000 0.2195122), wk = 0.0037594 k( 134) = ( -0.2317073 -0.0000000 0.2317073), wk = 0.0037594 k( 135) = ( -0.2439024 -0.0000000 0.2439024), wk = 0.0037594 k( 136) = ( -0.2560976 -0.0000000 0.2560976), wk = 0.0037594 k( 137) = ( -0.2682927 -0.0000000 0.2682927), wk = 0.0037594 k( 138) = ( -0.2804878 -0.0000000 0.2804878), wk = 0.0037594 k( 139) = ( -0.2926829 -0.0000000 0.2926829), wk = 0.0037594 k( 140) = ( -0.3048781 -0.0000000 0.3048781), wk = 0.0037594 k( 141) = ( -0.3170732 -0.0000000 0.3170732), wk = 0.0037594 k( 142) = ( -0.3292683 -0.0000000 0.3292683), wk = 0.0037594 k( 143) = ( -0.3414634 -0.0000000 0.3414634), wk = 0.0037594 k( 144) = ( -0.3536585 -0.0000000 0.3536585), wk = 0.0037594 k( 145) = ( -0.3658537 -0.0000000 0.3658537), wk = 0.0037594 k( 146) = ( -0.3780488 -0.0000000 0.3780488), wk = 0.0037594 k( 147) = ( -0.3902439 -0.0000000 0.3902439), wk = 0.0037594 k( 148) = ( -0.4024390 -0.0000000 0.4024390), wk = 0.0037594 k( 149) = ( -0.4146341 -0.0000000 0.4146341), wk = 0.0037594 k( 150) = ( -0.4268293 -0.0000000 0.4268293), wk = 0.0037594 k( 151) = ( -0.4390244 -0.0000000 0.4390244), wk = 0.0037594 k( 152) = ( -0.4512195 -0.0000000 0.4512195), wk = 0.0037594 k( 153) = ( -0.4634146 -0.0000000 0.4634146), wk = 0.0037594 k( 154) = ( -0.4756098 -0.0000000 0.4756098), wk = 0.0037594 k( 155) = ( -0.4878049 -0.0000000 0.4878049), wk = 0.0037594 k( 156) = ( -0.5000000 -0.0000000 0.5000000), wk = 0.0037594 k( 157) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0037594 k( 158) = ( -0.4912281 -0.4912281 0.4912281), wk = 0.0037594 k( 159) = ( -0.4824561 -0.4824561 0.4824561), wk = 0.0037594 k( 160) = ( -0.4736842 -0.4736842 0.4736842), wk = 0.0037594 k( 161) = ( -0.4649123 -0.4649123 0.4649123), wk = 0.0037594 k( 162) = ( -0.4561404 -0.4561404 0.4561404), wk = 0.0037594 k( 163) = ( -0.4473684 -0.4473684 0.4473684), wk = 0.0037594 k( 164) = ( -0.4385965 -0.4385965 0.4385965), wk = 0.0037594 k( 165) = ( -0.4298246 -0.4298246 0.4298246), wk = 0.0037594 k( 166) = ( -0.4210526 -0.4210526 0.4210526), wk = 0.0037594 k( 167) = ( -0.4122807 -0.4122807 0.4122807), wk = 0.0037594 k( 168) = ( -0.4035088 -0.4035088 0.4035088), wk = 0.0037594 k( 169) = ( -0.3947368 -0.3947368 0.3947368), wk = 0.0037594 k( 170) = ( -0.3859649 -0.3859649 0.3859649), wk = 0.0037594 k( 171) = ( -0.3771930 -0.3771930 0.3771930), wk = 0.0037594 k( 172) = ( -0.3684211 -0.3684211 0.3684211), wk = 0.0037594 k( 173) = ( -0.3596491 -0.3596491 0.3596491), wk = 0.0037594 k( 174) = ( -0.3508772 -0.3508772 0.3508772), wk = 0.0037594 k( 175) = ( -0.3421053 -0.3421053 0.3421053), wk = 0.0037594 k( 176) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0037594 k( 177) = ( -0.3245614 -0.3245614 0.3245614), wk = 0.0037594 k( 178) = ( -0.3157895 -0.3157895 0.3157895), wk = 0.0037594 k( 179) = ( -0.3070175 -0.3070175 0.3070175), wk = 0.0037594 k( 180) = ( -0.2982456 -0.2982456 0.2982456), wk = 0.0037594 k( 181) = ( -0.2894737 -0.2894737 0.2894737), wk = 0.0037594 k( 182) = ( -0.2807018 -0.2807018 0.2807018), wk = 0.0037594 k( 183) = ( -0.2719298 -0.2719298 0.2719298), wk = 0.0037594 k( 184) = ( -0.2631579 -0.2631579 0.2631579), wk = 0.0037594 k( 185) = ( -0.2543860 -0.2543860 0.2543860), wk = 0.0037594 k( 186) = ( -0.2456140 -0.2456140 0.2456140), wk = 0.0037594 k( 187) = ( -0.2368421 -0.2368421 0.2368421), wk = 0.0037594 k( 188) = ( -0.2280702 -0.2280702 0.2280702), wk = 0.0037594 k( 189) = ( -0.2192983 -0.2192983 0.2192983), wk = 0.0037594 k( 190) = ( -0.2105263 -0.2105263 0.2105263), wk = 0.0037594 k( 191) = ( -0.2017544 -0.2017544 0.2017544), wk = 0.0037594 k( 192) = ( -0.1929825 -0.1929825 0.1929825), wk = 0.0037594 k( 193) = ( -0.1842105 -0.1842105 0.1842105), wk = 0.0037594 k( 194) = ( -0.1754386 -0.1754386 0.1754386), wk = 0.0037594 k( 195) = ( -0.1666667 -0.1666667 0.1666667), wk = 0.0037594 k( 196) = ( -0.1578947 -0.1578947 0.1578947), wk = 0.0037594 k( 197) = ( -0.1491228 -0.1491228 0.1491228), wk = 0.0037594 k( 198) = ( -0.1403509 -0.1403509 0.1403509), wk = 0.0037594 k( 199) = ( -0.1315790 -0.1315790 0.1315790), wk = 0.0037594 k( 200) = ( -0.1228070 -0.1228070 0.1228070), wk = 0.0037594 k( 201) = ( -0.1140351 -0.1140351 0.1140351), wk = 0.0037594 k( 202) = ( -0.1052632 -0.1052632 0.1052632), wk = 0.0037594 k( 203) = ( -0.0964912 -0.0964912 0.0964912), wk = 0.0037594 k( 204) = ( -0.0877193 -0.0877193 0.0877193), wk = 0.0037594 k( 205) = ( -0.0789474 -0.0789474 0.0789474), wk = 0.0037594 k( 206) = ( -0.0701754 -0.0701754 0.0701754), wk = 0.0037594 k( 207) = ( -0.0614035 -0.0614035 0.0614035), wk = 0.0037594 k( 208) = ( -0.0526316 -0.0526316 0.0526316), wk = 0.0037594 k( 209) = ( -0.0438597 -0.0438597 0.0438597), wk = 0.0037594 k( 210) = ( -0.0350877 -0.0350877 0.0350877), wk = 0.0037594 k( 211) = ( -0.0263158 -0.0263158 0.0263158), wk = 0.0037594 k( 212) = ( -0.0175439 -0.0175439 0.0175439), wk = 0.0037594 k( 213) = ( -0.0087719 -0.0087719 0.0087719), wk = 0.0037594 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 k( 216) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0037594 k( 217) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0037594 k( 218) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0037594 k( 219) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0037594 k( 220) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0037594 k( 221) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0037594 k( 222) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0037594 k( 223) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0037594 k( 224) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0037594 k( 225) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0037594 k( 226) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0037594 k( 227) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0037594 k( 228) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0037594 k( 229) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0037594 k( 230) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0037594 k( 231) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0037594 k( 232) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0037594 k( 233) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0037594 k( 234) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037594 k( 235) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0037594 k( 236) = ( 0.0000000 -0.4838710 0.4838710), wk = 0.0037594 k( 237) = ( 0.0000000 -0.4677419 0.4677419), wk = 0.0037594 k( 238) = ( 0.0000000 -0.4516129 0.4516129), wk = 0.0037594 k( 239) = ( 0.0000000 -0.4354839 0.4354839), wk = 0.0037594 k( 240) = ( 0.0000000 -0.4193548 0.4193548), wk = 0.0037594 k( 241) = ( 0.0000000 -0.4032258 0.4032258), wk = 0.0037594 k( 242) = ( 0.0000000 -0.3870968 0.3870968), wk = 0.0037594 k( 243) = ( 0.0000000 -0.3709677 0.3709677), wk = 0.0037594 k( 244) = ( 0.0000000 -0.3548387 0.3548387), wk = 0.0037594 k( 245) = ( 0.0000000 -0.3387097 0.3387097), wk = 0.0037594 k( 246) = ( 0.0000000 -0.3225807 0.3225806), wk = 0.0037594 k( 247) = ( 0.0000000 -0.3064516 0.3064516), wk = 0.0037594 k( 248) = ( 0.0000000 -0.2903226 0.2903226), wk = 0.0037594 k( 249) = ( 0.0000000 -0.2741936 0.2741936), wk = 0.0037594 k( 250) = ( 0.0000000 -0.2580645 0.2580645), wk = 0.0037594 k( 251) = ( 0.0000000 -0.2419355 0.2419355), wk = 0.0037594 k( 252) = ( 0.0000000 -0.2258064 0.2258064), wk = 0.0037594 k( 253) = ( 0.0000000 -0.2096774 0.2096774), wk = 0.0037594 k( 254) = ( 0.0000000 -0.1935484 0.1935484), wk = 0.0037594 k( 255) = ( 0.0000000 -0.1774194 0.1774194), wk = 0.0037594 k( 256) = ( 0.0000000 -0.1612903 0.1612903), wk = 0.0037594 k( 257) = ( 0.0000000 -0.1451613 0.1451613), wk = 0.0037594 k( 258) = ( 0.0000000 -0.1290323 0.1290323), wk = 0.0037594 k( 259) = ( 0.0000000 -0.1129032 0.1129032), wk = 0.0037594 k( 260) = ( 0.0000000 -0.0967742 0.0967742), wk = 0.0037594 k( 261) = ( 0.0000000 -0.0806452 0.0806452), wk = 0.0037594 k( 262) = ( 0.0000000 -0.0645161 0.0645161), wk = 0.0037594 k( 263) = ( 0.0000000 -0.0483871 0.0483871), wk = 0.0037594 k( 264) = ( 0.0000000 -0.0322581 0.0322581), wk = 0.0037594 k( 265) = ( 0.0000000 -0.0161290 0.0161290), wk = 0.0037594 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037594 Dense grid: 133387 G-vectors FFT dimensions: ( 48, 64, 100) Smooth grid: 130359 G-vectors FFT dimensions: ( 48, 64, 100) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.82 Mb ( 930, 58) NL pseudopotentials 1.06 Mb ( 465, 150) Each V/rho on FFT grid 0.14 Mb ( 9216) Each G-vector array 0.03 Mb ( 3708) G-vector shells 0.03 Mb ( 3619) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.29 Mb ( 930, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.27 Mb ( 150, 2, 58) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./CrxB3H8x2.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 4.5 secs Computing kpt #: 3 total cpu time spent up to now is 5.4 secs Computing kpt #: 4 total cpu time spent up to now is 6.3 secs Computing kpt #: 5 total cpu time spent up to now is 7.2 secs Computing kpt #: 6 total cpu time spent up to now is 8.0 secs Computing kpt #: 7 total cpu time spent up to now is 8.9 secs Computing kpt #: 8 total cpu time spent up to now is 9.8 secs Computing kpt #: 9 total cpu time spent up to now is 10.7 secs Computing kpt #: 10 total cpu time spent up to now is 11.6 secs Computing kpt #: 11 total cpu time spent up to now is 12.4 secs Computing kpt #: 12 total cpu time spent up to now is 13.4 secs Computing kpt #: 13 total cpu time spent up to now is 14.2 secs Computing kpt #: 14 total cpu time spent up to now is 15.1 secs Computing kpt #: 15 total cpu time spent up to now is 16.0 secs Computing kpt #: 16 total cpu time spent up to now is 16.9 secs Computing kpt #: 17 total cpu time spent up to now is 17.8 secs Computing kpt #: 18 total cpu time spent up to now is 18.6 secs Computing kpt #: 19 total cpu time spent up to now is 19.5 secs Computing kpt #: 20 total cpu time spent up to now is 20.4 secs Computing kpt #: 21 total cpu time spent up to now is 21.3 secs Computing kpt #: 22 total cpu time spent up to now is 22.3 secs Computing kpt #: 23 total cpu time spent up to now is 23.2 secs Computing kpt #: 24 total cpu time spent up to now is 24.0 secs Computing kpt #: 25 total cpu time spent up to now is 24.9 secs Computing kpt #: 26 total cpu time spent up to now is 25.8 secs Computing kpt #: 27 total cpu time spent up to now is 26.6 secs Computing kpt #: 28 total cpu time spent up to now is 27.8 secs Computing kpt #: 29 total cpu time spent up to now is 28.6 secs Computing kpt #: 30 total cpu time spent up to now is 29.5 secs Computing kpt #: 31 total cpu time spent up to now is 30.4 secs Computing kpt #: 32 total cpu time spent up to now is 31.2 secs Computing kpt #: 33 total cpu time spent up to now is 32.1 secs Computing kpt #: 34 total cpu time spent up to now is 33.0 secs Computing kpt #: 35 total cpu time spent up to now is 33.9 secs Computing kpt #: 36 total cpu time spent up to now is 34.8 secs Computing kpt #: 37 total cpu time spent up to now is 35.6 secs Computing kpt #: 38 total cpu time spent up to now is 36.5 secs Computing kpt #: 39 total cpu time spent up to now is 37.4 secs Computing kpt #: 40 total cpu time spent up to now is 38.2 secs Computing kpt #: 41 total cpu time spent up to now is 39.7 secs Computing kpt #: 42 total cpu time spent up to now is 40.6 secs Computing kpt #: 43 total cpu time spent up to now is 41.4 secs Computing kpt #: 44 total cpu time spent up to now is 42.3 secs Computing kpt #: 45 total cpu time spent up to now is 43.2 secs Computing kpt #: 46 total cpu time spent up to now is 44.1 secs Computing kpt #: 47 total cpu time spent up to now is 45.0 secs Computing kpt #: 48 total cpu time spent up to now is 45.9 secs Computing kpt #: 49 total cpu time spent up to now is 46.8 secs Computing kpt #: 50 total cpu time spent up to now is 47.7 secs Computing kpt #: 51 total cpu time spent up to now is 48.6 secs Computing kpt #: 52 total cpu time spent up to now is 49.5 secs Computing kpt #: 53 total cpu time spent up to now is 50.4 secs Computing kpt #: 54 total cpu time spent up to now is 51.3 secs Computing kpt #: 55 total cpu time spent up to now is 52.2 secs Computing kpt #: 56 total cpu time spent up to now is 53.1 secs Computing kpt #: 57 total cpu time spent up to now is 54.0 secs Computing kpt #: 58 total cpu time spent up to now is 54.9 secs Computing kpt #: 59 total cpu time spent up to now is 55.8 secs Computing kpt #: 60 total cpu time spent up to now is 56.7 secs Computing kpt #: 61 total cpu time spent up to now is 57.6 secs Computing kpt #: 62 total cpu time spent up to now is 58.5 secs Computing kpt #: 63 total cpu time spent up to now is 59.4 secs Computing kpt #: 64 total cpu time spent up to now is 60.3 secs Computing kpt #: 65 total cpu time spent up to now is 61.2 secs Computing kpt #: 66 total cpu time spent up to now is 62.1 secs Computing kpt #: 67 total cpu time spent up to now is 63.0 secs Computing kpt #: 68 total cpu time spent up to now is 63.9 secs Computing kpt #: 69 total cpu time spent up to now is 64.8 secs Computing kpt #: 70 total cpu time spent up to now is 65.7 secs Computing kpt #: 71 total cpu time spent up to now is 66.6 secs Computing kpt #: 72 total cpu time spent up to now is 67.5 secs Computing kpt #: 73 total cpu time spent up to now is 68.4 secs Computing kpt #: 74 total cpu time spent up to now is 69.2 secs Computing kpt #: 75 total cpu time spent up to now is 70.0 secs Computing kpt #: 76 total cpu time spent up to now is 70.9 secs Computing kpt #: 77 total cpu time spent up to now is 71.8 secs Computing kpt #: 78 total cpu time spent up to now is 72.6 secs Computing kpt #: 79 total cpu time spent up to now is 74.5 secs Computing kpt #: 80 total cpu time spent up to now is 75.4 secs Computing kpt #: 81 total cpu time spent up to now is 76.3 secs Computing kpt #: 82 total cpu time spent up to now is 77.2 secs Computing kpt #: 83 total cpu time spent up to now is 78.1 secs Computing kpt #: 84 total cpu time spent up to now is 79.0 secs Computing kpt #: 85 total cpu time spent up to now is 79.9 secs Computing kpt #: 86 total cpu time spent up to now is 80.8 secs Computing kpt #: 87 total cpu time spent up to now is 81.7 secs Computing kpt #: 88 total cpu time spent up to now is 82.6 secs Computing kpt #: 89 total cpu time spent up to now is 83.5 secs Computing kpt #: 90 total cpu time spent up to now is 84.4 secs Computing kpt #: 91 total cpu time spent up to now is 85.3 secs Computing kpt #: 92 total cpu time spent up to now is 86.2 secs Computing kpt #: 93 total cpu time spent up to now is 87.1 secs Computing kpt #: 94 total cpu time spent up to now is 88.0 secs Computing kpt #: 95 total cpu time spent up to now is 88.9 secs Computing kpt #: 96 total cpu time spent up to now is 89.9 secs Computing kpt #: 97 total cpu time spent up to now is 90.9 secs Computing kpt #: 98 total cpu time spent up to now is 91.7 secs Computing kpt #: 99 total cpu time spent up to now is 92.6 secs Computing kpt #: 100 total cpu time spent up to now is 93.5 secs Computing kpt #: 101 total cpu time spent up to now is 94.4 secs Computing kpt #: 102 total cpu time spent up to now is 95.3 secs Computing kpt #: 103 total cpu time spent up to now is 96.2 secs Computing kpt #: 104 total cpu time spent up to now is 97.1 secs Computing kpt #: 105 total cpu time spent up to now is 97.9 secs Computing kpt #: 106 total cpu time spent up to now is 98.8 secs Computing kpt #: 107 total cpu time spent up to now is 99.7 secs Computing kpt #: 108 total cpu time spent up to now is 100.6 secs Computing kpt #: 109 total cpu time spent up to now is 101.5 secs Computing kpt #: 110 total cpu time spent up to now is 102.3 secs Computing kpt #: 111 total cpu time spent up to now is 103.2 secs Computing kpt #: 112 total cpu time spent up to now is 104.1 secs Computing kpt #: 113 total cpu time spent up to now is 105.0 secs Computing kpt #: 114 total cpu time spent up to now is 105.8 secs Computing kpt #: 115 total cpu time spent up to now is 106.7 secs Computing kpt #: 116 total cpu time spent up to now is 107.6 secs Computing kpt #: 117 total cpu time spent up to now is 108.4 secs Computing kpt #: 118 total cpu time spent up to now is 110.6 secs Computing kpt #: 119 total cpu time spent up to now is 111.4 secs Computing kpt #: 120 total cpu time spent up to now is 112.3 secs Computing kpt #: 121 total cpu time spent up to now is 113.2 secs Computing kpt #: 122 total cpu time spent up to now is 114.1 secs Computing kpt #: 123 total cpu time spent up to now is 115.0 secs Computing kpt #: 124 total cpu time spent up to now is 115.8 secs Computing kpt #: 125 total cpu time spent up to now is 116.7 secs Computing kpt #: 126 total cpu time spent up to now is 117.6 secs Computing kpt #: 127 total cpu time spent up to now is 118.5 secs Computing kpt #: 128 total cpu time spent up to now is 119.4 secs Computing kpt #: 129 total cpu time spent up to now is 120.3 secs Computing kpt #: 130 total cpu time spent up to now is 121.2 secs Computing kpt #: 131 total cpu time spent up to now is 122.1 secs Computing kpt #: 132 total cpu time spent up to now is 123.0 secs Computing kpt #: 133 total cpu time spent up to now is 123.9 secs Computing kpt #: 134 total cpu time spent up to now is 124.9 secs Computing kpt #: 135 total cpu time spent up to now is 125.7 secs Computing kpt #: 136 total cpu time spent up to now is 126.7 secs Computing kpt #: 137 total cpu time spent up to now is 127.5 secs Computing kpt #: 138 total cpu time spent up to now is 128.5 secs Computing kpt #: 139 total cpu time spent up to now is 129.3 secs Computing kpt #: 140 total cpu time spent up to now is 130.2 secs Computing kpt #: 141 total cpu time spent up to now is 131.1 secs Computing kpt #: 142 total cpu time spent up to now is 132.0 secs Computing kpt #: 143 total cpu time spent up to now is 132.9 secs Computing kpt #: 144 total cpu time spent up to now is 133.8 secs Computing kpt #: 145 total cpu time spent up to now is 134.6 secs Computing kpt #: 146 total cpu time spent up to now is 135.5 secs Computing kpt #: 147 total cpu time spent up to now is 136.4 secs Computing kpt #: 148 total cpu time spent up to now is 137.3 secs Computing kpt #: 149 total cpu time spent up to now is 138.1 secs Computing kpt #: 150 total cpu time spent up to now is 139.0 secs Computing kpt #: 151 total cpu time spent up to now is 139.8 secs Computing kpt #: 152 total cpu time spent up to now is 140.7 secs Computing kpt #: 153 total cpu time spent up to now is 141.5 secs Computing kpt #: 154 total cpu time spent up to now is 142.4 secs Computing kpt #: 155 total cpu time spent up to now is 143.3 secs Computing kpt #: 156 total cpu time spent up to now is 145.3 secs Computing kpt #: 157 total cpu time spent up to now is 146.1 secs Computing kpt #: 158 total cpu time spent up to now is 147.0 secs Computing kpt #: 159 total cpu time spent up to now is 147.9 secs Computing kpt #: 160 total cpu time spent up to now is 148.8 secs Computing kpt #: 161 total cpu time spent up to now is 149.8 secs Computing kpt #: 162 total cpu time spent up to now is 150.7 secs Computing kpt #: 163 total cpu time spent up to now is 151.6 secs Computing kpt #: 164 total cpu time spent up to now is 152.5 secs Computing kpt #: 165 total cpu time spent up to now is 153.4 secs Computing kpt #: 166 total cpu time spent up to now is 154.3 secs Computing kpt #: 167 total cpu time spent up to now is 155.1 secs Computing kpt #: 168 total cpu time spent up to now is 156.0 secs Computing kpt #: 169 total cpu time spent up to now is 156.9 secs Computing kpt #: 170 total cpu time spent up to now is 157.8 secs Computing kpt #: 171 total cpu time spent up to now is 158.7 secs Computing kpt #: 172 total cpu time spent up to now is 159.6 secs Computing kpt #: 173 total cpu time spent up to now is 160.5 secs Computing kpt #: 174 total cpu time spent up to now is 161.4 secs Computing kpt #: 175 total cpu time spent up to now is 162.3 secs Computing kpt #: 176 total cpu time spent up to now is 163.2 secs Computing kpt #: 177 total cpu time spent up to now is 164.1 secs Computing kpt #: 178 total cpu time spent up to now is 165.0 secs Computing kpt #: 179 total cpu time spent up to now is 165.9 secs Computing kpt #: 180 total cpu time spent up to now is 166.8 secs Computing kpt #: 181 total cpu time spent up to now is 167.7 secs Computing kpt #: 182 total cpu time spent up to now is 168.5 secs Computing kpt #: 183 total cpu time spent up to now is 169.4 secs Computing kpt #: 184 total cpu time spent up to now is 170.3 secs Computing kpt #: 185 total cpu time spent up to now is 171.2 secs Computing kpt #: 186 total cpu time spent up to now is 172.1 secs Computing kpt #: 187 total cpu time spent up to now is 173.0 secs Computing kpt #: 188 total cpu time spent up to now is 173.9 secs Computing kpt #: 189 total cpu time spent up to now is 174.7 secs Computing kpt #: 190 total cpu time spent up to now is 175.6 secs Computing kpt #: 191 total cpu time spent up to now is 176.5 secs Computing kpt #: 192 total cpu time spent up to now is 177.4 secs Computing kpt #: 193 total cpu time spent up to now is 178.3 secs Computing kpt #: 194 total cpu time spent up to now is 179.7 secs Computing kpt #: 195 total cpu time spent up to now is 180.6 secs Computing kpt #: 196 total cpu time spent up to now is 181.5 secs Computing kpt #: 197 total cpu time spent up to now is 182.4 secs Computing kpt #: 198 total cpu time spent up to now is 183.3 secs Computing kpt #: 199 total cpu time spent up to now is 184.2 secs Computing kpt #: 200 total cpu time spent up to now is 185.1 secs Computing kpt #: 201 total cpu time spent up to now is 186.0 secs Computing kpt #: 202 total cpu time spent up to now is 186.9 secs Computing kpt #: 203 total cpu time spent up to now is 187.7 secs Computing kpt #: 204 total cpu time spent up to now is 188.6 secs Computing kpt #: 205 total cpu time spent up to now is 189.5 secs Computing kpt #: 206 total cpu time spent up to now is 190.4 secs Computing kpt #: 207 total cpu time spent up to now is 191.3 secs Computing kpt #: 208 total cpu time spent up to now is 192.2 secs Computing kpt #: 209 total cpu time spent up to now is 193.1 secs Computing kpt #: 210 total cpu time spent up to now is 193.9 secs Computing kpt #: 211 total cpu time spent up to now is 194.8 secs Computing kpt #: 212 total cpu time spent up to now is 195.6 secs Computing kpt #: 213 total cpu time spent up to now is 196.5 secs Computing kpt #: 214 total cpu time spent up to now is 197.3 secs Computing kpt #: 215 total cpu time spent up to now is 198.2 secs Computing kpt #: 216 total cpu time spent up to now is 199.1 secs Computing kpt #: 217 total cpu time spent up to now is 199.9 secs Computing kpt #: 218 total cpu time spent up to now is 200.9 secs Computing kpt #: 219 total cpu time spent up to now is 201.7 secs Computing kpt #: 220 total cpu time spent up to now is 202.6 secs Computing kpt #: 221 total cpu time spent up to now is 203.5 secs Computing kpt #: 222 total cpu time spent up to now is 204.3 secs Computing kpt #: 223 total cpu time spent up to now is 205.2 secs Computing kpt #: 224 total cpu time spent up to now is 206.1 secs Computing kpt #: 225 total cpu time spent up to now is 206.9 secs Computing kpt #: 226 total cpu time spent up to now is 207.7 secs Computing kpt #: 227 total cpu time spent up to now is 208.6 secs Computing kpt #: 228 total cpu time spent up to now is 209.5 secs Computing kpt #: 229 total cpu time spent up to now is 210.3 secs Computing kpt #: 230 total cpu time spent up to now is 211.2 secs Computing kpt #: 231 total cpu time spent up to now is 212.0 secs Computing kpt #: 232 total cpu time spent up to now is 212.9 secs Computing kpt #: 233 total cpu time spent up to now is 215.0 secs Computing kpt #: 234 total cpu time spent up to now is 215.8 secs Computing kpt #: 235 total cpu time spent up to now is 216.7 secs Computing kpt #: 236 total cpu time spent up to now is 217.5 secs Computing kpt #: 237 total cpu time spent up to now is 218.4 secs Computing kpt #: 238 total cpu time spent up to now is 219.4 secs Computing kpt #: 239 total cpu time spent up to now is 220.6 secs Computing kpt #: 240 total cpu time spent up to now is 221.7 secs Computing kpt #: 241 total cpu time spent up to now is 222.5 secs Computing kpt #: 242 total cpu time spent up to now is 223.4 secs Computing kpt #: 243 total cpu time spent up to now is 224.3 secs Computing kpt #: 244 total cpu time spent up to now is 225.1 secs Computing kpt #: 245 total cpu time spent up to now is 226.0 secs Computing kpt #: 246 total cpu time spent up to now is 226.9 secs Computing kpt #: 247 total cpu time spent up to now is 227.7 secs Computing kpt #: 248 total cpu time spent up to now is 228.5 secs Computing kpt #: 249 total cpu time spent up to now is 229.4 secs Computing kpt #: 250 total cpu time spent up to now is 230.3 secs Computing kpt #: 251 total cpu time spent up to now is 231.1 secs Computing kpt #: 252 total cpu time spent up to now is 232.0 secs Computing kpt #: 253 total cpu time spent up to now is 232.9 secs Computing kpt #: 254 total cpu time spent up to now is 233.7 secs Computing kpt #: 255 total cpu time spent up to now is 234.5 secs Computing kpt #: 256 total cpu time spent up to now is 235.4 secs Computing kpt #: 257 total cpu time spent up to now is 236.3 secs Computing kpt #: 258 total cpu time spent up to now is 237.2 secs Computing kpt #: 259 total cpu time spent up to now is 238.0 secs Computing kpt #: 260 total cpu time spent up to now is 238.9 secs Computing kpt #: 261 total cpu time spent up to now is 239.7 secs Computing kpt #: 262 total cpu time spent up to now is 240.6 secs Computing kpt #: 263 total cpu time spent up to now is 241.5 secs Computing kpt #: 264 total cpu time spent up to now is 242.3 secs Computing kpt #: 265 total cpu time spent up to now is 243.2 secs Computing kpt #: 266 total cpu time spent up to now is 244.1 secs ethr = 2.08E-08, avg # of iterations = 13.2 total cpu time spent up to now is 244.1 secs End of band structure calculation k = 0.0000-0.4132-0.1334 ( 16268 PWs) bands (ev): -70.4467 -70.4467 -42.5420 -42.5420 -41.6226 -41.6226 -41.4604 -41.4604 -11.3032 -11.3032 -11.1589 -11.1589 -9.0294 -9.0294 -8.6976 -8.6976 -6.0936 -6.0936 -5.8391 -5.8391 -5.3369 -5.3369 -5.0403 -5.0403 -4.7740 -4.7740 -4.2150 -4.2150 -3.2284 -3.2284 -2.6681 -2.6681 -2.3282 -2.3282 -1.7369 -1.7369 -1.2896 -1.2896 -0.7185 -0.7185 -0.2771 -0.2771 -0.1122 -0.1122 0.4041 0.4041 0.6518 0.6518 0.6944 0.6944 1.0322 1.0322 2.4232 2.4232 2.6648 2.6648 2.9932 2.9932 k = 0.0000-0.4003-0.1292 ( 16270 PWs) bands (ev): -70.4468 -70.4468 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3037 -11.3037 -11.1588 -11.1588 -9.0287 -9.0287 -8.6969 -8.6969 -6.0979 -6.0979 -5.8348 -5.8348 -5.3371 -5.3371 -5.0401 -5.0401 -4.7738 -4.7738 -4.2147 -4.2147 -3.2286 -3.2286 -2.6691 -2.6691 -2.3285 -2.3285 -1.7365 -1.7365 -1.2898 -1.2898 -0.7195 -0.7195 -0.2778 -0.2778 -0.1139 -0.1139 0.4049 0.4049 0.6520 0.6520 0.6949 0.6949 1.0325 1.0325 2.4233 2.4233 2.6654 2.6654 2.9927 2.9927 k = 0.0000-0.3874-0.1250 ( 16279 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3054 -11.3054 -11.1588 -11.1588 -9.0265 -9.0265 -8.6947 -8.6947 -6.1101 -6.1101 -5.8226 -5.8226 -5.3379 -5.3379 -5.0394 -5.0394 -4.7734 -4.7734 -4.2140 -4.2140 -3.2294 -3.2294 -2.6723 -2.6723 -2.3295 -2.3295 -1.7353 -1.7353 -1.2903 -1.2903 -0.7224 -0.7224 -0.2803 -0.2803 -0.1190 -0.1190 0.4081 0.4081 0.6525 0.6525 0.6965 0.6965 1.0327 1.0327 2.4224 2.4224 2.6673 2.6673 2.9913 2.9913 k = 0.0000-0.3744-0.1209 ( 16279 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3082 -11.3082 -11.1589 -11.1589 -9.0229 -9.0229 -8.6910 -8.6910 -6.1281 -6.1281 -5.8045 -5.8045 -5.3393 -5.3393 -5.0382 -5.0382 -4.7726 -4.7726 -4.2128 -4.2128 -3.2308 -3.2308 -2.6774 -2.6774 -2.3312 -2.3312 -1.7335 -1.7335 -1.2911 -1.2911 -0.7272 -0.7272 -0.2847 -0.2847 -0.1265 -0.1265 0.4129 0.4129 0.6540 0.6540 0.7004 0.7004 1.0339 1.0339 2.4214 2.4214 2.6703 2.6703 2.9889 2.9889 k = 0.0000-0.3615-0.1167 ( 16279 PWs) bands (ev): -70.4470 -70.4470 -42.5420 -42.5420 -41.6227 -41.6227 -41.4605 -41.4605 -11.3119 -11.3119 -11.1589 -11.1589 -9.0178 -9.0178 -8.6860 -8.6860 -6.1500 -6.1500 -5.7825 -5.7825 -5.3411 -5.3411 -5.0367 -5.0367 -4.7714 -4.7714 -4.2111 -4.2111 -3.2326 -3.2326 -2.6844 -2.6844 -2.3334 -2.3334 -1.7310 -1.7310 -1.2923 -1.2923 -0.7337 -0.7337 -0.2916 -0.2916 -0.1352 -0.1352 0.4193 0.4193 0.6554 0.6554 0.7059 0.7059 1.0353 1.0353 2.4204 2.4204 2.6744 2.6744 2.9855 2.9855 k = 0.0000-0.3486-0.1125 ( 16275 PWs) bands (ev): -70.4469 -70.4469 -42.5420 -42.5420 -41.6227 -41.6227 -41.4605 -41.4605 -11.3166 -11.3166 -11.1591 -11.1591 -9.0114 -9.0114 -8.6795 -8.6795 -6.1744 -6.1744 -5.7581 -5.7581 -5.3433 -5.3433 -5.0349 -5.0349 -4.7699 -4.7699 -4.2090 -4.2090 -3.2349 -3.2349 -2.6932 -2.6932 -2.3363 -2.3363 -1.7282 -1.7282 -1.2938 -1.2938 -0.7419 -0.7419 -0.3019 -0.3019 -0.1435 -0.1435 0.4263 0.4263 0.6565 0.6565 0.7138 0.7138 1.0376 1.0376 2.4192 2.4192 2.6793 2.6793 2.9811 2.9811 k = 0.0000-0.3357-0.1084 ( 16280 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3222 -11.3222 -11.1593 -11.1593 -9.0038 -9.0038 -8.6717 -8.6717 -6.2002 -6.2002 -5.7325 -5.7325 -5.3460 -5.3460 -5.0328 -5.0328 -4.7680 -4.7680 -4.2064 -4.2064 -3.2376 -3.2376 -2.7034 -2.7034 -2.3397 -2.3397 -1.7251 -1.7251 -1.2957 -1.2957 -0.7516 -0.7516 -0.3160 -0.3160 -0.1503 -0.1503 0.4334 0.4334 0.6570 0.6570 0.7224 0.7224 1.0398 1.0398 2.4180 2.4180 2.6850 2.6850 2.9757 2.9757 k = 0.0000-0.3228-0.1042 ( 16279 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3285 -11.3285 -11.1598 -11.1598 -8.9949 -8.9949 -8.6627 -8.6627 -6.2266 -6.2266 -5.7063 -5.7063 -5.3490 -5.3490 -5.0306 -5.0306 -4.7656 -4.7656 -4.2034 -4.2034 -3.2409 -3.2409 -2.7149 -2.7149 -2.3437 -2.3437 -1.7219 -1.7219 -1.2979 -1.2979 -0.7625 -0.7625 -0.3340 -0.3340 -0.1546 -0.1546 0.4408 0.4408 0.6571 0.6571 0.7331 0.7331 1.0429 1.0429 2.4164 2.4164 2.6911 2.6911 2.9692 2.9692 k = 0.0000-0.3099-0.1000 ( 16282 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3354 -11.3354 -11.1603 -11.1603 -8.9850 -8.9850 -8.6525 -8.6525 -6.2532 -6.2532 -5.6801 -5.6801 -5.3522 -5.3522 -5.0283 -5.0283 -4.7628 -4.7628 -4.1999 -4.1999 -3.2447 -3.2447 -2.7275 -2.7275 -2.3483 -2.3483 -1.7187 -1.7187 -1.3006 -1.3006 -0.7746 -0.7746 -0.3555 -0.3555 -0.1562 -0.1562 0.4475 0.4475 0.6564 0.6564 0.7451 0.7451 1.0463 1.0463 2.4146 2.4146 2.6974 2.6974 2.9616 2.9616 k = 0.0000-0.2970-0.0959 ( 16282 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3428 -11.3428 -11.1611 -11.1611 -8.9740 -8.9740 -8.6413 -8.6413 -6.2797 -6.2797 -5.6545 -5.6545 -5.3557 -5.3557 -5.0261 -5.0261 -4.7596 -4.7596 -4.1960 -4.1960 -3.2488 -3.2488 -2.7408 -2.7408 -2.3535 -2.3535 -1.7157 -1.7157 -1.3038 -1.3038 -0.7876 -0.7876 -0.3798 -0.3798 -0.1551 -0.1551 0.4536 0.4536 0.6559 0.6559 0.7581 0.7581 1.0503 1.0503 2.4125 2.4125 2.7038 2.7038 2.9530 2.9530 k = 0.0000-0.2841-0.0917 ( 16284 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3507 -11.3507 -11.1621 -11.1621 -8.9621 -8.9621 -8.6290 -8.6290 -6.3056 -6.3056 -5.6296 -5.6296 -5.3592 -5.3592 -5.0239 -5.0239 -4.7559 -4.7559 -4.1918 -4.1918 -3.2534 -3.2534 -2.7545 -2.7545 -2.3594 -2.3594 -1.7129 -1.7129 -1.3074 -1.3074 -0.8014 -0.8014 -0.4059 -0.4059 -0.1519 -0.1519 0.4591 0.4591 0.6548 0.6548 0.7708 0.7708 1.0552 1.0552 2.4103 2.4103 2.7100 2.7100 2.9433 2.9433 k = 0.0000-0.2712-0.0875 ( 16289 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3590 -11.3590 -11.1632 -11.1632 -8.9495 -8.9495 -8.6159 -8.6159 -6.3310 -6.3310 -5.6058 -5.6058 -5.3628 -5.3628 -5.0218 -5.0218 -4.7518 -4.7518 -4.1872 -4.1872 -3.2584 -3.2584 -2.7684 -2.7684 -2.3660 -2.3660 -1.7103 -1.7103 -1.3116 -1.3116 -0.8156 -0.8156 -0.4333 -0.4333 -0.1467 -0.1467 0.4641 0.4641 0.6535 0.6535 0.7837 0.7837 1.0600 1.0600 2.4078 2.4078 2.7158 2.7158 2.9326 2.9326 k = 0.0000-0.2582-0.0834 ( 16286 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3674 -11.3674 -11.1646 -11.1646 -8.9362 -8.9362 -8.6020 -8.6020 -6.3555 -6.3555 -5.5834 -5.5834 -5.3664 -5.3664 -5.0198 -5.0198 -4.7473 -4.7473 -4.1822 -4.1822 -3.2638 -3.2638 -2.7821 -2.7821 -2.3735 -2.3735 -1.7080 -1.7080 -1.3162 -1.3162 -0.8302 -0.8302 -0.4612 -0.4612 -0.1398 -0.1398 0.4683 0.4683 0.6524 0.6524 0.7969 0.7969 1.0663 1.0663 2.4049 2.4049 2.7210 2.7210 2.9210 2.9210 k = 0.0000-0.2453-0.0792 ( 16289 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3761 -11.3761 -11.1661 -11.1661 -8.9224 -8.9224 -8.5875 -8.5875 -6.3791 -6.3791 -5.5626 -5.5626 -5.3697 -5.3697 -5.0180 -5.0180 -4.7424 -4.7424 -4.1770 -4.1770 -3.2696 -3.2696 -2.7954 -2.7954 -2.3819 -2.3819 -1.7059 -1.7059 -1.3214 -1.3214 -0.8449 -0.8449 -0.4893 -0.4893 -0.1315 -0.1315 0.4718 0.4718 0.6509 0.6509 0.8092 0.8092 1.0728 1.0728 2.4017 2.4017 2.7255 2.7255 2.9085 2.9085 k = 0.0000-0.2324-0.0750 ( 16295 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3848 -11.3848 -11.1678 -11.1678 -8.9082 -8.9082 -8.5725 -8.5725 -6.4017 -6.4017 -5.5435 -5.5435 -5.3729 -5.3729 -5.0162 -5.0162 -4.7374 -4.7374 -4.1715 -4.1715 -3.2757 -3.2757 -2.8080 -2.8080 -2.3913 -2.3913 -1.7039 -1.7039 -1.3272 -1.3272 -0.8595 -0.8595 -0.5171 -0.5171 -0.1221 -0.1221 0.4748 0.4748 0.6490 0.6490 0.8208 0.8208 1.0794 1.0794 2.3982 2.3982 2.7292 2.7292 2.8953 2.8953 k = 0.0000-0.2195-0.0709 ( 16296 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3934 -11.3934 -11.1696 -11.1696 -8.8938 -8.8938 -8.5571 -8.5571 -6.4231 -6.4231 -5.5264 -5.5264 -5.3757 -5.3757 -5.0144 -5.0144 -4.7322 -4.7322 -4.1657 -4.1657 -3.2819 -3.2819 -2.8195 -2.8195 -2.4019 -2.4019 -1.7019 -1.7019 -1.3335 -1.3335 -0.8738 -0.8738 -0.5443 -0.5443 -0.1115 -0.1115 0.4774 0.4774 0.6471 0.6471 0.8318 0.8318 1.0866 1.0866 2.3951 2.3951 2.7319 2.7319 2.8815 2.8815 k = 0.0000-0.2066-0.0667 ( 16298 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.4020 -11.4020 -11.1715 -11.1715 -8.8792 -8.8792 -8.5415 -8.5415 -6.4435 -6.4435 -5.5115 -5.5115 -5.3781 -5.3781 -5.0125 -5.0125 -4.7270 -4.7270 -4.1598 -4.1598 -3.2884 -3.2884 -2.8299 -2.8299 -2.4137 -2.4137 -1.6997 -1.6997 -1.3404 -1.3404 -0.8877 -0.8877 -0.5709 -0.5709 -0.1001 -0.1001 0.4790 0.4790 0.6453 0.6453 0.8419 0.8419 1.0945 1.0945 2.3914 2.3914 2.7337 2.7337 2.8673 2.8673 k = 0.0000-0.1937-0.0625 ( 16297 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4104 -11.4104 -11.1736 -11.1736 -8.8648 -8.8648 -8.5259 -8.5259 -6.4626 -6.4626 -5.4987 -5.4987 -5.3801 -5.3801 -5.0104 -5.0104 -4.7218 -4.7218 -4.1537 -4.1537 -3.2950 -3.2950 -2.8387 -2.8387 -2.4267 -2.4267 -1.6972 -1.6972 -1.3478 -1.3478 -0.9010 -0.9010 -0.5966 -0.5966 -0.0880 -0.0880 0.4803 0.4803 0.6435 0.6435 0.8510 0.8510 1.1026 1.1026 2.3882 2.3882 2.7345 2.7345 2.8528 2.8528 k = 0.0000-0.1808-0.0584 ( 16293 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4186 -11.4186 -11.1756 -11.1756 -8.8505 -8.8505 -8.5103 -8.5103 -6.4804 -6.4804 -5.4881 -5.4881 -5.3816 -5.3816 -5.0080 -5.0080 -4.7170 -4.7170 -4.1476 -4.1476 -3.3017 -3.3017 -2.8459 -2.8459 -2.4411 -2.4411 -1.6943 -1.6943 -1.3556 -1.3556 -0.9135 -0.9135 -0.6214 -0.6214 -0.0753 -0.0753 0.4814 0.4814 0.6419 0.6419 0.8592 0.8592 1.1115 1.1115 2.3846 2.3846 2.7343 2.7343 2.8383 2.8383 k = 0.0000-0.1679-0.0542 ( 16304 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4265 -11.4265 -11.1777 -11.1777 -8.8365 -8.8365 -8.4949 -8.4949 -6.4970 -6.4970 -5.4795 -5.4795 -5.3829 -5.3829 -5.0053 -5.0053 -4.7124 -4.7124 -4.1415 -4.1415 -3.3084 -3.3084 -2.8513 -2.8513 -2.4567 -2.4567 -1.6908 -1.6908 -1.3640 -1.3640 -0.9251 -0.9251 -0.6454 -0.6454 -0.0623 -0.0623 0.4815 0.4815 0.6397 0.6397 0.8656 0.8656 1.1191 1.1191 2.3812 2.3812 2.7333 2.7333 2.8238 2.8238 k = 0.0000-0.1549-0.0500 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4340 -11.4340 -11.1798 -11.1798 -8.8229 -8.8229 -8.4800 -8.4800 -6.5123 -6.5123 -5.4728 -5.4728 -5.3840 -5.3840 -5.0021 -5.0021 -4.7083 -4.7083 -4.1354 -4.1354 -3.3150 -3.3150 -2.8546 -2.8546 -2.4738 -2.4738 -1.6868 -1.6868 -1.3727 -1.3727 -0.9358 -0.9358 -0.6680 -0.6680 -0.0491 -0.0491 0.4819 0.4819 0.6380 0.6380 0.8724 0.8724 1.1271 1.1271 2.3780 2.3780 2.7315 2.7315 2.8097 2.8097 k = 0.0000-0.1420-0.0459 ( 16295 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4411 -11.4411 -11.1818 -11.1818 -8.8100 -8.8100 -8.4655 -8.4655 -6.5263 -6.5263 -5.4676 -5.4676 -5.3852 -5.3852 -4.9985 -4.9985 -4.7047 -4.7047 -4.1294 -4.1294 -3.3215 -3.3215 -2.8559 -2.8559 -2.4920 -2.4920 -1.6821 -1.6821 -1.3817 -1.3817 -0.9454 -0.9454 -0.6896 -0.6896 -0.0360 -0.0360 0.4821 0.4821 0.6365 0.6365 0.8780 0.8780 1.1353 1.1353 2.3747 2.3747 2.7290 2.7290 2.7960 2.7960 k = 0.0000-0.1291-0.0417 ( 16291 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4478 -11.4478 -11.1837 -11.1837 -8.7977 -8.7977 -8.4517 -8.4517 -6.5390 -6.5390 -5.4636 -5.4636 -5.3867 -5.3867 -4.9944 -4.9944 -4.7016 -4.7016 -4.1237 -4.1237 -3.3278 -3.3278 -2.8550 -2.8550 -2.5114 -2.5114 -1.6767 -1.6767 -1.3908 -1.3908 -0.9540 -0.9540 -0.7099 -0.7099 -0.0231 -0.0231 0.4817 0.4817 0.6346 0.6346 0.8836 0.8836 1.1432 1.1432 2.3715 2.3715 2.7259 2.7259 2.7830 2.7830 k = 0.0000-0.1162-0.0375 ( 16296 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4540 -11.4540 -11.1856 -11.1856 -8.7862 -8.7862 -8.4387 -8.4387 -6.5504 -6.5504 -5.4603 -5.4603 -5.3887 -5.3887 -4.9900 -4.9900 -4.6991 -4.6991 -4.1182 -4.1182 -3.3339 -3.3339 -2.8519 -2.8519 -2.5319 -2.5319 -1.6708 -1.6708 -1.4001 -1.4001 -0.9615 -0.9615 -0.7289 -0.7289 -0.0106 -0.0106 0.4806 0.4806 0.6325 0.6325 0.8881 0.8881 1.1504 1.1504 2.3678 2.3678 2.7224 2.7224 2.7708 2.7708 k = 0.0000-0.1033-0.0333 ( 16295 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4596 -11.4596 -11.1873 -11.1873 -8.7757 -8.7757 -8.4267 -8.4267 -6.5605 -6.5605 -5.4574 -5.4574 -5.3913 -5.3913 -4.9853 -4.9853 -4.6972 -4.6972 -4.1130 -4.1130 -3.3396 -3.3396 -2.8466 -2.8466 -2.5532 -2.5532 -1.6644 -1.6644 -1.4092 -1.4092 -0.9680 -0.9680 -0.7465 -0.7465 0.0012 0.0012 0.4803 0.4803 0.6310 0.6310 0.8921 0.8921 1.1569 1.1569 2.3644 2.3644 2.7187 2.7187 2.7595 2.7595 k = 0.0000-0.0904-0.0292 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4646 -11.4646 -11.1889 -11.1889 -8.7662 -8.7662 -8.4158 -8.4158 -6.5694 -6.5694 -5.4547 -5.4547 -5.3945 -5.3945 -4.9806 -4.9806 -4.6959 -4.6959 -4.1083 -4.1083 -3.3449 -3.3449 -2.8391 -2.8391 -2.5752 -2.5752 -1.6578 -1.6578 -1.4181 -1.4181 -0.9734 -0.9734 -0.7627 -0.7627 0.0122 0.0122 0.4793 0.4793 0.6291 0.6291 0.8947 0.8947 1.1623 1.1623 2.3613 2.3613 2.7149 2.7149 2.7493 2.7493 k = 0.0000-0.0775-0.0250 ( 16308 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4691 -11.4691 -11.1903 -11.1903 -8.7577 -8.7577 -8.4061 -8.4061 -6.5770 -6.5770 -5.4519 -5.4519 -5.3984 -5.3984 -4.9759 -4.9759 -4.6950 -4.6950 -4.1040 -4.1040 -3.3496 -3.3496 -2.8295 -2.8295 -2.5977 -2.5977 -1.6510 -1.6510 -1.4266 -1.4266 -0.9779 -0.9779 -0.7771 -0.7771 0.0221 0.0221 0.4779 0.4779 0.6277 0.6277 0.8975 0.8975 1.1680 1.1680 2.3583 2.3583 2.7112 2.7112 2.7403 2.7403 k = 0.0000-0.0646-0.0208 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4728 -11.4728 -11.1916 -11.1916 -8.7504 -8.7504 -8.3976 -8.3976 -6.5834 -6.5834 -5.4489 -5.4489 -5.4027 -5.4027 -4.9714 -4.9714 -4.6945 -4.6945 -4.1003 -4.1003 -3.3537 -3.3537 -2.8179 -2.8179 -2.6204 -2.6204 -1.6444 -1.6444 -1.4344 -1.4344 -0.9815 -0.9815 -0.7897 -0.7897 0.0309 0.0309 0.4769 0.4769 0.6269 0.6269 0.8996 0.8996 1.1728 1.1728 2.3561 2.3561 2.7077 2.7077 2.7326 2.7326 k = 0.0000-0.0516-0.0167 ( 16304 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4760 -11.4760 -11.1926 -11.1926 -8.7444 -8.7444 -8.3906 -8.3906 -6.5886 -6.5886 -5.4457 -5.4457 -5.4074 -5.4074 -4.9675 -4.9675 -4.6942 -4.6942 -4.0972 -4.0972 -3.3572 -3.3572 -2.8044 -2.8044 -2.6431 -2.6431 -1.6383 -1.6383 -1.4414 -1.4414 -0.9842 -0.9842 -0.8002 -0.8002 0.0383 0.0383 0.4767 0.4767 0.6259 0.6259 0.9012 0.9012 1.1767 1.1767 2.3541 2.3541 2.7047 2.7047 2.7262 2.7262 k = 0.0000-0.0387-0.0125 ( 16307 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4784 -11.4784 -11.1934 -11.1934 -8.7396 -8.7396 -8.3850 -8.3850 -6.5927 -6.5927 -5.4421 -5.4421 -5.4124 -5.4124 -4.9642 -4.9642 -4.6942 -4.6942 -4.0947 -4.0947 -3.3600 -3.3600 -2.7893 -2.7893 -2.6655 -2.6655 -1.6330 -1.6330 -1.4473 -1.4473 -0.9863 -0.9863 -0.8087 -0.8087 0.0443 0.0443 0.4756 0.4756 0.6248 0.6248 0.9029 0.9029 1.1800 1.1800 2.3522 2.3522 2.7021 2.7021 2.7212 2.7212 k = 0.0000-0.0258-0.0083 ( 16307 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4802 -11.4802 -11.1940 -11.1940 -8.7362 -8.7362 -8.3810 -8.3810 -6.5955 -6.5955 -5.4382 -5.4382 -5.4173 -5.4173 -4.9617 -4.9617 -4.6943 -4.6943 -4.0929 -4.0929 -3.3620 -3.3620 -2.7728 -2.7728 -2.6872 -2.6872 -1.6289 -1.6289 -1.4518 -1.4518 -0.9877 -0.9877 -0.8149 -0.8149 0.0486 0.0486 0.4752 0.4752 0.6241 0.6241 0.9044 0.9044 1.1820 1.1820 2.3509 2.3509 2.7003 2.7003 2.7177 2.7177 k = 0.0000-0.0129-0.0042 ( 16310 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4813 -11.4813 -11.1943 -11.1943 -8.7341 -8.7341 -8.3786 -8.3786 -6.5972 -6.5972 -5.4344 -5.4344 -5.4219 -5.4219 -4.9601 -4.9601 -4.6944 -4.6944 -4.0919 -4.0919 -3.3632 -3.3632 -2.7562 -2.7562 -2.7070 -2.7070 -1.6263 -1.6263 -1.4546 -1.4546 -0.9885 -0.9885 -0.8187 -0.8187 0.0512 0.0512 0.4739 0.4739 0.6237 0.6237 0.9053 0.9053 1.1837 1.1837 2.3499 2.3499 2.6991 2.6991 2.7155 2.7155 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k = 0.0128 0.0049 0.0025 ( 16308 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4813 -11.4813 -11.1943 -11.1943 -8.7331 -8.7331 -8.3779 -8.3779 -6.5973 -6.5973 -5.4363 -5.4363 -5.4208 -5.4208 -4.9600 -4.9600 -4.6946 -4.6946 -4.0929 -4.0929 -3.3629 -3.3629 -2.7460 -2.7460 -2.7187 -2.7187 -1.6262 -1.6262 -1.4554 -1.4554 -0.9901 -0.9901 -0.8192 -0.8192 0.0521 0.0521 0.4748 0.4748 0.6236 0.6236 0.9053 0.9053 1.1838 1.1838 2.3481 2.3481 2.6999 2.6999 2.7151 2.7151 k = 0.0256 0.0099 0.0050 ( 16301 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.4804 -11.4804 -11.1939 -11.1939 -8.7323 -8.7323 -8.3782 -8.3782 -6.5957 -6.5957 -5.4435 -5.4435 -5.4153 -5.4153 -4.9613 -4.9613 -4.6953 -4.6953 -4.0973 -4.0973 -3.3608 -3.3608 -2.7467 -2.7467 -2.7194 -2.7194 -1.6287 -1.6287 -1.4549 -1.4549 -0.9940 -0.9940 -0.8168 -0.8168 0.0522 0.0522 0.4773 0.4773 0.6236 0.6236 0.9049 0.9049 1.1838 1.1838 2.3433 2.3433 2.7030 2.7030 2.7161 2.7161 k = 0.0385 0.0148 0.0075 ( 16319 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4788 -11.4788 -11.1931 -11.1931 -8.7309 -8.7309 -8.3787 -8.3787 -6.5930 -6.5930 -5.4517 -5.4517 -5.4100 -5.4100 -4.9635 -4.9635 -4.6964 -4.6964 -4.1044 -4.1044 -3.3577 -3.3577 -2.7481 -2.7481 -2.7203 -2.7203 -1.6328 -1.6328 -1.4542 -1.4542 -1.0006 -1.0006 -0.8133 -0.8133 0.0524 0.0524 0.4795 0.4795 0.6236 0.6236 0.9034 0.9034 1.1818 1.1818 2.3341 2.3341 2.7070 2.7070 2.7189 2.7189 k = 0.0513 0.0198 0.0100 ( 16316 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4766 -11.4766 -11.1921 -11.1921 -8.7289 -8.7289 -8.3794 -8.3794 -6.5892 -6.5892 -5.4606 -5.4606 -5.4050 -5.4050 -4.9665 -4.9665 -4.6979 -4.6979 -4.1142 -4.1142 -3.3533 -3.3533 -2.7505 -2.7505 -2.7209 -2.7209 -1.6384 -1.6384 -1.4531 -1.4531 -1.0096 -1.0096 -0.8082 -0.8082 0.0526 0.0526 0.4838 0.4838 0.6245 0.6245 0.9025 0.9025 1.1805 1.1805 2.3227 2.3227 2.7098 2.7098 2.7252 2.7252 k = 0.0641 0.0247 0.0125 ( 16316 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4737 -11.4737 -11.1908 -11.1908 -8.7263 -8.7263 -8.3803 -8.3803 -6.5845 -6.5845 -5.4704 -5.4704 -5.4004 -5.4004 -4.9703 -4.9703 -4.7000 -4.7000 -4.1265 -4.1265 -3.3480 -3.3480 -2.7540 -2.7540 -2.7210 -2.7210 -1.6455 -1.6455 -1.4519 -1.4519 -1.0209 -1.0209 -0.8018 -0.8018 0.0528 0.0528 0.4894 0.4894 0.6252 0.6252 0.9009 0.9009 1.1788 1.1788 2.3087 2.3087 2.7111 2.7111 2.7350 2.7350 k = 0.0769 0.0297 0.0150 ( 16317 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4703 -11.4703 -11.1892 -11.1892 -8.7233 -8.7233 -8.3813 -8.3813 -6.5786 -6.5786 -5.4809 -5.4809 -5.3961 -5.3961 -4.9748 -4.9748 -4.7025 -4.7025 -4.1412 -4.1412 -3.3421 -3.3421 -2.7587 -2.7587 -2.7203 -2.7203 -1.6541 -1.6541 -1.4504 -1.4504 -1.0344 -1.0344 -0.7940 -0.7940 0.0530 0.0530 0.4954 0.4954 0.6263 0.6263 0.8991 0.8991 1.1772 1.1772 2.2921 2.2921 2.7117 2.7117 2.7470 2.7470 k = 0.0897 0.0346 0.0175 ( 16313 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4663 -11.4663 -11.1873 -11.1873 -8.7197 -8.7197 -8.3826 -8.3826 -6.5717 -6.5717 -5.4923 -5.4923 -5.3921 -5.3921 -4.9801 -4.9801 -4.7055 -4.7055 -4.1580 -4.1580 -3.3358 -3.3358 -2.7645 -2.7645 -2.7188 -2.7188 -1.6640 -1.6640 -1.4487 -1.4487 -1.0498 -1.0498 -0.7849 -0.7849 0.0531 0.0531 0.5027 0.5027 0.6276 0.6276 0.8974 0.8974 1.1751 1.1751 2.2739 2.2739 2.7121 2.7121 2.7608 2.7608 k = 0.1026 0.0396 0.0200 ( 16314 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4618 -11.4618 -11.1852 -11.1852 -8.7156 -8.7156 -8.3840 -8.3840 -6.5638 -6.5638 -5.5045 -5.5045 -5.3883 -5.3883 -4.9860 -4.9860 -4.7090 -4.7090 -4.1768 -4.1768 -3.3294 -3.3294 -2.7708 -2.7708 -2.7166 -2.7166 -1.6751 -1.6751 -1.4469 -1.4469 -1.0670 -1.0670 -0.7746 -0.7746 0.0530 0.0530 0.5103 0.5103 0.6287 0.6287 0.8955 0.8955 1.1725 1.1725 2.2542 2.2542 2.7122 2.7122 2.7760 2.7760 k = 0.1154 0.0445 0.0224 ( 16313 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.4567 -11.4567 -11.1828 -11.1828 -8.7110 -8.7110 -8.3856 -8.3856 -6.5549 -6.5549 -5.5176 -5.5176 -5.3849 -5.3849 -4.9925 -4.9925 -4.7131 -4.7131 -4.1972 -4.1972 -3.3232 -3.3232 -2.7776 -2.7776 -2.7137 -2.7137 -1.6874 -1.6874 -1.4450 -1.4450 -1.0858 -1.0858 -0.7630 -0.7630 0.0528 0.0528 0.5181 0.5181 0.6300 0.6300 0.8932 0.8932 1.1702 1.1702 2.2335 2.2335 2.7120 2.7120 2.7923 2.7923 k = 0.1282 0.0495 0.0249 ( 16310 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4511 -11.4511 -11.1802 -11.1802 -8.7059 -8.7059 -8.3873 -8.3873 -6.5450 -6.5450 -5.5315 -5.5315 -5.3816 -5.3816 -4.9996 -4.9996 -4.7177 -4.7177 -4.2191 -4.2191 -3.3177 -3.3177 -2.7842 -2.7842 -2.7101 -2.7101 -1.7007 -1.7007 -1.4430 -1.4430 -1.1058 -1.1058 -0.7503 -0.7503 0.0523 0.0523 0.5263 0.5263 0.6322 0.6322 0.8904 0.8904 1.1673 1.1673 2.2122 2.2122 2.7116 2.7116 2.8097 2.8097 k = 0.1410 0.0544 0.0274 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4450 -11.4450 -11.1774 -11.1774 -8.7004 -8.7004 -8.3892 -8.3892 -6.5341 -6.5341 -5.5462 -5.5462 -5.3786 -5.3786 -5.0071 -5.0071 -4.7229 -4.7229 -4.2421 -4.2421 -3.3131 -3.3131 -2.7905 -2.7905 -2.7059 -2.7059 -1.7150 -1.7150 -1.4411 -1.4411 -1.1269 -1.1269 -0.7365 -0.7365 0.0515 0.0515 0.5347 0.5347 0.6346 0.6346 0.8875 0.8875 1.1642 1.1642 2.1901 2.1901 2.7110 2.7110 2.8280 2.8280 k = 0.1538 0.0594 0.0299 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6229 -41.6229 -41.4606 -41.4606 -11.4385 -11.4385 -11.1744 -11.1744 -8.6946 -8.6946 -8.3912 -8.3912 -6.5222 -6.5222 -5.5618 -5.5618 -5.3758 -5.3758 -5.0150 -5.0150 -4.7288 -4.7288 -4.2660 -4.2660 -3.3099 -3.3099 -2.7959 -2.7959 -2.7011 -2.7011 -1.7301 -1.7301 -1.4392 -1.4392 -1.1488 -1.1488 -0.7217 -0.7217 0.0503 0.0503 0.5418 0.5418 0.6369 0.6369 0.8843 0.8843 1.1610 1.1610 2.1676 2.1676 2.7101 2.7101 2.8470 2.8470 k = 0.1667 0.0643 0.0324 ( 16308 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6229 -41.6229 -41.4606 -41.4606 -11.4317 -11.4317 -11.1712 -11.1712 -8.6883 -8.6883 -8.3932 -8.3932 -6.5094 -6.5094 -5.5781 -5.5781 -5.3733 -5.3733 -5.0233 -5.0233 -4.7352 -4.7352 -4.2907 -4.2907 -3.3083 -3.3083 -2.8003 -2.8003 -2.6956 -2.6956 -1.7459 -1.7459 -1.4376 -1.4376 -1.1710 -1.1710 -0.7058 -0.7058 0.0488 0.0488 0.5489 0.5489 0.6400 0.6400 0.8803 0.8803 1.1581 1.1581 2.1449 2.1449 2.7087 2.7087 2.8669 2.8669 k = 0.1795 0.0693 0.0349 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.4244 -11.4244 -11.1678 -11.1678 -8.6817 -8.6817 -8.3954 -8.3954 -6.4957 -6.4957 -5.5952 -5.5952 -5.3710 -5.3710 -5.0319 -5.0319 -4.7424 -4.7424 -4.3157 -4.3157 -3.3088 -3.3088 -2.8033 -2.8033 -2.6895 -2.6895 -1.7624 -1.7624 -1.4364 -1.4364 -1.1932 -1.1932 -0.6890 -0.6890 0.0468 0.0468 0.5545 0.5545 0.6438 0.6438 0.8761 0.8761 1.1555 1.1555 2.1221 2.1221 2.7071 2.7071 2.8874 2.8874 k = 0.1923 0.0742 0.0374 ( 16303 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.4168 -11.4168 -11.1644 -11.1644 -8.6748 -8.6748 -8.3977 -8.3977 -6.4812 -6.4812 -5.6130 -5.6130 -5.3689 -5.3689 -5.0407 -5.0407 -4.7502 -4.7502 -4.3409 -4.3409 -3.3115 -3.3115 -2.8047 -2.8047 -2.6827 -2.6827 -1.7794 -1.7794 -1.4358 -1.4358 -1.2151 -1.2151 -0.6712 -0.6712 0.0443 0.0443 0.5595 0.5595 0.6482 0.6482 0.8724 0.8724 1.1523 1.1523 2.1001 2.1001 2.7051 2.7051 2.9088 2.9088 k = 0.2051 0.0792 0.0399 ( 16304 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.4090 -11.4090 -11.1607 -11.1607 -8.6677 -8.6677 -8.4000 -8.4000 -6.4659 -6.4659 -5.6314 -5.6314 -5.3671 -5.3671 -5.0497 -5.0497 -4.7586 -4.7586 -4.3660 -4.3660 -3.3165 -3.3165 -2.8046 -2.8046 -2.6753 -2.6753 -1.7968 -1.7968 -1.4361 -1.4361 -1.2359 -1.2359 -0.6526 -0.6526 0.0414 0.0414 0.5629 0.5629 0.6531 0.6531 0.8678 0.8678 1.1491 1.1491 2.0783 2.0783 2.7027 2.7027 2.9307 2.9307 k = 0.2179 0.0841 0.0424 ( 16300 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.4009 -11.4009 -11.1570 -11.1570 -8.6603 -8.6603 -8.4024 -8.4024 -6.4497 -6.4497 -5.6504 -5.6504 -5.3655 -5.3655 -5.0588 -5.0588 -4.7678 -4.7678 -4.3908 -4.3908 -3.3239 -3.3239 -2.8028 -2.8028 -2.6671 -2.6671 -1.8146 -1.8146 -1.4378 -1.4378 -1.2552 -1.2552 -0.6330 -0.6330 0.0379 0.0379 0.5645 0.5645 0.6585 0.6585 0.8636 0.8636 1.1469 1.1469 2.0569 2.0569 2.6999 2.6999 2.9532 2.9532 k = 0.2308 0.0891 0.0449 ( 16303 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.3927 -11.3927 -11.1533 -11.1533 -8.6527 -8.6527 -8.4049 -8.4049 -6.4329 -6.4329 -5.6699 -5.6699 -5.3642 -5.3642 -5.0680 -5.0680 -4.7775 -4.7775 -4.4151 -4.4151 -3.3335 -3.3335 -2.7995 -2.7995 -2.6582 -2.6582 -1.8326 -1.8326 -1.4414 -1.4414 -1.2722 -1.2722 -0.6129 -0.6129 0.0339 0.0339 0.5648 0.5648 0.6638 0.6638 0.8587 0.8587 1.1444 1.1444 2.0363 2.0363 2.6967 2.6967 2.9762 2.9762 k = 0.2436 0.0940 0.0474 ( 16299 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3843 -11.3843 -11.1494 -11.1494 -8.6450 -8.6450 -8.4073 -8.4073 -6.4154 -6.4154 -5.6898 -5.6898 -5.3631 -5.3631 -5.0773 -5.0773 -4.7879 -4.7879 -4.4388 -4.4388 -3.3453 -3.3453 -2.7949 -2.7949 -2.6485 -2.6485 -1.8507 -1.8507 -1.4475 -1.4475 -1.2862 -1.2862 -0.5919 -0.5919 0.0295 0.0295 0.5639 0.5639 0.6695 0.6695 0.8539 0.8539 1.1427 1.1427 2.0166 2.0166 2.6931 2.6931 2.9998 2.9998 k = 0.2564 0.0990 0.0499 ( 16291 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3758 -11.3758 -11.1456 -11.1456 -8.6372 -8.6372 -8.4098 -8.4098 -6.3974 -6.3974 -5.7101 -5.7101 -5.3623 -5.3623 -5.0865 -5.0865 -4.7988 -4.7988 -4.4616 -4.4616 -3.3588 -3.3588 -2.7893 -2.7893 -2.6380 -2.6380 -1.8689 -1.8689 -1.4563 -1.4563 -1.2967 -1.2967 -0.5703 -0.5703 0.0245 0.0245 0.5617 0.5617 0.6753 0.6753 0.8491 0.8491 1.1418 1.1418 1.9981 1.9981 2.6892 2.6892 3.0238 3.0238 k = 0.2692 0.1039 0.0524 ( 16288 PWs) bands (ev): -70.4470 -70.4470 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3674 -11.3674 -11.1417 -11.1417 -8.6293 -8.6293 -8.4123 -8.4123 -6.3788 -6.3788 -5.7306 -5.7306 -5.3618 -5.3618 -5.0958 -5.0958 -4.8101 -4.8101 -4.4835 -4.4835 -3.3739 -3.3739 -2.7829 -2.7829 -2.6268 -2.6268 -1.8870 -1.8870 -1.4680 -1.4680 -1.3036 -1.3036 -0.5483 -0.5483 0.0190 0.0190 0.5585 0.5585 0.6811 0.6811 0.8433 0.8433 1.1405 1.1405 1.9806 1.9806 2.6848 2.6848 3.0483 3.0483 k = 0.2821 0.1088 0.0549 ( 16285 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3590 -11.3590 -11.1379 -11.1379 -8.6214 -8.6214 -8.4148 -8.4148 -6.3598 -6.3598 -5.7512 -5.7512 -5.3615 -5.3615 -5.1050 -5.1050 -4.8217 -4.8217 -4.5043 -4.5043 -3.3902 -3.3902 -2.7761 -2.7761 -2.6149 -2.6149 -1.9050 -1.9050 -1.4820 -1.4820 -1.3073 -1.3073 -0.5256 -0.5256 0.0130 0.0130 0.5540 0.5540 0.6863 0.6863 0.8380 0.8380 1.1396 1.1396 1.9641 1.9641 2.6802 2.6802 3.0730 3.0730 k = 0.2949 0.1138 0.0574 ( 16285 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3506 -11.3506 -11.1342 -11.1342 -8.6135 -8.6135 -8.4172 -8.4172 -6.3404 -6.3404 -5.7718 -5.7718 -5.3615 -5.3615 -5.1142 -5.1142 -4.8335 -4.8335 -4.5241 -4.5241 -3.4075 -3.4075 -2.7689 -2.7689 -2.6023 -2.6023 -1.9227 -1.9227 -1.4977 -1.4977 -1.3082 -1.3082 -0.5026 -0.5026 0.0066 0.0066 0.5482 0.5482 0.6911 0.6911 0.8324 0.8324 1.1395 1.1395 1.9483 1.9483 2.6753 2.6753 3.0979 3.0979 k = 0.3077 0.1187 0.0599 ( 16288 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3424 -11.3424 -11.1305 -11.1305 -8.6058 -8.6058 -8.4197 -8.4197 -6.3208 -6.3208 -5.7924 -5.7924 -5.3616 -5.3616 -5.1233 -5.1233 -4.8453 -4.8453 -4.5427 -4.5427 -3.4253 -3.4253 -2.7618 -2.7618 -2.5892 -2.5892 -1.9400 -1.9400 -1.5145 -1.5145 -1.3071 -1.3071 -0.4792 -0.4792 -0.0003 -0.0003 0.5413 0.5413 0.6955 0.6955 0.8263 0.8263 1.1394 1.1394 1.9338 1.9338 2.6701 2.6701 3.1230 3.1230 k = 0.3205 0.1237 0.0624 ( 16286 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3345 -11.3345 -11.1269 -11.1269 -8.5981 -8.5981 -8.4221 -8.4221 -6.3010 -6.3010 -5.8127 -5.8127 -5.3620 -5.3620 -5.1323 -5.1323 -4.8570 -4.8570 -4.5602 -4.5602 -3.4433 -3.4433 -2.7548 -2.7548 -2.5757 -2.5757 -1.9569 -1.9569 -1.5316 -1.5316 -1.3044 -1.3044 -0.4556 -0.4556 -0.0076 -0.0076 0.5337 0.5337 0.6994 0.6994 0.8210 0.8210 1.1397 1.1397 1.9204 1.9204 2.6647 2.6647 3.1480 3.1480 k = 0.3333 0.1286 0.0649 ( 16282 PWs) bands (ev): -70.4468 -70.4468 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3267 -11.3267 -11.1234 -11.1234 -8.5906 -8.5906 -8.4244 -8.4244 -6.2812 -6.2812 -5.8328 -5.8328 -5.3626 -5.3626 -5.1412 -5.1412 -4.8685 -4.8685 -4.5766 -4.5766 -3.4614 -3.4614 -2.7480 -2.7480 -2.5620 -2.5620 -1.9731 -1.9731 -1.5488 -1.5488 -1.3007 -1.3007 -0.4318 -0.4318 -0.0153 -0.0153 0.5254 0.5254 0.7030 0.7030 0.8156 0.8156 1.1403 1.1403 1.9087 1.9087 2.6593 2.6593 3.1729 3.1729 k = 0.3462 0.1336 0.0673 ( 16276 PWs) bands (ev): -70.4466 -70.4466 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3193 -11.3193 -11.1201 -11.1201 -8.5834 -8.5834 -8.4267 -8.4267 -6.2615 -6.2615 -5.8526 -5.8526 -5.3632 -5.3632 -5.1499 -5.1499 -4.8794 -4.8794 -4.5919 -4.5919 -3.4791 -3.4791 -2.7415 -2.7415 -2.5483 -2.5483 -1.9888 -1.9888 -1.5655 -1.5655 -1.2962 -1.2962 -0.4080 -0.4080 -0.0233 -0.0233 0.5166 0.5166 0.7060 0.7060 0.8108 0.8108 1.1412 1.1412 1.8980 1.8980 2.6537 2.6537 3.1976 3.1976 k = 0.3590 0.1385 0.0698 ( 16275 PWs) bands (ev): -70.4466 -70.4466 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3123 -11.3123 -11.1170 -11.1170 -8.5764 -8.5764 -8.4290 -8.4290 -6.2419 -6.2419 -5.8718 -5.8718 -5.3640 -5.3640 -5.1585 -5.1585 -4.8898 -4.8898 -4.6061 -4.6061 -3.4964 -3.4964 -2.7355 -2.7355 -2.5348 -2.5348 -2.0036 -2.0036 -1.5815 -1.5815 -1.2912 -1.2912 -0.3842 -0.3842 -0.0318 -0.0318 0.5073 0.5073 0.7084 0.7084 0.8065 0.8065 1.1415 1.1415 1.8882 1.8882 2.6482 2.6482 3.2216 3.2216 k = 0.3718 0.1435 0.0723 ( 16272 PWs) bands (ev): -70.4465 -70.4465 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.3057 -11.3057 -11.1140 -11.1140 -8.5698 -8.5698 -8.4311 -8.4311 -6.2226 -6.2226 -5.8905 -5.8905 -5.3648 -5.3648 -5.1667 -5.1667 -4.8995 -4.8995 -4.6192 -4.6192 -3.5129 -3.5129 -2.7298 -2.7298 -2.5216 -2.5216 -2.0176 -2.0176 -1.5967 -1.5967 -1.2860 -1.2860 -0.3606 -0.3606 -0.0405 -0.0405 0.4973 0.4973 0.7101 0.7101 0.8023 0.8023 1.1426 1.1426 1.8799 1.8799 2.6428 2.6428 3.2449 3.2449 k = 0.3846 0.1484 0.0748 ( 16270 PWs) bands (ev): -70.4464 -70.4464 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2995 -11.2995 -11.1113 -11.1113 -8.5635 -8.5635 -8.4332 -8.4332 -6.2037 -6.2037 -5.9086 -5.9086 -5.3656 -5.3656 -5.1747 -5.1747 -4.9084 -4.9084 -4.6311 -4.6311 -3.5284 -3.5284 -2.7247 -2.7247 -2.5089 -2.5089 -2.0306 -2.0306 -1.6108 -1.6108 -1.2808 -1.2808 -0.3372 -0.3372 -0.0496 -0.0496 0.4874 0.4874 0.7112 0.7112 0.7985 0.7985 1.1434 1.1434 1.8727 1.8727 2.6376 2.6376 3.2672 3.2672 k = 0.3974 0.1534 0.0773 ( 16268 PWs) bands (ev): -70.4464 -70.4464 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2939 -11.2939 -11.1088 -11.1088 -8.5577 -8.5577 -8.4351 -8.4351 -6.1853 -6.1853 -5.9261 -5.9261 -5.3663 -5.3663 -5.1823 -5.1823 -4.9164 -4.9164 -4.6420 -4.6420 -3.5428 -3.5428 -2.7200 -2.7200 -2.4970 -2.4970 -2.0425 -2.0425 -1.6238 -1.6238 -1.2757 -1.2757 -0.3143 -0.3143 -0.0592 -0.0592 0.4776 0.4776 0.7122 0.7122 0.7955 0.7955 1.1437 1.1437 1.8665 1.8665 2.6326 2.6326 3.2883 3.2883 k = 0.4103 0.1583 0.0798 ( 16262 PWs) bands (ev): -70.4462 -70.4462 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2888 -11.2888 -11.1066 -11.1066 -8.5523 -8.5523 -8.4370 -8.4370 -6.1675 -6.1675 -5.9428 -5.9428 -5.3670 -5.3670 -5.1894 -5.1894 -4.9235 -4.9235 -4.6517 -4.6517 -3.5558 -3.5558 -2.7158 -2.7158 -2.4860 -2.4860 -2.0533 -2.0533 -1.6354 -1.6354 -1.2708 -1.2708 -0.2918 -0.2918 -0.0690 -0.0690 0.4681 0.4681 0.7131 0.7131 0.7932 0.7932 1.1447 1.1447 1.8608 1.8608 2.6280 2.6280 3.3078 3.3078 k = 0.4231 0.1633 0.0823 ( 16259 PWs) bands (ev): -70.4462 -70.4462 -42.5422 -42.5422 -41.6227 -41.6227 -41.4608 -41.4608 -11.2843 -11.2843 -11.1046 -11.1046 -8.5475 -8.5475 -8.4387 -8.4387 -6.1503 -6.1503 -5.9588 -5.9588 -5.3676 -5.3676 -5.1958 -5.1958 -4.9297 -4.9297 -4.6603 -4.6603 -3.5674 -3.5674 -2.7122 -2.7122 -2.4761 -2.4761 -2.0628 -2.0628 -1.6458 -1.6458 -1.2663 -1.2663 -0.2700 -0.2700 -0.0793 -0.0793 0.4588 0.4588 0.7136 0.7136 0.7912 0.7912 1.1455 1.1455 1.8562 1.8562 2.6238 2.6238 3.3255 3.3255 k = 0.4359 0.1682 0.0848 ( 16261 PWs) bands (ev): -70.4462 -70.4462 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2804 -11.2804 -11.1029 -11.1029 -8.5433 -8.5433 -8.4402 -8.4402 -6.1340 -6.1340 -5.9740 -5.9740 -5.3680 -5.3680 -5.2016 -5.2016 -4.9349 -4.9349 -4.6676 -4.6676 -3.5775 -3.5775 -2.7091 -2.7091 -2.4675 -2.4675 -2.0710 -2.0710 -1.6546 -1.6546 -1.2623 -1.2623 -0.2491 -0.2491 -0.0902 -0.0902 0.4505 0.4505 0.7136 0.7136 0.7892 0.7892 1.1459 1.1459 1.8522 1.8522 2.6201 2.6201 3.3411 3.3411 k = 0.4487 0.1732 0.0873 ( 16255 PWs) bands (ev): -70.4461 -70.4461 -42.5422 -42.5422 -41.6227 -41.6227 -41.4608 -41.4608 -11.2772 -11.2772 -11.1015 -11.1015 -8.5398 -8.5398 -8.4415 -8.4415 -6.1185 -6.1185 -5.9885 -5.9885 -5.3684 -5.3684 -5.2065 -5.2065 -4.9391 -4.9391 -4.6737 -4.6737 -3.5858 -3.5858 -2.7065 -2.7065 -2.4602 -2.4602 -2.0779 -2.0779 -1.6619 -1.6619 -1.2589 -1.2589 -0.2290 -0.2290 -0.1017 -0.1017 0.4433 0.4433 0.7141 0.7141 0.7878 0.7878 1.1466 1.1466 1.8495 1.8495 2.6170 2.6170 3.3544 3.3544 k = 0.4615 0.1781 0.0898 ( 16265 PWs) bands (ev): -70.4463 -70.4463 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2747 -11.2747 -11.1004 -11.1004 -8.5370 -8.5370 -8.4425 -8.4425 -6.1042 -6.1042 -6.0019 -6.0019 -5.3686 -5.3686 -5.2105 -5.2105 -4.9424 -4.9424 -4.6785 -4.6785 -3.5924 -3.5924 -2.7045 -2.7045 -2.4544 -2.4544 -2.0833 -2.0833 -1.6677 -1.6677 -1.2562 -1.2562 -0.2101 -0.2101 -0.1138 -0.1138 0.4373 0.4373 0.7134 0.7134 0.7859 0.7859 1.1466 1.1466 1.8471 1.8471 2.6145 2.6145 3.3649 3.3649 k = 0.4744 0.1831 0.0923 ( 16261 PWs) bands (ev): -70.4462 -70.4462 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2729 -11.2729 -11.0996 -11.0996 -8.5349 -8.5349 -8.4433 -8.4433 -6.0914 -6.0914 -6.0140 -6.0140 -5.3688 -5.3688 -5.2135 -5.2135 -4.9447 -4.9447 -4.6820 -4.6820 -3.5972 -3.5972 -2.7030 -2.7030 -2.4502 -2.4502 -2.0872 -2.0872 -1.6718 -1.6718 -1.2542 -1.2542 -0.1924 -0.1924 -0.1263 -0.1263 0.4330 0.4330 0.7135 0.7135 0.7854 0.7854 1.1467 1.1467 1.8458 1.8458 2.6127 2.6127 3.3726 3.3726 k = 0.4872 0.1880 0.0948 ( 16259 PWs) bands (ev): -70.4461 -70.4461 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2718 -11.2718 -11.0992 -11.0992 -8.5337 -8.5337 -8.4438 -8.4438 -6.0816 -6.0816 -6.0235 -6.0235 -5.3689 -5.3689 -5.2153 -5.2153 -4.9461 -4.9461 -4.6840 -4.6840 -3.6001 -3.6001 -2.7022 -2.7022 -2.4477 -2.4477 -2.0895 -2.0895 -1.6743 -1.6743 -1.2529 -1.2529 -0.1767 -0.1767 -0.1389 -0.1389 0.4302 0.4302 0.7135 0.7135 0.7849 0.7849 1.1470 1.1470 1.8453 1.8453 2.6115 2.6115 3.3773 3.3773 k = 0.5000 0.1930 0.0973 ( 16252 PWs) bands (ev): -70.4460 -70.4460 -42.5422 -42.5422 -41.6227 -41.6227 -41.4607 -41.4607 -11.2714 -11.2714 -11.0990 -11.0990 -8.5333 -8.5333 -8.4439 -8.4439 -6.0775 -6.0775 -6.0274 -6.0274 -5.3689 -5.3689 -5.2159 -5.2159 -4.9466 -4.9466 -4.6847 -4.6847 -3.6010 -3.6010 -2.7019 -2.7019 -2.4468 -2.4468 -2.0903 -2.0903 -1.6751 -1.6751 -1.2525 -1.2525 -0.1679 -0.1679 -0.1465 -0.1465 0.4292 0.4292 0.7141 0.7141 0.7856 0.7856 1.1472 1.1472 1.8451 1.8451 2.6112 2.6112 3.3788 3.3788 k = 0.5000-0.2202-0.0361 ( 16334 PWs) bands (ev): -70.4481 -70.4481 -42.5425 -42.5425 -41.6231 -41.6231 -41.4611 -41.4611 -11.1845 -11.1845 -11.0940 -11.0940 -8.6933 -8.6933 -8.6497 -8.6497 -5.9225 -5.9225 -5.7656 -5.7656 -5.6236 -5.6236 -5.1102 -5.1102 -4.7181 -4.7181 -4.5219 -4.5219 -4.0298 -4.0298 -3.0247 -3.0247 -2.1513 -2.1513 -1.9296 -1.9296 -1.3185 -1.3185 -1.1693 -1.1693 -0.4637 -0.4637 -0.2410 -0.2410 0.5032 0.5032 0.6675 0.6675 0.7862 0.7862 1.1040 1.1040 1.8617 1.8617 2.9661 2.9661 3.1768 3.1768 k = 0.4875-0.2147-0.0352 ( 16326 PWs) bands (ev): -70.4479 -70.4479 -42.5424 -42.5424 -41.6231 -41.6231 -41.4611 -41.4611 -11.1852 -11.1852 -11.0940 -11.0940 -8.6935 -8.6935 -8.6492 -8.6492 -5.9290 -5.9290 -5.7595 -5.7595 -5.6227 -5.6227 -5.1104 -5.1104 -4.7187 -4.7187 -4.5212 -4.5212 -4.0281 -4.0281 -3.0248 -3.0248 -2.1521 -2.1521 -1.9290 -1.9290 -1.3189 -1.3189 -1.1694 -1.1694 -0.4631 -0.4631 -0.2418 -0.2418 0.5034 0.5034 0.6679 0.6679 0.7871 0.7871 1.1044 1.1044 1.8628 1.8628 2.9655 2.9655 3.1769 3.1769 k = 0.4750-0.2092-0.0343 ( 16320 PWs) bands (ev): -70.4477 -70.4477 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.1871 -11.1871 -11.0940 -11.0940 -8.6940 -8.6940 -8.6474 -8.6474 -5.9461 -5.9461 -5.7438 -5.7438 -5.6199 -5.6199 -5.1111 -5.1111 -4.7206 -4.7206 -4.5192 -4.5192 -4.0231 -4.0231 -3.0249 -3.0249 -2.1545 -2.1545 -1.9271 -1.9271 -1.3200 -1.3200 -1.1698 -1.1698 -0.4617 -0.4617 -0.2444 -0.2444 0.5047 0.5047 0.6685 0.6685 0.7890 0.7890 1.1046 1.1046 1.8637 1.8637 2.9635 2.9635 3.1769 3.1769 k = 0.4625-0.2037-0.0334 ( 16319 PWs) bands (ev): -70.4477 -70.4477 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.1903 -11.1903 -11.0941 -11.0941 -8.6948 -8.6948 -8.6447 -8.6447 -5.9695 -5.9695 -5.7232 -5.7232 -5.6148 -5.6148 -5.1121 -5.1121 -4.7236 -4.7236 -4.5160 -4.5160 -4.0148 -4.0148 -3.0252 -3.0252 -2.1585 -2.1585 -1.9241 -1.9241 -1.3218 -1.3218 -1.1705 -1.1705 -0.4594 -0.4594 -0.2483 -0.2483 0.5063 0.5063 0.6687 0.6687 0.7918 0.7918 1.1043 1.1043 1.8656 1.8656 2.9602 2.9602 3.1768 3.1768 k = 0.4500-0.1982-0.0325 ( 16315 PWs) bands (ev): -70.4476 -70.4476 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.1947 -11.1947 -11.0943 -11.0943 -8.6957 -8.6957 -8.6410 -8.6410 -5.9961 -5.9961 -5.7014 -5.7014 -5.6067 -5.6067 -5.1137 -5.1137 -4.7274 -4.7274 -4.5117 -4.5117 -4.0033 -4.0033 -3.0255 -3.0255 -2.1641 -2.1641 -1.9200 -1.9200 -1.3242 -1.3242 -1.1714 -1.1714 -0.4566 -0.4566 -0.2534 -0.2534 0.5084 0.5084 0.6692 0.6692 0.7956 0.7956 1.1041 1.1041 1.8683 1.8683 2.9556 2.9556 3.1763 3.1763 k = 0.4375-0.1927-0.0316 ( 16315 PWs) bands (ev): -70.4476 -70.4476 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.2002 -11.2002 -11.0947 -11.0947 -8.6967 -8.6967 -8.6364 -8.6364 -6.0244 -6.0244 -5.6809 -5.6809 -5.5946 -5.5946 -5.1158 -5.1158 -4.7318 -4.7318 -4.5065 -4.5065 -3.9888 -3.9888 -3.0260 -3.0260 -2.1710 -2.1710 -1.9149 -1.9149 -1.3270 -1.3270 -1.1725 -1.1725 -0.4537 -0.4537 -0.2591 -0.2591 0.5107 0.5107 0.6695 0.6695 0.8011 0.8011 1.1033 1.1033 1.8716 1.8716 2.9500 2.9500 3.1754 3.1754 k = 0.4250-0.1872-0.0307 ( 16303 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2066 -11.2066 -11.0953 -11.0953 -8.6978 -8.6978 -8.6310 -8.6310 -6.0535 -6.0535 -5.6635 -5.6635 -5.5779 -5.5779 -5.1186 -5.1186 -4.7364 -4.7364 -4.5004 -4.5004 -3.9713 -3.9713 -3.0265 -3.0265 -2.1793 -2.1793 -1.9091 -1.9091 -1.3300 -1.3300 -1.1738 -1.1738 -0.4514 -0.4514 -0.2646 -0.2646 0.5134 0.5134 0.6710 0.6710 0.8077 0.8077 1.1030 1.1030 1.8759 1.8759 2.9433 2.9433 3.1739 3.1739 k = 0.4125-0.1817-0.0298 ( 16301 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2139 -11.2139 -11.0962 -11.0962 -8.6990 -8.6990 -8.6249 -8.6249 -6.0828 -6.0828 -5.6495 -5.6495 -5.5568 -5.5568 -5.1221 -5.1221 -4.7409 -4.7409 -4.4936 -4.4936 -3.9512 -3.9512 -3.0272 -3.0272 -2.1889 -2.1889 -1.9027 -1.9027 -1.3330 -1.3330 -1.1753 -1.1753 -0.4504 -0.4504 -0.2693 -0.2693 0.5160 0.5160 0.6716 0.6716 0.8148 0.8148 1.1026 1.1026 1.8807 1.8807 2.9357 2.9357 3.1716 3.1716 k = 0.4000-0.1762-0.0289 ( 16306 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2220 -11.2220 -11.0974 -11.0974 -8.7001 -8.7001 -8.6182 -8.6182 -6.1121 -6.1121 -5.6381 -5.6381 -5.5324 -5.5324 -5.1264 -5.1264 -4.7451 -4.7451 -4.4863 -4.4863 -3.9286 -3.9286 -3.0279 -3.0279 -2.1998 -2.1998 -1.8958 -1.8958 -1.3360 -1.3360 -1.1768 -1.1768 -0.4515 -0.4515 -0.2723 -0.2723 0.5189 0.5189 0.6720 0.6720 0.8218 0.8218 1.1021 1.1021 1.8856 1.8856 2.9273 2.9273 3.1683 3.1683 k = 0.3875-0.1707-0.0280 ( 16301 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2308 -11.2308 -11.0990 -11.0990 -8.7012 -8.7012 -8.6108 -8.6108 -6.1411 -6.1411 -5.6282 -5.6282 -5.5060 -5.5060 -5.1314 -5.1314 -4.7488 -4.7488 -4.4782 -4.4782 -3.9037 -3.9037 -3.0287 -3.0287 -2.2118 -2.2118 -1.8884 -1.8884 -1.3386 -1.3386 -1.1784 -1.1784 -0.4553 -0.4553 -0.2727 -0.2727 0.5219 0.5219 0.6729 0.6729 0.8298 0.8298 1.1016 1.1016 1.8925 1.8925 2.9181 2.9181 3.1641 3.1641 k = 0.3750-0.1652-0.0271 ( 16307 PWs) bands (ev): -70.4475 -70.4475 -42.5423 -42.5423 -41.6230 -41.6230 -41.4609 -41.4609 -11.2401 -11.2401 -11.1009 -11.1009 -8.7024 -8.7024 -8.6029 -8.6029 -6.1696 -6.1696 -5.6190 -5.6190 -5.4787 -5.4787 -5.1373 -5.1373 -4.7518 -4.7518 -4.4695 -4.4695 -3.8767 -3.8767 -3.0296 -3.0296 -2.2250 -2.2250 -1.8808 -1.8808 -1.3408 -1.3408 -1.1799 -1.1799 -0.4622 -0.4622 -0.2702 -0.2702 0.5250 0.5250 0.6728 0.6728 0.8378 0.8378 1.1007 1.1007 1.8996 1.8996 2.9083 2.9083 3.1586 3.1586 k = 0.3625-0.1597-0.0262 ( 16308 PWs) bands (ev): -70.4475 -70.4475 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2500 -11.2500 -11.1031 -11.1031 -8.7035 -8.7035 -8.5946 -8.5946 -6.1975 -6.1975 -5.6102 -5.6102 -5.4510 -5.4510 -5.1441 -5.1441 -4.7541 -4.7541 -4.4601 -4.4601 -3.8479 -3.8479 -3.0305 -3.0305 -2.2393 -2.2393 -1.8729 -1.8729 -1.3425 -1.3425 -1.1813 -1.1813 -0.4721 -0.4721 -0.2648 -0.2648 0.5285 0.5285 0.6728 0.6728 0.8457 0.8457 1.1001 1.1001 1.9081 1.9081 2.8978 2.8978 3.1519 3.1519 k = 0.3500-0.1542-0.0253 ( 16295 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.2603 -11.2603 -11.1056 -11.1056 -8.7046 -8.7046 -8.5857 -8.5857 -6.2248 -6.2248 -5.6016 -5.6016 -5.4235 -5.4235 -5.1515 -5.1515 -4.7556 -4.7556 -4.4501 -4.4501 -3.8175 -3.8175 -3.0314 -3.0314 -2.2546 -2.2546 -1.8649 -1.8649 -1.3437 -1.3437 -1.1823 -1.1823 -0.4846 -0.4846 -0.2567 -0.2567 0.5325 0.5325 0.6732 0.6732 0.8542 0.8542 1.1004 1.1004 1.9177 1.9177 2.8870 2.8870 3.1441 3.1441 k = 0.3375-0.1487-0.0244 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.2710 -11.2710 -11.1085 -11.1085 -8.7057 -8.7057 -8.5765 -8.5765 -6.2513 -6.2513 -5.5929 -5.5929 -5.3965 -5.3965 -5.1596 -5.1596 -4.7563 -4.7563 -4.4394 -4.4394 -3.7857 -3.7857 -3.0322 -3.0322 -2.2709 -2.2709 -1.8567 -1.8567 -1.3445 -1.3445 -1.1829 -1.1829 -0.4992 -0.4992 -0.2465 -0.2465 0.5359 0.5359 0.6726 0.6726 0.8622 0.8622 1.1003 1.1003 1.9283 1.9283 2.8757 2.8757 3.1348 3.1348 k = 0.3250-0.1431-0.0235 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.2820 -11.2820 -11.1117 -11.1117 -8.7069 -8.7069 -8.5670 -8.5670 -6.2770 -6.2770 -5.5841 -5.5841 -5.3704 -5.3704 -5.1680 -5.1680 -4.7562 -4.7562 -4.4280 -4.4280 -3.7530 -3.7530 -3.0329 -3.0329 -2.2882 -2.2882 -1.8484 -1.8484 -1.3449 -1.3449 -1.1829 -1.1829 -0.5153 -0.5153 -0.2345 -0.2345 0.5389 0.5389 0.6721 0.6721 0.8698 0.8698 1.1009 1.1009 1.9392 1.9392 2.8641 2.8641 3.1240 3.1240 k = 0.3125-0.1376-0.0226 ( 16297 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.2932 -11.2932 -11.1152 -11.1152 -8.7080 -8.7080 -8.5572 -8.5572 -6.3018 -6.3018 -5.5753 -5.5753 -5.3455 -5.3455 -5.1764 -5.1764 -4.7554 -4.7554 -4.4159 -4.4159 -3.7195 -3.7195 -3.0334 -3.0334 -2.3063 -2.3063 -1.8400 -1.8400 -1.3451 -1.3451 -1.1821 -1.1821 -0.5326 -0.5326 -0.2214 -0.2214 0.5420 0.5420 0.6710 0.6710 0.8768 0.8768 1.1016 1.1016 1.9509 1.9509 2.8522 2.8522 3.1120 3.1120 k = 0.3000-0.1321-0.0217 ( 16301 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3045 -11.3045 -11.1189 -11.1189 -8.7092 -8.7092 -8.5471 -8.5471 -6.3258 -6.3258 -5.5664 -5.5664 -5.3225 -5.3225 -5.1841 -5.1841 -4.7540 -4.7540 -4.4031 -4.4031 -3.6856 -3.6856 -3.0336 -3.0336 -2.3251 -2.3251 -1.8315 -1.8315 -1.3453 -1.3453 -1.1803 -1.1803 -0.5505 -0.5505 -0.2073 -0.2073 0.5443 0.5443 0.6703 0.6703 0.8830 0.8830 1.1026 1.1026 1.9636 1.9636 2.8403 2.8403 3.0987 3.0987 k = 0.2875-0.1266-0.0208 ( 16301 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3159 -11.3159 -11.1228 -11.1228 -8.7104 -8.7104 -8.5369 -8.5369 -6.3487 -6.3487 -5.5575 -5.5575 -5.3025 -5.3025 -5.1901 -5.1901 -4.7521 -4.7521 -4.3895 -4.3895 -3.6516 -3.6516 -3.0333 -3.0333 -2.3446 -2.3446 -1.8229 -1.8229 -1.3457 -1.3457 -1.1773 -1.1773 -0.5688 -0.5688 -0.1925 -0.1925 0.5467 0.5467 0.6690 0.6690 0.8887 0.8887 1.1044 1.1044 1.9774 1.9774 2.8283 2.8283 3.0842 3.0842 k = 0.2750-0.1211-0.0199 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.3273 -11.3273 -11.1269 -11.1269 -8.7117 -8.7117 -8.5266 -8.5266 -6.3707 -6.3707 -5.5486 -5.5486 -5.2874 -5.2874 -5.1923 -5.1923 -4.7498 -4.7498 -4.3751 -4.3751 -3.6178 -3.6178 -3.0323 -3.0323 -2.3647 -2.3647 -1.8140 -1.8140 -1.3466 -1.3466 -1.1731 -1.1731 -0.5871 -0.5871 -0.1774 -0.1774 0.5486 0.5486 0.6677 0.6677 0.8942 0.8942 1.1074 1.1074 1.9925 1.9925 2.8165 2.8165 3.0685 3.0685 k = 0.2625-0.1156-0.0190 ( 16291 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.3387 -11.3387 -11.1311 -11.1311 -8.7129 -8.7129 -8.5162 -8.5162 -6.3916 -6.3916 -5.5398 -5.5398 -5.2796 -5.2796 -5.1884 -5.1884 -4.7471 -4.7471 -4.3602 -4.3602 -3.5848 -3.5848 -3.0304 -3.0304 -2.3852 -2.3852 -1.8050 -1.8050 -1.3481 -1.3481 -1.1674 -1.1674 -0.6052 -0.6052 -0.1619 -0.1619 0.5502 0.5502 0.6658 0.6658 0.8985 0.8985 1.1104 1.1104 2.0085 2.0085 2.8048 2.8048 3.0518 3.0518 k = 0.2500-0.1101-0.0181 ( 16287 PWs) bands (ev): -70.4470 -70.4470 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3499 -11.3499 -11.1355 -11.1355 -8.7142 -8.7142 -8.5058 -8.5058 -6.4116 -6.4116 -5.5312 -5.5312 -5.2793 -5.2793 -5.1779 -5.1779 -4.7441 -4.7441 -4.3446 -4.3446 -3.5529 -3.5529 -3.0274 -3.0274 -2.4059 -2.4059 -1.7958 -1.7958 -1.3504 -1.3504 -1.1604 -1.1604 -0.6231 -0.6231 -0.1464 -0.1464 0.5509 0.5509 0.6639 0.6639 0.9025 0.9025 1.1140 1.1140 2.0256 2.0256 2.7935 2.7935 3.0340 3.0340 k = 0.2375-0.1046-0.0172 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6229 -41.6229 -41.4606 -41.4606 -11.3610 -11.3610 -11.1399 -11.1399 -8.7156 -8.7156 -8.4955 -8.4955 -6.4304 -6.4304 -5.5227 -5.5227 -5.2846 -5.2846 -5.1629 -5.1629 -4.7409 -4.7409 -4.3284 -4.3284 -3.5226 -3.5226 -3.0230 -3.0230 -2.4268 -2.4268 -1.7863 -1.7863 -1.3534 -1.3534 -1.1522 -1.1522 -0.6406 -0.6406 -0.1310 -0.1310 0.5501 0.5501 0.6615 0.6615 0.9050 0.9050 1.1180 1.1180 2.0432 2.0432 2.7825 2.7825 3.0154 3.0154 k = 0.2250-0.0991-0.0162 ( 16301 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6229 -41.6229 -41.4607 -41.4607 -11.3719 -11.3719 -11.1443 -11.1443 -8.7169 -8.7169 -8.4853 -8.4853 -6.4483 -6.4483 -5.5144 -5.5144 -5.2930 -5.2930 -5.1458 -5.1458 -4.7376 -4.7376 -4.3118 -4.3118 -3.4944 -3.4944 -3.0169 -3.0169 -2.4478 -2.4478 -1.7767 -1.7767 -1.3572 -1.3572 -1.1427 -1.1427 -0.6576 -0.6576 -0.1157 -0.1157 0.5490 0.5490 0.6589 0.6589 0.9070 0.9070 1.1220 1.1220 2.0612 2.0612 2.7722 2.7722 2.9960 2.9960 k = 0.2125-0.0936-0.0153 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3825 -11.3825 -11.1488 -11.1488 -8.7182 -8.7182 -8.4753 -8.4753 -6.4650 -6.4650 -5.5063 -5.5063 -5.3029 -5.3029 -5.1279 -5.1279 -4.7342 -4.7342 -4.2948 -4.2948 -3.4686 -3.4686 -3.0089 -3.0089 -2.4686 -2.4686 -1.7668 -1.7668 -1.3617 -1.3617 -1.1323 -1.1323 -0.6739 -0.6739 -0.1006 -0.1006 0.5475 0.5475 0.6567 0.6567 0.9088 0.9088 1.1271 1.1271 2.0807 2.0807 2.7625 2.7625 2.9761 2.9761 k = 0.2000-0.0881-0.0144 ( 16302 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3927 -11.3927 -11.1532 -11.1532 -8.7196 -8.7196 -8.4655 -8.4655 -6.4808 -6.4808 -5.4986 -5.4986 -5.3135 -5.3135 -5.1101 -5.1101 -4.7308 -4.7308 -4.2776 -4.2776 -3.4457 -3.4457 -2.9987 -2.9987 -2.4893 -2.4893 -1.7567 -1.7567 -1.3669 -1.3669 -1.1212 -1.1212 -0.6896 -0.6896 -0.0858 -0.0858 0.5452 0.5452 0.6537 0.6537 0.9098 0.9098 1.1314 1.1314 2.0997 2.0997 2.7535 2.7535 2.9556 2.9556 k = 0.1875-0.0826-0.0135 ( 16300 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4026 -11.4026 -11.1575 -11.1575 -8.7209 -8.7209 -8.4560 -8.4560 -6.4954 -6.4954 -5.4911 -5.4911 -5.3244 -5.3244 -5.0929 -5.0929 -4.7273 -4.7273 -4.2603 -4.2603 -3.4258 -3.4258 -2.9862 -2.9862 -2.5096 -2.5096 -1.7464 -1.7464 -1.3726 -1.3726 -1.1095 -1.1095 -0.7045 -0.7045 -0.0715 -0.0715 0.5416 0.5416 0.6511 0.6511 0.9104 0.9104 1.1367 1.1367 2.1203 2.1203 2.7453 2.7453 2.9349 2.9349 k = 0.1750-0.0771-0.0126 ( 16296 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4121 -11.4121 -11.1617 -11.1617 -8.7223 -8.7223 -8.4469 -8.4469 -6.5091 -6.5091 -5.4841 -5.4841 -5.3353 -5.3353 -5.0763 -5.0763 -4.7239 -4.7239 -4.2430 -4.2430 -3.4091 -3.4091 -2.9716 -2.9716 -2.5294 -2.5294 -1.7360 -1.7360 -1.3789 -1.3789 -1.0975 -1.0975 -0.7187 -0.7187 -0.0575 -0.0575 0.5380 0.5380 0.6483 0.6483 0.9104 0.9104 1.1419 1.1419 2.1415 2.1415 2.7381 2.7381 2.9140 2.9140 k = 0.1625-0.0716-0.0117 ( 16293 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4211 -11.4211 -11.1657 -11.1657 -8.7236 -8.7236 -8.4381 -8.4381 -6.5216 -6.5216 -5.4774 -5.4774 -5.3460 -5.3460 -5.0606 -5.0606 -4.7205 -4.7205 -4.2258 -4.2258 -3.3956 -3.3956 -2.9550 -2.9550 -2.5487 -2.5487 -1.7254 -1.7254 -1.3854 -1.3854 -1.0853 -1.0853 -0.7320 -0.7320 -0.0441 -0.0441 0.5336 0.5336 0.6460 0.6460 0.9104 0.9104 1.1473 1.1473 2.1620 2.1620 2.7318 2.7318 2.8929 2.8929 k = 0.1500-0.0661-0.0108 ( 16288 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4296 -11.4296 -11.1696 -11.1696 -8.7248 -8.7248 -8.4298 -8.4298 -6.5332 -6.5332 -5.4711 -5.4711 -5.3563 -5.3563 -5.0460 -5.0460 -4.7172 -4.7172 -4.2091 -4.2091 -3.3850 -3.3850 -2.9368 -2.9368 -2.5673 -2.5673 -1.7148 -1.7148 -1.3923 -1.3923 -1.0733 -1.0733 -0.7445 -0.7445 -0.0313 -0.0313 0.5284 0.5284 0.6436 0.6436 0.9104 0.9104 1.1522 1.1522 2.1833 2.1833 2.7264 2.7264 2.8719 2.8719 k = 0.1375-0.0606-0.0099 ( 16292 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4376 -11.4376 -11.1733 -11.1733 -8.7260 -8.7260 -8.4220 -8.4220 -6.5438 -6.5438 -5.4653 -5.4653 -5.3660 -5.3660 -5.0323 -5.0323 -4.7141 -4.7141 -4.1928 -4.1928 -3.3770 -3.3770 -2.9174 -2.9174 -2.5852 -2.5852 -1.7041 -1.7041 -1.3994 -1.3994 -1.0615 -1.0615 -0.7562 -0.7562 -0.0191 -0.0191 0.5227 0.5227 0.6409 0.6409 0.9102 0.9102 1.1568 1.1568 2.2033 2.2033 2.7219 2.7219 2.8511 2.8511 k = 0.1250-0.0551-0.0090 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4449 -11.4449 -11.1768 -11.1768 -8.7272 -8.7272 -8.4147 -8.4147 -6.5533 -6.5533 -5.4600 -5.4600 -5.3753 -5.3753 -5.0198 -5.0198 -4.7110 -4.7110 -4.1772 -4.1772 -3.3712 -3.3712 -2.8973 -2.8973 -2.6023 -2.6023 -1.6936 -1.6936 -1.4065 -1.4065 -1.0502 -1.0502 -0.7669 -0.7669 -0.0077 -0.0077 0.5162 0.5162 0.6384 0.6384 0.9095 0.9095 1.1613 1.1613 2.2238 2.2238 2.7183 2.7183 2.8307 2.8307 k = 0.1125-0.0496-0.0081 ( 16294 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4517 -11.4517 -11.1800 -11.1800 -8.7283 -8.7283 -8.4079 -8.4079 -6.5619 -6.5619 -5.4551 -5.4551 -5.3839 -5.3839 -5.0084 -5.0084 -4.7082 -4.7082 -4.1624 -4.1624 -3.3672 -3.3672 -2.8770 -2.8770 -2.6185 -2.6185 -1.6833 -1.6833 -1.4136 -1.4136 -1.0395 -1.0395 -0.7767 -0.7767 0.0029 0.0029 0.5098 0.5098 0.6362 0.6362 0.9090 0.9090 1.1655 1.1655 2.2435 2.2435 2.7155 2.7155 2.8108 2.8108 k = 0.1000-0.0440-0.0072 ( 16297 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4579 -11.4579 -11.1829 -11.1829 -8.7293 -8.7293 -8.4018 -8.4018 -6.5696 -6.5696 -5.4506 -5.4506 -5.3917 -5.3917 -4.9982 -4.9982 -4.7055 -4.7055 -4.1486 -4.1486 -3.3647 -3.3647 -2.8570 -2.8570 -2.6337 -2.6337 -1.6733 -1.6733 -1.4206 -1.4206 -1.0295 -1.0295 -0.7856 -0.7856 0.0127 0.0127 0.5035 0.5035 0.6341 0.6341 0.9082 0.9082 1.1692 1.1692 2.2622 2.2622 2.7135 2.7135 2.7917 2.7917 k = 0.0875-0.0385-0.0063 ( 16292 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4633 -11.4633 -11.1855 -11.1855 -8.7302 -8.7302 -8.3963 -8.3963 -6.5763 -6.5763 -5.4467 -5.4467 -5.3988 -5.3988 -4.9891 -4.9891 -4.7031 -4.7031 -4.1360 -4.1360 -3.3633 -3.3633 -2.8377 -2.8377 -2.6480 -2.6480 -1.6637 -1.6637 -1.4274 -1.4274 -1.0204 -1.0204 -0.7935 -0.7935 0.0216 0.0216 0.4976 0.4976 0.6324 0.6324 0.9079 0.9079 1.1728 1.1728 2.2803 2.2803 2.7121 2.7121 2.7737 2.7737 k = 0.0750-0.0330-0.0054 ( 16297 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4681 -11.4681 -11.1879 -11.1879 -8.7311 -8.7311 -8.3915 -8.3915 -6.5820 -6.5820 -5.4432 -5.4432 -5.4051 -5.4051 -4.9813 -4.9813 -4.7009 -4.7009 -4.1247 -4.1247 -3.3626 -3.3626 -2.8194 -2.8194 -2.6614 -2.6614 -1.6547 -1.6547 -1.4338 -1.4338 -1.0123 -1.0123 -0.8004 -0.8004 0.0294 0.0294 0.4919 0.4919 0.6301 0.6301 0.9070 0.9070 1.1758 1.1758 2.2970 2.2970 2.7111 2.7111 2.7570 2.7570 k = 0.0625-0.0275-0.0045 ( 16296 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4722 -11.4722 -11.1899 -11.1899 -8.7318 -8.7318 -8.3873 -8.3873 -6.5869 -6.5869 -5.4402 -5.4402 -5.4106 -5.4106 -4.9747 -4.9747 -4.6989 -4.6989 -4.1149 -4.1149 -3.3624 -3.3624 -2.8023 -2.8023 -2.6739 -2.6739 -1.6466 -1.6466 -1.4398 -1.4398 -1.0053 -1.0053 -0.8063 -0.8063 0.0362 0.0362 0.4869 0.4869 0.6287 0.6287 0.9066 0.9066 1.1785 1.1785 2.3120 2.3120 2.7105 2.7105 2.7421 2.7421 k = 0.0500-0.0220-0.0036 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4756 -11.4756 -11.1915 -11.1915 -8.7324 -8.7324 -8.3839 -8.3839 -6.5908 -6.5908 -5.4376 -5.4376 -5.4152 -5.4152 -4.9692 -4.9692 -4.6974 -4.6974 -4.1066 -4.1066 -3.3628 -3.3628 -2.7866 -2.7866 -2.6855 -2.6855 -1.6394 -1.6394 -1.4450 -1.4450 -0.9994 -0.9994 -0.8112 -0.8112 0.0418 0.0418 0.4821 0.4821 0.6269 0.6269 0.9060 0.9060 1.1801 1.1801 2.3241 2.3241 2.7096 2.7096 2.7294 2.7294 k = 0.0375-0.0165-0.0027 ( 16303 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4782 -11.4782 -11.1928 -11.1928 -8.7328 -8.7328 -8.3812 -8.3812 -6.5939 -6.5939 -5.4355 -5.4355 -5.4189 -5.4189 -4.9650 -4.9650 -4.6961 -4.6961 -4.1001 -4.1001 -3.3630 -3.3630 -2.7725 -2.7725 -2.6963 -2.6963 -1.6335 -1.6335 -1.4494 -1.4494 -0.9948 -0.9948 -0.8150 -0.8150 0.0463 0.0463 0.4792 0.4792 0.6253 0.6253 0.9061 0.9061 1.1817 1.1817 2.3355 2.3355 2.7077 2.7077 2.7206 2.7206 k = 0.0250-0.0110-0.0018 ( 16307 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4801 -11.4801 -11.1937 -11.1937 -8.7332 -8.7332 -8.3793 -8.3793 -6.5961 -6.5961 -5.4338 -5.4338 -5.4218 -5.4218 -4.9620 -4.9620 -4.6951 -4.6951 -4.0953 -4.0953 -3.3633 -3.3633 -2.7601 -2.7601 -2.7062 -2.7062 -1.6291 -1.6291 -1.4528 -1.4528 -0.9914 -0.9914 -0.8177 -0.8177 0.0495 0.0495 0.4762 0.4762 0.6240 0.6240 0.9057 0.9057 1.1832 1.1832 2.3434 2.3434 2.7038 2.7038 2.7164 2.7164 k = 0.0125-0.0055-0.0009 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4813 -11.4813 -11.1943 -11.1943 -8.7334 -8.7334 -8.3782 -8.3782 -6.5974 -6.5974 -5.4326 -5.4326 -5.4237 -5.4237 -4.9602 -4.9602 -4.6946 -4.6946 -4.0925 -4.0925 -3.3635 -3.3635 -2.7502 -2.7502 -2.7145 -2.7145 -1.6263 -1.6263 -1.4548 -1.4548 -0.9894 -0.9894 -0.8193 -0.8193 0.0514 0.0514 0.4747 0.4747 0.6238 0.6238 0.9055 0.9055 1.1841 1.1841 2.3483 2.3483 2.7001 2.7001 2.7150 2.7150 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k =-0.0122-0.0047 0.0039 ( 16312 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4813 -11.4813 -11.1944 -11.1944 -8.7333 -8.7333 -8.3777 -8.3777 -6.5972 -6.5972 -5.4324 -5.4324 -5.4244 -5.4244 -4.9601 -4.9601 -4.6951 -4.6951 -4.0931 -4.0931 -3.3626 -3.3626 -2.7454 -2.7454 -2.7191 -2.7191 -1.6259 -1.6259 -1.4556 -1.4556 -0.9894 -0.9894 -0.8191 -0.8191 0.0516 0.0516 0.4745 0.4745 0.6232 0.6232 0.9051 0.9051 1.1839 1.1839 2.3477 2.3477 2.6896 2.6896 2.7258 2.7258 k =-0.0244-0.0094 0.0078 ( 16307 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4803 -11.4803 -11.1941 -11.1941 -8.7328 -8.7328 -8.3776 -8.3776 -6.5956 -6.5956 -5.4332 -5.4332 -5.4245 -5.4245 -4.9617 -4.9617 -4.6972 -4.6972 -4.0979 -4.0979 -3.3595 -3.3595 -2.7442 -2.7442 -2.7209 -2.7209 -1.6276 -1.6276 -1.4557 -1.4557 -0.9915 -0.9915 -0.8167 -0.8167 0.0503 0.0503 0.4766 0.4766 0.6235 0.6235 0.9039 0.9039 1.1842 1.1842 2.3417 2.3417 2.6773 2.6773 2.7443 2.7443 k =-0.0366-0.0141 0.0116 ( 16316 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4787 -11.4787 -11.1937 -11.1937 -8.7320 -8.7320 -8.3773 -8.3773 -6.5928 -6.5928 -5.4346 -5.4346 -5.4245 -5.4245 -4.9644 -4.9644 -4.7007 -4.7007 -4.1058 -4.1058 -3.3547 -3.3547 -2.7436 -2.7436 -2.7226 -2.7226 -1.6303 -1.6303 -1.4559 -1.4559 -0.9950 -0.9950 -0.8130 -0.8130 0.0481 0.0481 0.4783 0.4783 0.6236 0.6236 0.9022 0.9022 1.1835 1.1835 2.3315 2.3315 2.6660 2.6660 2.7653 2.7653 k =-0.0488-0.0188 0.0155 ( 16308 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4764 -11.4764 -11.1931 -11.1931 -8.7310 -8.7310 -8.3770 -8.3770 -6.5889 -6.5889 -5.4365 -5.4365 -5.4246 -5.4246 -4.9681 -4.9681 -4.7055 -4.7055 -4.1166 -4.1166 -3.3479 -3.3479 -2.7458 -2.7458 -2.7217 -2.7217 -1.6341 -1.6341 -1.4561 -1.4561 -0.9997 -0.9997 -0.8078 -0.8078 0.0450 0.0450 0.4823 0.4823 0.6240 0.6240 0.9003 0.9003 1.1837 1.1837 2.3187 2.3187 2.6560 2.6560 2.7883 2.7883 k =-0.0610-0.0235 0.0194 ( 16317 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4736 -11.4736 -11.1923 -11.1923 -8.7296 -8.7296 -8.3765 -8.3765 -6.5839 -6.5839 -5.4391 -5.4391 -5.4246 -5.4246 -4.9728 -4.9728 -4.7117 -4.7117 -4.1302 -4.1302 -3.3398 -3.3398 -2.7518 -2.7518 -2.7173 -2.7173 -1.6388 -1.6388 -1.4565 -1.4565 -1.0057 -1.0057 -0.8013 -0.8013 0.0411 0.0411 0.4857 0.4857 0.6241 0.6241 0.8974 0.8974 1.1830 1.1830 2.3025 2.3025 2.6471 2.6471 2.8129 2.8129 k =-0.0732-0.0282 0.0233 ( 16304 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4701 -11.4701 -11.1913 -11.1913 -8.7279 -8.7279 -8.3760 -8.3760 -6.5778 -6.5778 -5.4423 -5.4423 -5.4246 -5.4246 -4.9785 -4.9785 -4.7190 -4.7190 -4.1462 -4.1462 -3.3304 -3.3304 -2.7608 -2.7608 -2.7100 -2.7100 -1.6444 -1.6444 -1.4570 -1.4570 -1.0129 -1.0129 -0.7935 -0.7935 0.0365 0.0365 0.4909 0.4909 0.6253 0.6253 0.8947 0.8947 1.1834 1.1834 2.2846 2.2846 2.6391 2.6391 2.8390 2.8390 k =-0.0854-0.0329 0.0271 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4659 -11.4659 -11.1902 -11.1902 -8.7260 -8.7260 -8.3753 -8.3753 -6.5706 -6.5706 -5.4460 -5.4460 -5.4246 -5.4246 -4.9852 -4.9852 -4.7276 -4.7276 -4.1645 -4.1645 -3.3201 -3.3201 -2.7716 -2.7716 -2.7009 -2.7009 -1.6507 -1.6507 -1.4576 -1.4576 -1.0211 -1.0211 -0.7846 -0.7846 0.0311 0.0311 0.4968 0.4968 0.6256 0.6256 0.8912 0.8912 1.1830 1.1830 2.2649 2.2649 2.6318 2.6318 2.8662 2.8662 k =-0.0976-0.0376 0.0310 ( 16297 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4613 -11.4613 -11.1890 -11.1890 -8.7238 -8.7238 -8.3746 -8.3746 -6.5623 -6.5623 -5.4504 -5.4504 -5.4247 -5.4247 -4.9928 -4.9928 -4.7373 -4.7373 -4.1847 -4.1847 -3.3092 -3.3092 -2.7836 -2.7836 -2.6903 -2.6903 -1.6577 -1.6577 -1.4583 -1.4583 -1.0302 -1.0302 -0.7748 -0.7748 0.0251 0.0251 0.5024 0.5024 0.6266 0.6266 0.8874 0.8874 1.1825 1.1825 2.2438 2.2438 2.6251 2.6251 2.8944 2.8944 k =-0.1098-0.0424 0.0349 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4560 -11.4560 -11.1876 -11.1876 -8.7213 -8.7213 -8.3738 -8.3738 -6.5530 -6.5530 -5.4555 -5.4555 -5.4247 -5.4247 -5.0013 -5.0013 -4.7480 -4.7480 -4.2067 -4.2067 -3.2982 -3.2982 -2.7963 -2.7963 -2.6785 -2.6785 -1.6653 -1.6653 -1.4592 -1.4592 -1.0403 -1.0403 -0.7642 -0.7642 0.0185 0.0185 0.5082 0.5082 0.6273 0.6273 0.8826 0.8826 1.1821 1.1821 2.2214 2.2214 2.6188 2.6188 2.9231 2.9231 k =-0.1220-0.0471 0.0388 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4502 -11.4502 -11.1861 -11.1861 -8.7186 -8.7186 -8.3729 -8.3729 -6.5425 -6.5425 -5.4611 -5.4611 -5.4249 -5.4249 -5.0108 -5.0108 -4.7596 -4.7596 -4.2301 -4.2301 -3.2876 -3.2876 -2.8092 -2.8092 -2.6658 -2.6658 -1.6733 -1.6733 -1.4603 -1.4603 -1.0511 -1.0511 -0.7529 -0.7529 0.0113 0.0113 0.5143 0.5143 0.6284 0.6284 0.8777 0.8777 1.1813 1.1813 2.1985 2.1985 2.6131 2.6131 2.9523 2.9523 k =-0.1341-0.0518 0.0426 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4439 -11.4439 -11.1844 -11.1844 -8.7157 -8.7157 -8.3719 -8.3719 -6.5310 -6.5310 -5.4674 -5.4674 -5.4251 -5.4251 -5.0210 -5.0210 -4.7721 -4.7721 -4.2548 -4.2548 -3.2776 -3.2776 -2.8218 -2.8218 -2.6522 -2.6522 -1.6817 -1.6817 -1.4615 -1.4615 -1.0626 -1.0626 -0.7411 -0.7411 0.0036 0.0036 0.5200 0.5200 0.6291 0.6291 0.8724 0.8724 1.1805 1.1805 2.1750 2.1750 2.6079 2.6079 2.9817 2.9817 k =-0.1463-0.0565 0.0465 ( 16300 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4371 -11.4371 -11.1827 -11.1827 -8.7126 -8.7126 -8.3709 -8.3709 -6.5184 -6.5184 -5.4744 -5.4744 -5.4254 -5.4254 -5.0320 -5.0320 -4.7853 -4.7853 -4.2805 -4.2805 -3.2690 -3.2690 -2.8335 -2.8335 -2.6379 -2.6379 -1.6903 -1.6903 -1.4630 -1.4630 -1.0746 -1.0746 -0.7287 -0.7287 -0.0045 -0.0045 0.5252 0.5252 0.6308 0.6308 0.8673 0.8673 1.1806 1.1806 2.1515 2.1515 2.6033 2.6033 3.0111 3.0111 k =-0.1585-0.0612 0.0504 ( 16303 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4299 -11.4299 -11.1808 -11.1808 -8.7092 -8.7092 -8.3698 -8.3698 -6.5048 -6.5048 -5.4820 -5.4820 -5.4258 -5.4258 -5.0437 -5.0437 -4.7991 -4.7991 -4.3069 -4.3069 -3.2622 -3.2622 -2.8438 -2.8438 -2.6230 -2.6230 -1.6989 -1.6989 -1.4646 -1.4646 -1.0872 -1.0872 -0.7162 -0.7162 -0.0130 -0.0130 0.5294 0.5294 0.6326 0.6326 0.8613 0.8613 1.1804 1.1804 2.1277 2.1277 2.5994 2.5994 3.0403 3.0403 k =-0.1707-0.0659 0.0543 ( 16302 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4223 -11.4223 -11.1789 -11.1789 -8.7057 -8.7057 -8.3686 -8.3686 -6.4902 -6.4902 -5.4902 -5.4902 -5.4263 -5.4263 -5.0561 -5.0561 -4.8134 -4.8134 -4.3339 -4.3339 -3.2579 -3.2579 -2.8519 -2.8519 -2.6077 -2.6077 -1.7076 -1.7076 -1.4663 -1.4663 -1.1002 -1.1002 -0.7034 -0.7034 -0.0218 -0.0218 0.5329 0.5329 0.6347 0.6347 0.8556 0.8556 1.1806 1.1806 2.1043 2.1043 2.5962 2.5962 3.0692 3.0692 k =-0.1829-0.0706 0.0581 ( 16298 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4143 -11.4143 -11.1769 -11.1769 -8.7021 -8.7021 -8.3674 -8.3674 -6.4746 -6.4746 -5.4992 -5.4992 -5.4269 -5.4269 -5.0692 -5.0692 -4.8281 -4.8281 -4.3613 -4.3613 -3.2564 -3.2564 -2.8574 -2.8574 -2.5921 -2.5921 -1.7162 -1.7162 -1.4682 -1.4682 -1.1134 -1.1134 -0.6906 -0.6906 -0.0308 -0.0308 0.5360 0.5360 0.6377 0.6377 0.8497 0.8497 1.1811 1.1811 2.0807 2.0807 2.5936 2.5936 3.0973 3.0973 k =-0.1951-0.0753 0.0620 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4059 -11.4059 -11.1748 -11.1748 -8.6983 -8.6983 -8.3661 -8.3661 -6.4581 -6.4581 -5.5088 -5.5088 -5.4277 -5.4277 -5.0827 -5.0827 -4.8432 -4.8432 -4.3889 -4.3889 -3.2582 -3.2582 -2.8600 -2.8600 -2.5763 -2.5763 -1.7246 -1.7246 -1.4703 -1.4703 -1.1269 -1.1269 -0.6779 -0.6779 -0.0401 -0.0401 0.5380 0.5380 0.6411 0.6411 0.8439 0.8439 1.1817 1.1817 2.0578 2.0578 2.5920 2.5920 3.1248 3.1248 k =-0.2073-0.0800 0.0659 ( 16293 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3972 -11.3972 -11.1728 -11.1728 -8.6943 -8.6943 -8.3648 -8.3648 -6.4406 -6.4406 -5.5190 -5.5190 -5.4287 -5.4287 -5.0967 -5.0967 -4.8584 -4.8584 -4.4165 -4.4165 -3.2632 -3.2632 -2.8595 -2.8595 -2.5604 -2.5604 -1.7328 -1.7328 -1.4725 -1.4725 -1.1406 -1.1406 -0.6655 -0.6655 -0.0495 -0.0495 0.5379 0.5379 0.6450 0.6450 0.8379 0.8379 1.1819 1.1819 2.0356 2.0356 2.5914 2.5914 3.1511 3.1511 k =-0.2195-0.0847 0.0698 ( 16285 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3883 -11.3883 -11.1706 -11.1706 -8.6903 -8.6903 -8.3635 -8.3635 -6.4222 -6.4222 -5.5300 -5.5300 -5.4298 -5.4298 -5.1111 -5.1111 -4.8737 -4.8737 -4.4439 -4.4439 -3.2714 -3.2714 -2.8560 -2.8560 -2.5445 -2.5445 -1.7406 -1.7406 -1.4747 -1.4747 -1.1543 -1.1543 -0.6533 -0.6533 -0.0589 -0.0589 0.5372 0.5372 0.6495 0.6495 0.8324 0.8324 1.1832 1.1832 2.0139 2.0139 2.5918 2.5918 3.1763 3.1763 k =-0.2317-0.0894 0.0736 ( 16284 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3791 -11.3791 -11.1685 -11.1685 -8.6862 -8.6862 -8.3622 -8.3622 -6.4030 -6.4030 -5.5416 -5.5416 -5.4312 -5.4312 -5.1258 -5.1258 -4.8891 -4.8891 -4.4710 -4.4710 -3.2826 -3.2826 -2.8499 -2.8499 -2.5286 -2.5286 -1.7481 -1.7481 -1.4770 -1.4770 -1.1681 -1.1681 -0.6415 -0.6415 -0.0683 -0.0683 0.5347 0.5347 0.6545 0.6545 0.8264 0.8264 1.1844 1.1844 1.9928 1.9928 2.5933 2.5933 3.2000 3.2000 k =-0.2439-0.0941 0.0775 ( 16288 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3698 -11.3698 -11.1664 -11.1664 -8.6820 -8.6820 -8.3609 -8.3609 -6.3830 -6.3830 -5.5538 -5.5538 -5.4327 -5.4327 -5.1407 -5.1407 -4.9044 -4.9044 -4.4976 -4.4976 -3.2963 -3.2963 -2.8415 -2.8415 -2.5129 -2.5129 -1.7552 -1.7552 -1.4792 -1.4792 -1.1818 -1.1818 -0.6302 -0.6302 -0.0776 -0.0776 0.5307 0.5307 0.6595 0.6595 0.8206 0.8206 1.1859 1.1859 1.9721 1.9721 2.5958 2.5958 3.2221 3.2221 k =-0.2561-0.0988 0.0814 ( 16293 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3604 -11.3604 -11.1644 -11.1644 -8.6778 -8.6778 -8.3595 -8.3595 -6.3623 -6.3623 -5.5667 -5.5667 -5.4345 -5.4345 -5.1557 -5.1557 -4.9196 -4.9196 -4.5236 -4.5236 -3.3120 -3.3120 -2.8314 -2.8314 -2.4972 -2.4972 -1.7618 -1.7618 -1.4814 -1.4814 -1.1955 -1.1955 -0.6195 -0.6195 -0.0868 -0.0868 0.5257 0.5257 0.6645 0.6645 0.8147 0.8147 1.1879 1.1879 1.9522 1.9522 2.5996 2.5996 3.2424 3.2424 k =-0.2683-0.1035 0.0853 ( 16303 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3509 -11.3509 -11.1624 -11.1624 -8.6735 -8.6735 -8.3582 -8.3582 -6.3409 -6.3409 -5.5802 -5.5802 -5.4365 -5.4365 -5.1707 -5.1707 -4.9347 -4.9347 -4.5488 -4.5488 -3.3291 -3.3291 -2.8202 -2.8202 -2.4817 -2.4817 -1.7679 -1.7679 -1.4835 -1.4835 -1.2090 -1.2090 -0.6095 -0.6095 -0.0957 -0.0957 0.5195 0.5195 0.6687 0.6687 0.8091 0.8091 1.1899 1.1899 1.9336 1.9336 2.6046 2.6046 3.2608 3.2608 k =-0.2805-0.1082 0.0891 ( 16309 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3413 -11.3413 -11.1605 -11.1605 -8.6693 -8.6693 -8.3569 -8.3569 -6.3189 -6.3189 -5.5943 -5.5943 -5.4387 -5.4387 -5.1857 -5.1857 -4.9495 -4.9495 -4.5732 -4.5732 -3.3471 -3.3471 -2.8082 -2.8082 -2.4664 -2.4664 -1.7735 -1.7735 -1.4855 -1.4855 -1.2224 -1.2224 -0.6001 -0.6001 -0.1043 -0.1043 0.5123 0.5123 0.6730 0.6730 0.8038 0.8038 1.1930 1.1930 1.9160 1.9160 2.6110 2.6110 3.2772 3.2772 k =-0.2927-0.1129 0.0930 ( 16310 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3318 -11.3318 -11.1587 -11.1587 -8.6651 -8.6651 -8.3557 -8.3557 -6.2964 -6.2964 -5.6089 -5.6089 -5.4410 -5.4410 -5.2005 -5.2005 -4.9640 -4.9640 -4.5965 -4.5965 -3.3657 -3.3657 -2.7961 -2.7961 -2.4514 -2.4514 -1.7785 -1.7785 -1.4873 -1.4873 -1.2355 -1.2355 -0.5913 -0.5913 -0.1125 -0.1125 0.5043 0.5043 0.6774 0.6774 0.7989 0.7989 1.1968 1.1968 1.8996 1.8996 2.6188 2.6188 3.2913 3.2913 k =-0.3049-0.1177 0.0969 ( 16307 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3223 -11.3223 -11.1570 -11.1570 -8.6609 -8.6609 -8.3544 -8.3544 -6.2735 -6.2735 -5.6240 -5.6240 -5.4435 -5.4435 -5.2150 -5.2150 -4.9781 -4.9781 -4.6187 -4.6187 -3.3845 -3.3845 -2.7841 -2.7841 -2.4365 -2.4365 -1.7830 -1.7830 -1.4888 -1.4888 -1.2484 -1.2484 -0.5833 -0.5833 -0.1202 -0.1202 0.4960 0.4960 0.6819 0.6819 0.7944 0.7944 1.2008 1.2008 1.8846 1.8846 2.6279 2.6279 3.3032 3.3032 k =-0.3171-0.1224 0.1008 ( 16305 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.3130 -11.3130 -11.1554 -11.1554 -8.6567 -8.6567 -8.3533 -8.3533 -6.2502 -6.2502 -5.6395 -5.6395 -5.4462 -5.4462 -5.2293 -5.2293 -4.9919 -4.9919 -4.6398 -4.6398 -3.4032 -3.4032 -2.7725 -2.7725 -2.4219 -2.4219 -1.7870 -1.7870 -1.4900 -1.4900 -1.2610 -1.2610 -0.5761 -0.5761 -0.1273 -0.1273 0.4870 0.4870 0.6861 0.6861 0.7901 0.7901 1.2052 1.2052 1.8705 1.8705 2.6384 2.6384 3.3127 3.3127 k =-0.3293-0.1271 0.1046 ( 16311 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.3038 -11.3038 -11.1540 -11.1540 -8.6527 -8.6527 -8.3521 -8.3521 -6.2266 -6.2266 -5.6554 -5.6554 -5.4488 -5.4488 -5.2432 -5.2432 -5.0051 -5.0051 -4.6596 -4.6596 -3.4216 -3.4216 -2.7616 -2.7616 -2.4075 -2.4075 -1.7904 -1.7904 -1.4910 -1.4910 -1.2732 -1.2732 -0.5696 -0.5696 -0.1339 -0.1339 0.4771 0.4771 0.6894 0.6894 0.7855 0.7855 1.2100 1.2100 1.8573 1.8573 2.6502 2.6502 3.3198 3.3198 k =-0.3415-0.1318 0.1085 ( 16310 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2948 -11.2948 -11.1527 -11.1527 -8.6488 -8.6488 -8.3511 -8.3511 -6.2029 -6.2029 -5.6717 -5.6717 -5.4515 -5.4515 -5.2567 -5.2567 -5.0179 -5.0179 -4.6781 -4.6781 -3.4395 -3.4395 -2.7516 -2.7516 -2.3935 -2.3935 -1.7933 -1.7933 -1.4916 -1.4916 -1.2851 -1.2851 -0.5637 -0.5637 -0.1397 -0.1397 0.4671 0.4671 0.6923 0.6923 0.7817 0.7817 1.2156 1.2156 1.8455 1.8455 2.6633 2.6633 3.3244 3.3244 k =-0.3537-0.1365 0.1124 ( 16305 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2861 -11.2861 -11.1517 -11.1517 -8.6450 -8.6450 -8.3501 -8.3501 -6.1791 -6.1791 -5.6881 -5.6881 -5.4541 -5.4541 -5.2697 -5.2697 -5.0300 -5.0300 -4.6952 -4.6952 -3.4565 -3.4565 -2.7426 -2.7426 -2.3799 -2.3799 -1.7957 -1.7957 -1.4919 -1.4919 -1.2966 -1.2966 -0.5587 -0.5587 -0.1449 -0.1449 0.4568 0.4568 0.6953 0.6953 0.7783 0.7783 1.2212 1.2212 1.8351 1.8351 2.6776 2.6776 3.3267 3.3267 k =-0.3659-0.1412 0.1163 ( 16307 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2778 -11.2778 -11.1508 -11.1508 -8.6414 -8.6414 -8.3491 -8.3491 -6.1554 -6.1554 -5.7048 -5.7048 -5.4565 -5.4565 -5.2824 -5.2824 -5.0415 -5.0415 -4.7110 -4.7110 -3.4727 -3.4727 -2.7346 -2.7346 -2.3667 -2.3667 -1.7976 -1.7976 -1.4919 -1.4919 -1.3076 -1.3076 -0.5543 -0.5543 -0.1494 -0.1494 0.4464 0.4464 0.6973 0.6973 0.7749 0.7749 1.2265 1.2265 1.8258 1.8258 2.6927 2.6927 3.3266 3.3266 k =-0.3780-0.1459 0.1201 ( 16302 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2698 -11.2698 -11.1501 -11.1501 -8.6380 -8.6380 -8.3483 -8.3483 -6.1319 -6.1319 -5.7216 -5.7216 -5.4587 -5.4587 -5.2945 -5.2945 -5.0522 -5.0522 -4.7253 -4.7253 -3.4879 -3.4879 -2.7277 -2.7277 -2.3541 -2.3541 -1.7991 -1.7991 -1.4916 -1.4916 -1.3181 -1.3181 -0.5506 -0.5506 -0.1531 -0.1531 0.4363 0.4363 0.6997 0.6997 0.7723 0.7723 1.2318 1.2318 1.8175 1.8175 2.7089 2.7089 3.3244 3.3244 k =-0.3902-0.1506 0.1240 ( 16309 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2623 -11.2623 -11.1496 -11.1496 -8.6349 -8.6349 -8.3475 -8.3475 -6.1086 -6.1086 -5.7385 -5.7385 -5.4606 -5.4606 -5.3061 -5.3061 -5.0621 -5.0621 -4.7383 -4.7383 -3.5019 -3.5019 -2.7219 -2.7219 -2.3423 -2.3423 -1.8002 -1.8002 -1.4909 -1.4909 -1.3281 -1.3281 -0.5476 -0.5476 -0.1563 -0.1563 0.4259 0.4259 0.7013 0.7013 0.7692 0.7692 1.2363 1.2363 1.8101 1.8101 2.7257 2.7257 3.3201 3.3201 k =-0.4024-0.1553 0.1279 ( 16305 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2553 -11.2553 -11.1493 -11.1493 -8.6320 -8.6320 -8.3468 -8.3468 -6.0857 -6.0857 -5.7554 -5.7554 -5.4621 -5.4621 -5.3172 -5.3172 -5.0711 -5.0711 -4.7498 -4.7498 -3.5147 -3.5147 -2.7170 -2.7170 -2.3312 -2.3312 -1.8009 -1.8009 -1.4900 -1.4900 -1.3374 -1.3374 -0.5450 -0.5450 -0.1587 -0.1587 0.4163 0.4163 0.7028 0.7028 0.7674 0.7674 1.2411 1.2411 1.8041 1.8041 2.7427 2.7427 3.3142 3.3142 k =-0.4146-0.1600 0.1318 ( 16302 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2488 -11.2488 -11.1492 -11.1492 -8.6293 -8.6293 -8.3462 -8.3462 -6.0633 -6.0633 -5.7723 -5.7723 -5.4631 -5.4631 -5.3277 -5.3277 -5.0792 -5.0792 -4.7599 -4.7599 -3.5261 -3.5261 -2.7130 -2.7130 -2.3211 -2.3211 -1.8014 -1.8014 -1.4889 -1.4889 -1.3460 -1.3460 -0.5430 -0.5430 -0.1606 -0.1606 0.4071 0.4071 0.7044 0.7044 0.7656 0.7656 1.2455 1.2455 1.7988 1.7988 2.7599 2.7599 3.3069 3.3069 k =-0.4268-0.1647 0.1356 ( 16307 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2430 -11.2430 -11.1492 -11.1492 -8.6270 -8.6270 -8.3456 -8.3456 -6.0417 -6.0417 -5.7890 -5.7890 -5.4637 -5.4637 -5.3374 -5.3374 -5.0863 -5.0863 -4.7687 -4.7687 -3.5362 -3.5362 -2.7098 -2.7098 -2.3121 -2.3121 -1.8017 -1.8017 -1.4876 -1.4876 -1.3539 -1.3539 -0.5414 -0.5414 -0.1620 -0.1620 0.3984 0.3984 0.7050 0.7050 0.7638 0.7638 1.2490 1.2490 1.7945 1.7945 2.7766 2.7766 3.2986 3.2986 k =-0.4390-0.1694 0.1395 ( 16306 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2379 -11.2379 -11.1493 -11.1493 -8.6249 -8.6249 -8.3452 -8.3452 -6.0208 -6.0208 -5.8055 -5.8055 -5.4638 -5.4638 -5.3462 -5.3462 -5.0924 -5.0924 -4.7760 -4.7760 -3.5448 -3.5448 -2.7073 -2.7073 -2.3042 -2.3042 -1.8018 -1.8018 -1.4863 -1.4863 -1.3608 -1.3608 -0.5401 -0.5401 -0.1630 -0.1630 0.3910 0.3910 0.7060 0.7060 0.7626 0.7626 1.2522 1.2522 1.7909 1.7909 2.7924 2.7924 3.2899 3.2899 k =-0.4512-0.1741 0.1434 ( 16309 PWs) bands (ev): -70.4474 -70.4474 -42.5423 -42.5423 -41.6229 -41.6229 -41.4610 -41.4610 -11.2335 -11.2335 -11.1495 -11.1495 -8.6233 -8.6233 -8.3448 -8.3448 -6.0011 -6.0011 -5.8216 -5.8216 -5.4635 -5.4635 -5.3540 -5.3540 -5.0974 -5.0974 -4.7820 -4.7820 -3.5519 -3.5519 -2.7054 -2.7054 -2.2976 -2.2976 -1.8018 -1.8018 -1.4849 -1.4849 -1.3668 -1.3668 -0.5392 -0.5392 -0.1637 -0.1637 0.3846 0.3846 0.7066 0.7066 0.7613 0.7613 1.2545 1.2545 1.7883 1.7883 2.8066 2.8066 3.2814 3.2814 k =-0.4634-0.1788 0.1473 ( 16314 PWs) bands (ev): -70.4475 -70.4475 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.2301 -11.2301 -11.1498 -11.1498 -8.6219 -8.6219 -8.3445 -8.3445 -5.9830 -5.9830 -5.8368 -5.8368 -5.4630 -5.4630 -5.3605 -5.3605 -5.1013 -5.1013 -4.7867 -4.7867 -3.5575 -3.5575 -2.7040 -2.7040 -2.2924 -2.2924 -1.8017 -1.8017 -1.4837 -1.4837 -1.3716 -1.3716 -0.5387 -0.5387 -0.1641 -0.1641 0.3794 0.3794 0.7070 0.7070 0.7603 0.7603 1.2562 1.2562 1.7858 1.7858 2.8187 2.8187 3.2738 3.2738 k =-0.4756-0.1835 0.1512 ( 16313 PWs) bands (ev): -70.4474 -70.4474 -42.5424 -42.5424 -41.6230 -41.6230 -41.4610 -41.4610 -11.2275 -11.2275 -11.1500 -11.1500 -8.6210 -8.6210 -8.3443 -8.3443 -5.9673 -5.9673 -5.8503 -5.8503 -5.4625 -5.4625 -5.3654 -5.3654 -5.1041 -5.1041 -4.7900 -4.7900 -3.5615 -3.5615 -2.7031 -2.7031 -2.2887 -2.2887 -1.8016 -1.8016 -1.4827 -1.4827 -1.3751 -1.3751 -0.5383 -0.5383 -0.1643 -0.1643 0.3756 0.3756 0.7076 0.7076 0.7597 0.7597 1.2579 1.2579 1.7841 1.7841 2.8280 2.8280 3.2677 3.2677 k =-0.4878-0.1882 0.1550 ( 16316 PWs) bands (ev): -70.4475 -70.4475 -42.5424 -42.5424 -41.6230 -41.6230 -41.4611 -41.4611 -11.2260 -11.2260 -11.1501 -11.1501 -8.6204 -8.6204 -8.3442 -8.3442 -5.9558 -5.9558 -5.8605 -5.8605 -5.4620 -5.4620 -5.3685 -5.3685 -5.1058 -5.1058 -4.7920 -4.7920 -3.5638 -3.5638 -2.7026 -2.7026 -2.2864 -2.2864 -1.8016 -1.8016 -1.4821 -1.4821 -1.3773 -1.3773 -0.5380 -0.5380 -0.1644 -0.1644 0.3729 0.3729 0.7077 0.7077 0.7594 0.7594 1.2591 1.2591 1.7830 1.7830 2.8335 2.8335 3.2638 3.2638 k =-0.5000-0.1930 0.1589 ( 16316 PWs) bands (ev): -70.4475 -70.4475 -42.5424 -42.5424 -41.6230 -41.6230 -41.4611 -41.4611 -11.2254 -11.2254 -11.1502 -11.1502 -8.6202 -8.6202 -8.3441 -8.3441 -5.9514 -5.9514 -5.8645 -5.8645 -5.4619 -5.4619 -5.3695 -5.3695 -5.1064 -5.1064 -4.7927 -4.7927 -3.5647 -3.5647 -2.7024 -2.7024 -2.2856 -2.2856 -1.8016 -1.8016 -1.4819 -1.4819 -1.3780 -1.3780 -0.5380 -0.5380 -0.1645 -0.1645 0.3720 0.3720 0.7080 0.7080 0.7592 0.7592 1.2594 1.2594 1.7827 1.7827 2.8355 2.8355 3.2624 3.2624 k =-0.5000-0.6061 0.0255 ( 16284 PWs) bands (ev): -70.4469 -70.4469 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1885 -11.1885 -11.0876 -11.0876 -8.8072 -8.8072 -8.5321 -8.5321 -5.9840 -5.9840 -5.8231 -5.8231 -5.4691 -5.4691 -5.1531 -5.1531 -4.7185 -4.7185 -4.4233 -4.4233 -4.1045 -4.1045 -2.6809 -2.6809 -2.6658 -2.6658 -2.0723 -2.0723 -1.1569 -1.1569 -1.0953 -1.0953 -0.5523 -0.5523 -0.0917 -0.0917 0.5302 0.5302 0.6836 0.6836 0.8313 0.8313 1.1212 1.1212 1.8366 1.8366 3.0094 3.0094 3.2069 3.2069 k =-0.4912-0.5955 0.0251 ( 16294 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1886 -11.1886 -11.0876 -11.0876 -8.8074 -8.8074 -8.5321 -8.5321 -5.9841 -5.9841 -5.8227 -5.8227 -5.4691 -5.4691 -5.1535 -5.1535 -4.7209 -4.7209 -4.4237 -4.4237 -4.1008 -4.1008 -2.6816 -2.6816 -2.6648 -2.6648 -2.0721 -2.0721 -1.1580 -1.1580 -1.0945 -1.0945 -0.5518 -0.5518 -0.0917 -0.0917 0.5300 0.5300 0.6832 0.6832 0.8301 0.8301 1.1211 1.1211 1.8360 1.8360 3.0099 3.0099 3.2061 3.2061 k =-0.4825-0.5849 0.0246 ( 16297 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1890 -11.1890 -11.0876 -11.0876 -8.8079 -8.8079 -8.5323 -8.5323 -5.9844 -5.9844 -5.8215 -5.8215 -5.4693 -5.4693 -5.1547 -5.1547 -4.7278 -4.7278 -4.4246 -4.4246 -4.0901 -4.0901 -2.6832 -2.6832 -2.6621 -2.6621 -2.0714 -2.0714 -1.1613 -1.1613 -1.0921 -1.0921 -0.5502 -0.5502 -0.0918 -0.0918 0.5309 0.5309 0.6841 0.6841 0.8281 0.8281 1.1201 1.1201 1.8359 1.8359 3.0114 3.0114 3.2041 3.2041 k =-0.4737-0.5742 0.0242 ( 16295 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1895 -11.1895 -11.0876 -11.0876 -8.8087 -8.8087 -8.5326 -8.5326 -5.9850 -5.9850 -5.8196 -5.8196 -5.4696 -5.4696 -5.1566 -5.1566 -4.7387 -4.7387 -4.4261 -4.4261 -4.0729 -4.0729 -2.6851 -2.6851 -2.6585 -2.6585 -2.0703 -2.0703 -1.1664 -1.1664 -1.0885 -1.0885 -0.5474 -0.5474 -0.0918 -0.0918 0.5324 0.5324 0.6858 0.6858 0.8252 0.8252 1.1187 1.1187 1.8366 1.8366 3.0140 3.0140 3.2007 3.2007 k =-0.4649-0.5636 0.0237 ( 16290 PWs) bands (ev): -70.4470 -70.4470 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1903 -11.1903 -11.0877 -11.0877 -8.8099 -8.8099 -8.5330 -8.5330 -5.9858 -5.9858 -5.8170 -5.8170 -5.4701 -5.4701 -5.1592 -5.1592 -4.7526 -4.7526 -4.4284 -4.4284 -4.0499 -4.0499 -2.6870 -2.6870 -2.6542 -2.6542 -2.0686 -2.0686 -1.1731 -1.1731 -1.0838 -1.0838 -0.5433 -0.5433 -0.0919 -0.0919 0.5341 0.5341 0.6881 0.6881 0.8215 0.8215 1.1173 1.1173 1.8376 1.8376 3.0175 3.0175 3.1959 3.1959 k =-0.4561-0.5530 0.0233 ( 16296 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6230 -41.6230 -41.4609 -41.4609 -11.1912 -11.1912 -11.0877 -11.0877 -8.8114 -8.8114 -8.5334 -8.5334 -5.9869 -5.9869 -5.8138 -5.8138 -5.4706 -5.4706 -5.1627 -5.1627 -4.7686 -4.7686 -4.4312 -4.4312 -4.0222 -4.0222 -2.6889 -2.6889 -2.6495 -2.6495 -2.0665 -2.0665 -1.1811 -1.1811 -1.0786 -1.0786 -0.5383 -0.5383 -0.0920 -0.0920 0.5360 0.5360 0.6897 0.6897 0.8161 0.8161 1.1157 1.1157 1.8382 1.8382 3.0220 3.0220 3.1898 3.1898 k =-0.4474-0.5423 0.0228 ( 16295 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1925 -11.1925 -11.0878 -11.0878 -8.8131 -8.8131 -8.5340 -8.5340 -5.9882 -5.9882 -5.8099 -5.8099 -5.4711 -5.4711 -5.1670 -5.1670 -4.7857 -4.7857 -4.4347 -4.4347 -3.9904 -3.9904 -2.6906 -2.6906 -2.6444 -2.6444 -2.0639 -2.0639 -1.1902 -1.1902 -1.0728 -1.0728 -0.5320 -0.5320 -0.0919 -0.0919 0.5384 0.5384 0.6923 0.6923 0.8097 0.8097 1.1143 1.1143 1.8392 1.8392 3.0273 3.0273 3.1825 3.1825 k =-0.4386-0.5317 0.0224 ( 16295 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1939 -11.1939 -11.0880 -11.0880 -8.8151 -8.8151 -8.5346 -8.5346 -5.9899 -5.9899 -5.8054 -5.8054 -5.4717 -5.4717 -5.1720 -5.1720 -4.8032 -4.8032 -4.4387 -4.4387 -3.9556 -3.9556 -2.6922 -2.6922 -2.6393 -2.6393 -2.0607 -2.0607 -1.2003 -1.2003 -1.0667 -1.0667 -0.5246 -0.5246 -0.0918 -0.0918 0.5414 0.5414 0.6951 0.6951 0.8018 0.8018 1.1127 1.1127 1.8404 1.8404 3.0334 3.0334 3.1740 3.1740 k =-0.4298-0.5211 0.0219 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1956 -11.1956 -11.0881 -11.0881 -8.8173 -8.8173 -8.5353 -8.5353 -5.9919 -5.9919 -5.8005 -5.8005 -5.4723 -5.4723 -5.1778 -5.1778 -4.8204 -4.8204 -4.4431 -4.4431 -3.9184 -3.9184 -2.6938 -2.6938 -2.6339 -2.6339 -2.0569 -2.0569 -1.2112 -1.2112 -1.0605 -1.0605 -0.5160 -0.5160 -0.0916 -0.0916 0.5444 0.5444 0.6976 0.6976 0.7936 0.7936 1.1112 1.1112 1.8424 1.8424 3.0402 3.0402 3.1645 3.1645 k =-0.4211-0.5104 0.0215 ( 16298 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1976 -11.1976 -11.0884 -11.0884 -8.8197 -8.8197 -8.5361 -8.5361 -5.9943 -5.9943 -5.7951 -5.7951 -5.4728 -5.4728 -5.1841 -5.1841 -4.8368 -4.8368 -4.4479 -4.4479 -3.8794 -3.8794 -2.6954 -2.6954 -2.6286 -2.6286 -2.0526 -2.0526 -1.2228 -1.2228 -1.0542 -1.0542 -0.5063 -0.5063 -0.0911 -0.0911 0.5472 0.5472 0.7004 0.7004 0.7845 0.7845 1.1089 1.1089 1.8440 1.8440 3.0475 3.0475 3.1540 3.1540 k =-0.4123-0.4998 0.0210 ( 16298 PWs) bands (ev): -70.4472 -70.4472 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.1999 -11.1999 -11.0887 -11.0887 -8.8223 -8.8223 -8.5368 -8.5368 -5.9973 -5.9973 -5.7892 -5.7892 -5.4732 -5.4732 -5.1910 -5.1910 -4.8519 -4.8519 -4.4530 -4.4530 -3.8391 -3.8391 -2.6971 -2.6971 -2.6232 -2.6232 -2.0478 -2.0478 -1.2350 -1.2350 -1.0480 -1.0480 -0.4955 -0.4955 -0.0904 -0.0904 0.5505 0.5505 0.7037 0.7037 0.7747 0.7747 1.1064 1.1064 1.8464 1.8464 3.0549 3.0549 3.1431 3.1431 k =-0.4035-0.4892 0.0206 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2024 -11.2024 -11.0890 -11.0890 -8.8249 -8.8249 -8.5376 -8.5376 -6.0009 -6.0009 -5.7830 -5.7830 -5.4735 -5.4735 -5.1982 -5.1982 -4.8656 -4.8656 -4.4583 -4.4583 -3.7978 -3.7978 -2.6990 -2.6990 -2.6178 -2.6178 -2.0425 -2.0425 -1.2477 -1.2477 -1.0420 -1.0420 -0.4835 -0.4835 -0.0895 -0.0895 0.5531 0.5531 0.7069 0.7069 0.7653 0.7653 1.1047 1.1047 1.8495 1.8495 3.0619 3.0619 3.1320 3.1320 k =-0.3947-0.4785 0.0201 ( 16299 PWs) bands (ev): -70.4473 -70.4473 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2052 -11.2052 -11.0894 -11.0894 -8.8276 -8.8276 -8.5383 -8.5383 -6.0053 -6.0053 -5.7764 -5.7764 -5.4736 -5.4736 -5.2055 -5.2055 -4.8777 -4.8777 -4.4637 -4.4637 -3.7561 -3.7561 -2.7012 -2.7012 -2.6125 -2.6125 -2.0367 -2.0367 -1.2606 -1.2606 -1.0363 -1.0363 -0.4706 -0.4706 -0.0883 -0.0883 0.5551 0.5551 0.7089 0.7089 0.7556 0.7556 1.1023 1.1023 1.8525 1.8525 3.0670 3.0670 3.1224 3.1224 k =-0.3860-0.4679 0.0197 ( 16293 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2084 -11.2084 -11.0900 -11.0900 -8.8304 -8.8304 -8.5390 -8.5390 -6.0106 -6.0106 -5.7695 -5.7695 -5.4735 -5.4735 -5.2126 -5.2126 -4.8881 -4.8881 -4.4690 -4.4690 -3.7143 -3.7143 -2.7037 -2.7037 -2.6073 -2.6073 -2.0305 -2.0305 -1.2738 -1.2738 -1.0311 -1.0311 -0.4566 -0.4566 -0.0868 -0.0868 0.5571 0.5571 0.7101 0.7101 0.7478 0.7478 1.1003 1.1003 1.8566 1.8566 3.0676 3.0676 3.1169 3.1169 k =-0.3772-0.4573 0.0193 ( 16293 PWs) bands (ev): -70.4471 -70.4471 -42.5423 -42.5423 -41.6229 -41.6229 -41.4609 -41.4609 -11.2119 -11.2119 -11.0906 -11.0906 -8.8330 -8.8330 -8.5397 -8.5397 -6.0169 -6.0169 -5.7622 -5.7622 -5.4730 -5.4730 -5.2192 -5.2192 -4.8968 -4.8968 -4.4742 -4.4742 -3.6725 -3.6725 -2.7066 -2.7066 -2.6021 -2.6021 -2.0240 -2.0240 -1.2869 -1.2869 -1.0263 -1.0263 -0.4418 -0.4418 -0.0849 -0.0849 0.5580 0.5580 0.7092 0.7092 0.7422 0.7422 1.0983 1.0983 1.8603 1.8603 3.0613 3.0613 3.1179 3.1179 k =-0.3684-0.4466 0.0188 ( 16290 PWs) bands (ev): -70.4470 -70.4470 -42.5423 -42.5423 -41.6229 -41.6229 -41.4608 -41.4608 -11.2157 -11.2157 -11.0913 -11.0913 -8.8356 -8.8356 -8.5402 -8.5402 -6.0244 -6.0244 -5.7545 -5.7545 -5.4723 -5.4723 -5.2251 -5.2251 -4.9040 -4.9040 -4.4792 -4.4792 -3.6311 -3.6311 -2.7100 -2.7100 -2.5971 -2.5971 -2.0172 -2.0172 -1.2999 -1.2999 -1.0222 -1.0222 -0.4264 -0.4264 -0.0827 -0.0827 0.5575 0.5575 0.7055 0.7055 0.7403 0.7403 1.0967 1.0967 1.8647 1.8647 3.0493 3.0493 3.1240 3.1240 k =-0.3596-0.4360 0.0184 ( 16285 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2198 -11.2198 -11.0922 -11.0922 -8.8381 -8.8381 -8.5406 -8.5406 -6.0332 -6.0332 -5.7464 -5.7464 -5.4711 -5.4711 -5.2300 -5.2300 -4.9097 -4.9097 -4.4839 -4.4839 -3.5903 -3.5903 -2.7138 -2.7138 -2.5921 -2.5921 -2.0103 -2.0103 -1.3126 -1.3126 -1.0187 -1.0187 -0.4105 -0.4105 -0.0801 -0.0801 0.5555 0.5555 0.7005 0.7005 0.7414 0.7414 1.0950 1.0950 1.8697 1.8697 3.0344 3.0344 3.1326 3.1326 k =-0.3509-0.4254 0.0179 ( 16274 PWs) bands (ev): -70.4466 -70.4466 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2243 -11.2243 -11.0932 -11.0932 -8.8403 -8.8403 -8.5408 -8.5408 -6.0434 -6.0434 -5.7379 -5.7379 -5.4695 -5.4695 -5.2337 -5.2337 -4.9140 -4.9140 -4.4882 -4.4882 -3.5503 -3.5503 -2.7182 -2.7182 -2.5874 -2.5874 -2.0033 -2.0033 -1.3249 -1.3249 -1.0159 -1.0159 -0.3944 -0.3944 -0.0771 -0.0771 0.5519 0.5519 0.6954 0.6954 0.7443 0.7443 1.0937 1.0937 1.8755 1.8755 3.0180 3.0180 3.1423 3.1423 k =-0.3421-0.4147 0.0175 ( 16273 PWs) bands (ev): -70.4466 -70.4466 -42.5422 -42.5422 -41.6228 -41.6228 -41.4608 -41.4608 -11.2291 -11.2291 -11.0943 -11.0943 -8.8424 -8.8424 -8.5409 -8.5409 -6.0550 -6.0550 -5.7290 -5.7290 -5.4676 -5.4676 -5.2361 -5.2361 -4.9171 -4.9171 -4.4920 -4.4920 -3.5113 -3.5113 -2.7230 -2.7230 -2.5829 -2.5829 -1.9962 -1.9962 -1.3366 -1.3366 -1.0137 -1.0137 -0.3783 -0.3783 -0.0738 -0.0738 0.5460 0.5460 0.6908 0.6908 0.7470 0.7470 1.0921 1.0921 1.8819 1.8819 3.0004 3.0004 3.1524 3.1524 k =-0.3333-0.4041 0.0170 ( 16268 PWs) bands (ev): -70.4465 -70.4465 -42.5422 -42.5422 -41.6227 -41.6227 -41.4608 -41.4608 -11.2343 -11.2343 -11.0956 -11.0956 -8.8442 -8.8442 -8.5407 -8.5407 -6.0682 -6.0682 -5.7195 -5.7195 -5.4652 -5.4652 -5.2371 -5.2371 -4.9190 -4.9190 -4.4953 -4.4953 -3.4735 -3.4735 -2.7283 -2.7283 -2.5786 -2.5786 -1.9892 -1.9892 -1.3475 -1.3475 -1.0123 -1.0123 -0.3627 -0.3627 -0.0699 -0.0699 0.5384 0.5384 0.6873 0.6873 0.7501 0.7501 1.0914 1.0914 1.8889 1.8889 2.9823 2.9823 3.1625 3.1625 k =-0.3246-0.3935 0.0166 ( 16270 PWs) bands (ev): -70.4465 -70.4465 -42.5421 -42.5421 -41.6227 -41.6227 -41.4608 -41.4608 -11.2398 -11.2398 -11.0970 -11.0970 -8.8456 -8.8456 -8.5403 -8.5403 -6.0827 -6.0827 -5.7095 -5.7095 -5.4624 -5.4624 -5.2366 -5.2366 -4.9199 -4.9199 -4.4979 -4.4979 -3.4371 -3.4371 -2.7340 -2.7340 -2.5748 -2.5748 -1.9822 -1.9822 -1.3577 -1.3577 -1.0115 -1.0115 -0.3479 -0.3479 -0.0656 -0.0656 0.5292 0.5292 0.6851 0.6851 0.7533 0.7533 1.0903 1.0903 1.8956 1.8956 2.9638 2.9638 3.1723 3.1723 k =-0.3158-0.3828 0.0161 ( 16268 PWs) bands (ev): -70.4465 -70.4465 -42.5421 -42.5421 -41.6227 -41.6227 -41.4608 -41.4608 -11.2457 -11.2457 -11.0987 -11.0987 -8.8467 -8.8467 -8.5396 -8.5396 -6.0987 -6.0987 -5.6991 -5.6991 -5.4593 -5.4593 -5.2347 -5.2347 -4.9198 -4.9198 -4.4998 -4.4998 -3.4022 -3.4022 -2.7401 -2.7401 -2.5714 -2.5714 -1.9753 -1.9753 -1.3670 -1.3670 -1.0114 -1.0114 -0.3342 -0.3342 -0.0609 -0.0609 0.5190 0.5190 0.6844 0.6844 0.7564 0.7564 1.0896 1.0896 1.9035 1.9035 2.9451 2.9451 3.1816 3.1816 k =-0.3070-0.3722 0.0157 ( 16277 PWs) bands (ev): -70.4467 -70.4467 -42.5422 -42.5422 -41.6227 -41.6227 -41.4608 -41.4608 -11.2520 -11.2520 -11.1004 -11.1004 -8.8474 -8.8474 -8.5386 -8.5386 -6.1159 -6.1159 -5.6881 -5.6881 -5.4558 -5.4558 -5.2312 -5.2312 -4.9189 -4.9189 -4.5009 -4.5009 -3.3690 -3.3690 -2.7465 -2.7465 -2.5685 -2.5685 -1.9684 -1.9684 -1.3752 -1.3752 -1.0118 -1.0118 -0.3224 -0.3224 -0.0557 -0.0557 0.5082 0.5082 0.6844 0.6844 0.7588 0.7588 1.0885 1.0885 1.9113 1.9113 2.9263 2.9263 3.1901 3.1901 k =-0.2982-0.3616 0.0152 ( 16271 PWs) bands (ev): -70.4466 -70.4466 -42.5421 -42.5421 -41.6227 -41.6227 -41.4607 -41.4607 -11.2586 -11.2586 -11.1024 -11.1024 -8.8478 -8.8478 -8.5373 -8.5373 -6.1342 -6.1342 -5.6766 -5.6766 -5.4522 -5.4522 -5.2264 -5.2264 -4.9172 -4.9172 -4.5011 -4.5011 -3.3377 -3.3377 -2.7530 -2.7530 -2.5663 -2.5663 -1.9615 -1.9615 -1.3825 -1.3825 -1.0128 -1.0128 -0.3125 -0.3125 -0.0501 -0.0501 0.4976 0.4976 0.6859 0.6859 0.7614 0.7614 1.0886 1.0886 1.9208 1.9208 2.9078 2.9078 3.1977 3.1977 k =-0.2895-0.3509 0.0148 ( 16276 PWs) bands (ev): -70.4467 -70.4467 -42.5422 -42.5422 -41.6227 -41.6227 -41.4607 -41.4607 -11.2655 -11.2655 -11.1045 -11.1045 -8.8476 -8.8476 -8.5357 -8.5357 -6.1535 -6.1535 -5.6648 -5.6648 -5.4484 -5.4484 -5.2202 -5.2202 -4.9147 -4.9147 -4.5003 -4.5003 -3.3083 -3.3083 -2.7596 -2.7596 -2.5649 -2.5649 -1.9546 -1.9546 -1.3887 -1.3887 -1.0142 -1.0142 -0.3051 -0.3051 -0.0439 -0.0439 0.4872 0.4872 0.6869 0.6869 0.7640 0.7640 1.0883 1.0883 1.9303 1.9303 2.8895 2.8895 3.2042 3.2042 k =-0.2807-0.3403 0.0143 ( 16282 PWs) bands (ev): -70.4468 -70.4468 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.2728 -11.2728 -11.1069 -11.1069 -8.8471 -8.8471 -8.5336 -8.5336 -6.1736 -6.1736 -5.6525 -5.6525 -5.4446 -5.4446 -5.2129 -5.2129 -4.9116 -4.9116 -4.4986 -4.4986 -3.2811 -3.2811 -2.7661 -2.7661 -2.5642 -2.5642 -1.9475 -1.9475 -1.3939 -1.3939 -1.0161 -1.0161 -0.3006 -0.3006 -0.0374 -0.0374 0.4779 0.4779 0.6881 0.6881 0.7661 0.7661 1.0879 1.0879 1.9406 1.9406 2.8716 2.8716 3.2093 3.2093 k =-0.2719-0.3297 0.0139 ( 16284 PWs) bands (ev): -70.4469 -70.4469 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.2803 -11.2803 -11.1093 -11.1093 -8.8460 -8.8460 -8.5312 -8.5312 -6.1943 -6.1943 -5.6400 -5.6400 -5.4407 -5.4407 -5.2045 -5.2045 -4.9078 -4.9078 -4.4957 -4.4957 -3.2561 -3.2561 -2.7726 -2.7726 -2.5644 -2.5644 -1.9402 -1.9402 -1.3981 -1.3981 -1.0182 -1.0182 -0.2992 -0.2992 -0.0305 -0.0305 0.4704 0.4704 0.6889 0.6889 0.7684 0.7684 1.0883 1.0883 1.9516 1.9516 2.8541 2.8541 3.2130 3.2130 k =-0.2632-0.3190 0.0134 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.2881 -11.2881 -11.1120 -11.1120 -8.8445 -8.8445 -8.5284 -8.5284 -6.2155 -6.2155 -5.6272 -5.6272 -5.4370 -5.4370 -5.1951 -5.1951 -4.9033 -4.9033 -4.4918 -4.4918 -3.2336 -3.2336 -2.7787 -2.7787 -2.5655 -2.5655 -1.9326 -1.9326 -1.4013 -1.4013 -1.0206 -1.0206 -0.3010 -0.3010 -0.0237 -0.0237 0.4644 0.4644 0.6889 0.6889 0.7706 0.7706 1.0886 1.0886 1.9632 1.9632 2.8371 2.8371 3.2150 3.2150 k =-0.2544-0.3084 0.0130 ( 16291 PWs) bands (ev): -70.4470 -70.4470 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.2962 -11.2962 -11.1148 -11.1148 -8.8425 -8.8425 -8.5252 -8.5252 -6.2369 -6.2369 -5.6143 -5.6143 -5.4334 -5.4334 -5.1849 -5.1849 -4.8983 -4.8983 -4.4866 -4.4866 -3.2136 -3.2136 -2.7845 -2.7845 -2.5675 -2.5675 -1.9246 -1.9246 -1.4037 -1.4037 -1.0232 -1.0232 -0.3062 -0.3062 -0.0168 -0.0168 0.4606 0.4606 0.6888 0.6888 0.7733 0.7733 1.0898 1.0898 1.9756 1.9756 2.8208 2.8208 3.2152 3.2152 k =-0.2456-0.2978 0.0125 ( 16296 PWs) bands (ev): -70.4472 -70.4472 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3045 -11.3045 -11.1178 -11.1178 -8.8401 -8.8401 -8.5216 -8.5216 -6.2585 -6.2585 -5.6013 -5.6013 -5.4300 -5.4300 -5.1740 -5.1740 -4.8927 -4.8927 -4.4802 -4.4802 -3.1963 -3.1963 -2.7897 -2.7897 -2.5703 -2.5703 -1.9161 -1.9161 -1.4053 -1.4053 -1.0258 -1.0258 -0.3145 -0.3145 -0.0101 -0.0101 0.4586 0.4586 0.6881 0.6881 0.7761 0.7761 1.0906 1.0906 1.9885 1.9885 2.8052 2.8052 3.2136 3.2136 k =-0.2368-0.2871 0.0121 ( 16294 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3130 -11.3130 -11.1209 -11.1209 -8.8372 -8.8372 -8.5175 -8.5175 -6.2801 -6.2801 -5.5884 -5.5884 -5.4269 -5.4269 -5.1626 -5.1626 -4.8866 -4.8866 -4.4725 -4.4725 -3.1818 -3.1818 -2.7944 -2.7944 -2.5738 -2.5738 -1.9071 -1.9071 -1.4062 -1.4062 -1.0285 -1.0285 -0.3259 -0.3259 -0.0039 -0.0039 0.4588 0.4588 0.6870 0.6870 0.7788 0.7788 1.0928 1.0928 2.0021 2.0021 2.7903 2.7903 3.2099 3.2099 k =-0.2281-0.2765 0.0116 ( 16291 PWs) bands (ev): -70.4470 -70.4470 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3217 -11.3217 -11.1242 -11.1242 -8.8339 -8.8339 -8.5131 -8.5131 -6.3015 -6.3015 -5.5756 -5.5756 -5.4241 -5.4241 -5.1508 -5.1508 -4.8800 -4.8800 -4.4636 -4.4636 -3.1701 -3.1701 -2.7983 -2.7983 -2.5779 -2.5779 -1.8975 -1.8975 -1.4067 -1.4067 -1.0311 -1.0311 -0.3403 -0.3403 0.0018 0.0018 0.4610 0.4610 0.6849 0.6849 0.7821 0.7821 1.0950 1.0950 2.0165 2.0165 2.7763 2.7763 3.2043 3.2043 k =-0.2193-0.2658 0.0112 ( 16288 PWs) bands (ev): -70.4470 -70.4470 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3305 -11.3305 -11.1276 -11.1276 -8.8302 -8.8302 -8.5083 -8.5083 -6.3226 -6.3226 -5.5631 -5.5631 -5.4217 -5.4217 -5.1387 -5.1387 -4.8730 -4.8730 -4.4534 -4.4534 -3.1615 -3.1615 -2.8016 -2.8016 -2.5825 -2.5825 -1.8873 -1.8873 -1.4067 -1.4067 -1.0335 -1.0335 -0.3573 -0.3573 0.0070 0.0070 0.4647 0.4647 0.6823 0.6823 0.7862 0.7862 1.0972 1.0972 2.0314 2.0314 2.7629 2.7629 3.1965 3.1965 k =-0.2105-0.2552 0.0107 ( 16277 PWs) bands (ev): -70.4467 -70.4467 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.3394 -11.3394 -11.1311 -11.1311 -8.8262 -8.8262 -8.5031 -8.5031 -6.3433 -6.3433 -5.5508 -5.5508 -5.4196 -5.4196 -5.1265 -5.1265 -4.8654 -4.8654 -4.4419 -4.4419 -3.1557 -3.1557 -2.8043 -2.8043 -2.5873 -2.5873 -1.8766 -1.8766 -1.4064 -1.4064 -1.0357 -1.0357 -0.3766 -0.3766 0.0118 0.0118 0.4699 0.4699 0.6793 0.6793 0.7911 0.7911 1.0999 1.0999 2.0470 2.0470 2.7506 2.7506 3.1867 3.1867 k =-0.2018-0.2446 0.0103 ( 16274 PWs) bands (ev): -70.4467 -70.4467 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.3484 -11.3484 -11.1347 -11.1347 -8.8218 -8.8218 -8.4975 -8.4975 -6.3635 -6.3635 -5.5390 -5.5390 -5.4178 -5.4178 -5.1142 -5.1142 -4.8575 -4.8575 -4.4292 -4.4292 -3.1528 -3.1528 -2.8063 -2.8063 -2.5924 -2.5924 -1.8654 -1.8654 -1.4059 -1.4059 -1.0376 -1.0376 -0.3979 -0.3979 0.0161 0.0161 0.4757 0.4757 0.6754 0.6754 0.7956 0.7956 1.1032 1.1032 2.0627 2.0627 2.7389 2.7389 3.1749 3.1749 k =-0.1930-0.2339 0.0098 ( 16279 PWs) bands (ev): -70.4468 -70.4468 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.3574 -11.3574 -11.1383 -11.1383 -8.8171 -8.8171 -8.4916 -8.4916 -6.3832 -6.3832 -5.5276 -5.5276 -5.4164 -5.4164 -5.1021 -5.1021 -4.8492 -4.8492 -4.4153 -4.4153 -3.1526 -3.1526 -2.8078 -2.8078 -2.5974 -2.5974 -1.8536 -1.8536 -1.4055 -1.4055 -1.0392 -1.0392 -0.4210 -0.4210 0.0199 0.0199 0.4818 0.4818 0.6707 0.6707 0.8006 0.8006 1.1057 1.1057 2.0785 2.0785 2.7280 2.7280 3.1610 3.1610 k =-0.1842-0.2233 0.0094 ( 16288 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.3663 -11.3663 -11.1421 -11.1421 -8.8122 -8.8122 -8.4854 -8.4854 -6.4021 -6.4021 -5.5168 -5.5168 -5.4154 -5.4154 -5.0901 -5.0901 -4.8405 -4.8405 -4.4003 -4.4003 -3.1550 -3.1550 -2.8090 -2.8090 -2.6023 -2.6023 -1.8414 -1.8414 -1.4051 -1.4051 -1.0403 -1.0403 -0.4454 -0.4454 0.0233 0.0233 0.4878 0.4878 0.6655 0.6655 0.8058 0.8058 1.1084 1.1084 2.0948 2.0948 2.7179 2.7179 3.1453 3.1453 k =-0.1754-0.2127 0.0090 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3752 -11.3752 -11.1458 -11.1458 -8.8071 -8.8071 -8.4790 -8.4790 -6.4204 -6.4204 -5.5067 -5.5067 -5.4146 -5.4146 -5.0785 -5.0785 -4.8315 -4.8315 -4.3843 -4.3843 -3.1597 -3.1597 -2.8099 -2.8099 -2.6069 -2.6069 -1.8288 -1.8288 -1.4049 -1.4049 -1.0408 -1.0408 -0.4708 -0.4708 0.0264 0.0264 0.4940 0.4940 0.6605 0.6605 0.8113 0.8113 1.1116 1.1116 2.1112 2.1112 2.7085 2.7085 3.1279 3.1279 k =-0.1667-0.2020 0.0085 ( 16300 PWs) bands (ev): -70.4473 -70.4473 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.3840 -11.3840 -11.1496 -11.1496 -8.8018 -8.8018 -8.4723 -8.4723 -6.4379 -6.4379 -5.4972 -5.4972 -5.4142 -5.4142 -5.0672 -5.0672 -4.8223 -4.8223 -4.3674 -4.3674 -3.1664 -3.1664 -2.8106 -2.8106 -2.6113 -2.6113 -1.8158 -1.8158 -1.4049 -1.4049 -1.0409 -1.0409 -0.4969 -0.4969 0.0291 0.0291 0.4991 0.4991 0.6553 0.6553 0.8170 0.8170 1.1153 1.1153 2.1276 2.1276 2.6999 2.6999 3.1088 3.1088 k =-0.1579-0.1914 0.0081 ( 16291 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.3926 -11.3926 -11.1533 -11.1533 -8.7964 -8.7964 -8.4655 -8.4655 -6.4545 -6.4545 -5.4884 -5.4884 -5.4139 -5.4139 -5.0563 -5.0563 -4.8129 -4.8129 -4.3496 -4.3496 -3.1749 -3.1749 -2.8112 -2.8112 -2.6154 -2.6154 -1.8026 -1.8026 -1.4054 -1.4054 -1.0403 -1.0403 -0.5233 -0.5233 0.0317 0.0317 0.5045 0.5045 0.6504 0.6504 0.8242 0.8242 1.1199 1.1199 2.1444 2.1444 2.6922 2.6922 3.0884 3.0884 k =-0.1491-0.1808 0.0076 ( 16292 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4011 -11.4011 -11.1570 -11.1570 -8.7910 -8.7910 -8.4585 -8.4585 -6.4703 -6.4703 -5.4804 -5.4804 -5.4139 -5.4139 -5.0460 -5.0460 -4.8033 -4.8033 -4.3312 -4.3312 -3.1849 -3.1849 -2.8116 -2.8116 -2.6193 -2.6193 -1.7892 -1.7892 -1.4062 -1.4062 -1.0392 -1.0392 -0.5498 -0.5498 0.0340 0.0340 0.5082 0.5082 0.6452 0.6452 0.8308 0.8308 1.1249 1.1249 2.1612 2.1612 2.6852 2.6852 3.0667 3.0667 k =-0.1404-0.1701 0.0072 ( 16304 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.4093 -11.4093 -11.1606 -11.1606 -8.7856 -8.7856 -8.4514 -8.4514 -6.4852 -6.4852 -5.4732 -5.4732 -5.4141 -5.4141 -5.0361 -5.0361 -4.7937 -4.7937 -4.3122 -4.3122 -3.1963 -3.1963 -2.8118 -2.8118 -2.6231 -2.6231 -1.7756 -1.7756 -1.4075 -1.4075 -1.0374 -1.0374 -0.5762 -0.5762 0.0361 0.0361 0.5106 0.5106 0.6406 0.6406 0.8368 0.8368 1.1286 1.1286 2.1776 2.1776 2.6789 2.6789 3.0439 3.0439 k =-0.1316-0.1595 0.0067 ( 16304 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4607 -41.4607 -11.4172 -11.4172 -11.1642 -11.1642 -8.7803 -8.7803 -8.4444 -8.4444 -6.4992 -6.4992 -5.4668 -5.4668 -5.4143 -5.4143 -5.0269 -5.0269 -4.7841 -4.7841 -4.2928 -4.2928 -3.2086 -3.2086 -2.8117 -2.8117 -2.6268 -2.6268 -1.7620 -1.7620 -1.4093 -1.4093 -1.0351 -1.0351 -0.6020 -0.6020 0.0380 0.0380 0.5116 0.5116 0.6368 0.6368 0.8437 0.8437 1.1335 1.1335 2.1942 2.1942 2.6734 2.6734 3.0204 3.0204 k =-0.1228-0.1489 0.0063 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4248 -11.4248 -11.1677 -11.1677 -8.7750 -8.7750 -8.4374 -8.4374 -6.5122 -6.5122 -5.4612 -5.4612 -5.4147 -5.4147 -5.0182 -5.0182 -4.7745 -4.7745 -4.2733 -4.2733 -3.2218 -3.2218 -2.8112 -2.8112 -2.6307 -2.6307 -1.7485 -1.7485 -1.4116 -1.4116 -1.0322 -1.0322 -0.6272 -0.6272 0.0398 0.0398 0.5120 0.5120 0.6337 0.6337 0.8501 0.8501 1.1382 1.1382 2.2105 2.2105 2.6686 2.6686 2.9963 2.9963 k =-0.1140-0.1382 0.0058 ( 16302 PWs) bands (ev): -70.4474 -70.4474 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4321 -11.4321 -11.1710 -11.1710 -8.7699 -8.7699 -8.4305 -8.4305 -6.5243 -6.5243 -5.4563 -5.4563 -5.4151 -5.4151 -5.0101 -5.0101 -4.7652 -4.7652 -4.2537 -4.2537 -3.2356 -3.2356 -2.8102 -2.8102 -2.6348 -2.6348 -1.7351 -1.7351 -1.4143 -1.4143 -1.0289 -1.0289 -0.6514 -0.6514 0.0415 0.0415 0.5111 0.5111 0.6316 0.6316 0.8566 0.8566 1.1433 1.1433 2.2264 2.2264 2.6646 2.6646 2.9718 2.9718 k =-0.1053-0.1276 0.0054 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4390 -11.4390 -11.1742 -11.1742 -8.7650 -8.7650 -8.4238 -8.4238 -6.5354 -6.5354 -5.4522 -5.4522 -5.4156 -5.4156 -5.0026 -5.0026 -4.7560 -4.7560 -4.2343 -4.2343 -3.2497 -3.2497 -2.8086 -2.8086 -2.6393 -2.6393 -1.7220 -1.7220 -1.4175 -1.4175 -1.0252 -1.0252 -0.6746 -0.6746 0.0430 0.0430 0.5089 0.5089 0.6296 0.6296 0.8626 0.8626 1.1482 1.1482 2.2419 2.2419 2.6614 2.6614 2.9471 2.9471 k =-0.0965-0.1170 0.0049 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4455 -11.4455 -11.1772 -11.1772 -8.7604 -8.7604 -8.4173 -8.4173 -6.5456 -6.5456 -5.4487 -5.4487 -5.4161 -5.4161 -4.9957 -4.9957 -4.7472 -4.7472 -4.2153 -4.2153 -3.2639 -3.2639 -2.8064 -2.8064 -2.6442 -2.6442 -1.7092 -1.7092 -1.4210 -1.4210 -1.0212 -1.0212 -0.6965 -0.6965 0.0444 0.0444 0.5063 0.5063 0.6281 0.6281 0.8689 0.8689 1.1529 1.1529 2.2566 2.2566 2.6590 2.6590 2.9225 2.9225 k =-0.0877-0.1063 0.0045 ( 16301 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4515 -11.4515 -11.1800 -11.1800 -8.7560 -8.7560 -8.4111 -8.4111 -6.5548 -6.5548 -5.4458 -5.4458 -5.4166 -5.4166 -4.9894 -4.9894 -4.7389 -4.7389 -4.1969 -4.1969 -3.2781 -3.2781 -2.8034 -2.8034 -2.6495 -2.6495 -1.6968 -1.6968 -1.4249 -1.4249 -1.0170 -1.0170 -0.7169 -0.7169 0.0457 0.0457 0.5027 0.5027 0.6272 0.6272 0.8748 0.8748 1.1581 1.1581 2.2710 2.2710 2.6575 2.6575 2.8983 2.8983 k =-0.0789-0.0957 0.0040 ( 16304 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4570 -11.4570 -11.1826 -11.1826 -8.7519 -8.7519 -8.4052 -8.4052 -6.5631 -6.5631 -5.4434 -5.4434 -5.4172 -5.4172 -4.9837 -4.9837 -4.7310 -4.7310 -4.1792 -4.1792 -3.2919 -3.2919 -2.7996 -2.7996 -2.6555 -2.6555 -1.6850 -1.6850 -1.4289 -1.4289 -1.0128 -1.0128 -0.7358 -0.7358 0.0468 0.0468 0.4987 0.4987 0.6261 0.6261 0.8802 0.8802 1.1626 1.1626 2.2844 2.2844 2.6568 2.6568 2.8745 2.8745 k =-0.0702-0.0851 0.0036 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4621 -11.4621 -11.1850 -11.1850 -8.7482 -8.7482 -8.3998 -8.3998 -6.5705 -6.5705 -5.4413 -5.4413 -5.4179 -5.4179 -4.9786 -4.9786 -4.7238 -4.7238 -4.1626 -4.1626 -3.3051 -3.3051 -2.7950 -2.7950 -2.6620 -2.6620 -1.6739 -1.6739 -1.4331 -1.4331 -1.0085 -1.0085 -0.7530 -0.7530 0.0479 0.0479 0.4948 0.4948 0.6254 0.6254 0.8853 0.8853 1.1664 1.1664 2.2968 2.2968 2.6572 2.6572 2.8513 2.8513 k =-0.0614-0.0744 0.0031 ( 16307 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4666 -11.4666 -11.1872 -11.1872 -8.7448 -8.7448 -8.3949 -8.3949 -6.5770 -6.5770 -5.4396 -5.4396 -5.4187 -5.4187 -4.9742 -4.9742 -4.7172 -4.7172 -4.1472 -4.1472 -3.3174 -3.3174 -2.7897 -2.7897 -2.6690 -2.6690 -1.6636 -1.6636 -1.4373 -1.4373 -1.0045 -1.0045 -0.7684 -0.7684 0.0488 0.0488 0.4909 0.4909 0.6252 0.6252 0.8891 0.8891 1.1703 1.1703 2.3084 2.3084 2.6586 2.6586 2.8290 2.8290 k =-0.0526-0.0638 0.0027 ( 16311 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4705 -11.4705 -11.1891 -11.1891 -8.7419 -8.7419 -8.3905 -8.3905 -6.5826 -6.5826 -5.4380 -5.4380 -5.4195 -5.4195 -4.9703 -4.9703 -4.7113 -4.7113 -4.1333 -4.1333 -3.3288 -3.3288 -2.7836 -2.7836 -2.6766 -2.6766 -1.6542 -1.6542 -1.4414 -1.4414 -1.0007 -1.0007 -0.7819 -0.7819 0.0497 0.0497 0.4867 0.4867 0.6243 0.6243 0.8930 0.8930 1.1740 1.1740 2.3188 2.3188 2.6611 2.6611 2.8076 2.8076 k =-0.0439-0.0532 0.0022 ( 16311 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4739 -11.4739 -11.1907 -11.1907 -8.7393 -8.7393 -8.3867 -8.3867 -6.5872 -6.5872 -5.4366 -5.4366 -5.4205 -5.4205 -4.9670 -4.9670 -4.7063 -4.7063 -4.1211 -4.1211 -3.3389 -3.3389 -2.7769 -2.7769 -2.6845 -2.6845 -1.6459 -1.6459 -1.4452 -1.4452 -0.9973 -0.9973 -0.7934 -0.7934 0.0504 0.0504 0.4829 0.4829 0.6243 0.6243 0.8967 0.8967 1.1768 1.1768 2.3279 2.3279 2.6649 2.6649 2.7875 2.7875 k =-0.0351-0.0425 0.0018 ( 16312 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4766 -11.4766 -11.1920 -11.1920 -8.7372 -8.7372 -8.3835 -8.3835 -6.5911 -6.5911 -5.4353 -5.4353 -5.4215 -5.4215 -4.9643 -4.9643 -4.7021 -4.7021 -4.1107 -4.1107 -3.3474 -3.3474 -2.7698 -2.7698 -2.6927 -2.6927 -1.6388 -1.6388 -1.4486 -1.4486 -0.9943 -0.9943 -0.8029 -0.8029 0.0510 0.0510 0.4795 0.4795 0.6241 0.6241 0.8995 0.8995 1.1793 1.1793 2.3359 2.3359 2.6700 2.6700 2.7687 2.7687 k =-0.0263-0.0319 0.0013 ( 16315 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4788 -11.4788 -11.1931 -11.1931 -8.7356 -8.7356 -8.3810 -8.3810 -6.5940 -6.5940 -5.4342 -5.4342 -5.4225 -5.4225 -4.9623 -4.9623 -4.6987 -4.6987 -4.1024 -4.1024 -3.3544 -3.3544 -2.7623 -2.7623 -2.7010 -2.7010 -1.6330 -1.6330 -1.4515 -1.4515 -0.9919 -0.9919 -0.8104 -0.8104 0.0515 0.0515 0.4773 0.4773 0.6237 0.6237 0.9016 0.9016 1.1813 1.1813 2.3416 2.3416 2.6765 2.6765 2.7513 2.7513 k =-0.0175-0.0213 0.0009 ( 16310 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4804 -11.4804 -11.1939 -11.1939 -8.7344 -8.7344 -8.3792 -8.3792 -6.5961 -6.5961 -5.4331 -5.4331 -5.4235 -5.4235 -4.9608 -4.9608 -4.6963 -4.6963 -4.0964 -4.0964 -3.3595 -3.3595 -2.7549 -2.7549 -2.7089 -2.7089 -1.6288 -1.6288 -1.4537 -1.4537 -0.9902 -0.9902 -0.8156 -0.8156 0.0518 0.0518 0.4762 0.4762 0.6235 0.6235 0.9036 0.9036 1.1827 1.1827 2.3460 2.3460 2.6843 2.6843 2.7356 2.7356 k =-0.0088-0.0106 0.0004 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4813 -11.4813 -11.1943 -11.1943 -8.7337 -8.7337 -8.3781 -8.3781 -6.5974 -6.5974 -5.4324 -5.4324 -5.4241 -5.4241 -4.9599 -4.9599 -4.6949 -4.6949 -4.0927 -4.0927 -3.3626 -3.3626 -2.7486 -2.7486 -2.7155 -2.7155 -1.6262 -1.6262 -1.4551 -1.4551 -0.9891 -0.9891 -0.8188 -0.8188 0.0520 0.0520 0.4744 0.4744 0.6235 0.6235 0.9050 0.9050 1.1840 1.1840 2.3488 2.3488 2.6929 2.6929 2.7221 2.7221 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 k = 0.0000 0.0000 0.0135 ( 16311 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4812 -11.4812 -11.1950 -11.1950 -8.7339 -8.7339 -8.3770 -8.3770 -6.5964 -6.5964 -5.4473 -5.4473 -5.4117 -5.4117 -4.9603 -4.9603 -4.6939 -4.6939 -4.0922 -4.0922 -3.3628 -3.3628 -2.7501 -2.7501 -2.7122 -2.7122 -1.6254 -1.6254 -1.4546 -1.4546 -0.9901 -0.9901 -0.8185 -0.8185 0.0499 0.0499 0.4735 0.4735 0.6235 0.6235 0.9053 0.9053 1.1844 1.1844 2.3497 2.3497 2.6660 2.6660 2.7484 2.7484 k = 0.0000 0.0000 0.0270 ( 16311 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4800 -11.4800 -11.1966 -11.1966 -8.7353 -8.7353 -8.3746 -8.3746 -6.5921 -6.5921 -5.4683 -5.4683 -5.3984 -5.3984 -4.9625 -4.9625 -4.6925 -4.6925 -4.0941 -4.0941 -3.3605 -3.3605 -2.7580 -2.7580 -2.6986 -2.6986 -1.6253 -1.6253 -1.4520 -1.4520 -0.9942 -0.9942 -0.8143 -0.8143 0.0436 0.0436 0.4737 0.4737 0.6235 0.6235 0.9043 0.9043 1.1858 1.1858 2.3492 2.3492 2.6277 2.6277 2.7893 2.7893 k = 0.0000 0.0000 0.0405 ( 16313 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4780 -11.4780 -11.1992 -11.1992 -8.7376 -8.7376 -8.3707 -8.3707 -6.5851 -6.5851 -5.4918 -5.4918 -5.3877 -5.3877 -4.9658 -4.9658 -4.6902 -4.6902 -4.0972 -4.0972 -3.3569 -3.3569 -2.7658 -2.7658 -2.6814 -2.6814 -1.6252 -1.6252 -1.4477 -1.4477 -1.0007 -1.0007 -0.8076 -0.8076 0.0332 0.0332 0.4734 0.4734 0.6237 0.6237 0.9028 0.9028 1.1878 1.1878 2.3480 2.3480 2.5909 2.5909 2.8307 2.8307 k = 0.0000 0.0000 0.0539 ( 16317 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4751 -11.4751 -11.2028 -11.2028 -8.7407 -8.7407 -8.3654 -8.3654 -6.5752 -6.5752 -5.5176 -5.5176 -5.3795 -5.3795 -4.9700 -4.9700 -4.6872 -4.6872 -4.1013 -4.1013 -3.3522 -3.3522 -2.7730 -2.7730 -2.6614 -2.6614 -1.6249 -1.6249 -1.4418 -1.4418 -1.0091 -1.0091 -0.7990 -0.7990 0.0190 0.0190 0.4732 0.4732 0.6239 0.6239 0.9005 0.9005 1.1908 1.1908 2.3460 2.3460 2.5559 2.5559 2.8717 2.8717 k = 0.0000 0.0000 0.0674 ( 16317 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4715 -11.4715 -11.2074 -11.2074 -8.7444 -8.7444 -8.3591 -8.3591 -6.5626 -6.5626 -5.5458 -5.5458 -5.3739 -5.3739 -4.9747 -4.9747 -4.6836 -4.6836 -4.1061 -4.1061 -3.3466 -3.3466 -2.7793 -2.7793 -2.6390 -2.6390 -1.6245 -1.6245 -1.4345 -1.4345 -1.0190 -1.0190 -0.7886 -0.7886 0.0012 0.0012 0.4727 0.4727 0.6246 0.6246 0.8983 0.8983 1.1945 1.1945 2.3434 2.3434 2.5233 2.5233 2.9120 2.9120 k = 0.0000 0.0000 0.0809 ( 16316 PWs) bands (ev): -70.4478 -70.4478 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4672 -11.4672 -11.2129 -11.2129 -8.7485 -8.7485 -8.3518 -8.3518 -6.5473 -6.5473 -5.5761 -5.5761 -5.3709 -5.3709 -4.9795 -4.9795 -4.6796 -4.6796 -4.1114 -4.1114 -3.3404 -3.3404 -2.7850 -2.7850 -2.6146 -2.6146 -1.6239 -1.6239 -1.4259 -1.4259 -1.0301 -1.0301 -0.7769 -0.7769 -0.0197 -0.0197 0.4718 0.4718 0.6253 0.6253 0.8961 0.8961 1.1985 1.1985 2.3401 2.3401 2.4935 2.4935 2.9512 2.9512 k = 0.0000 0.0000 0.0944 ( 16314 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4621 -11.4621 -11.2193 -11.2193 -8.7529 -8.7529 -8.3438 -8.3438 -6.5294 -6.5294 -5.6086 -5.6086 -5.3702 -5.3702 -4.9842 -4.9842 -4.6753 -4.6753 -4.1171 -4.1171 -3.3339 -3.3339 -2.7901 -2.7901 -2.5886 -2.5886 -1.6232 -1.6232 -1.4163 -1.4163 -1.0421 -1.0421 -0.7640 -0.7640 -0.0433 -0.0433 0.4712 0.4712 0.6264 0.6264 0.8933 0.8933 1.2028 1.2028 2.3359 2.3359 2.4666 2.4666 2.9889 2.9889 k = 0.0000 0.0000 0.1079 ( 16310 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4563 -11.4563 -11.2264 -11.2264 -8.7575 -8.7575 -8.3355 -8.3355 -6.5089 -6.5089 -5.6430 -5.6430 -5.3716 -5.3716 -4.9885 -4.9885 -4.6708 -4.6708 -4.1227 -4.1227 -3.3273 -3.3273 -2.7946 -2.7946 -2.5613 -2.5613 -1.6222 -1.6222 -1.4058 -1.4058 -1.0547 -1.0547 -0.7503 -0.7503 -0.0692 -0.0692 0.4703 0.4703 0.6278 0.6278 0.8900 0.8900 1.2077 1.2077 2.3308 2.3308 2.4431 2.4431 3.0245 3.0245 k = 0.0000 0.0000 0.1214 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.4499 -11.4499 -11.2343 -11.2343 -8.7621 -8.7621 -8.3269 -8.3269 -6.4859 -6.4859 -5.6793 -5.6793 -5.3747 -5.3747 -4.9922 -4.9922 -4.6664 -4.6664 -4.1283 -4.1283 -3.3207 -3.3207 -2.7987 -2.7987 -2.5333 -2.5333 -1.6211 -1.6211 -1.3946 -1.3946 -1.0678 -1.0678 -0.7356 -0.7356 -0.0969 -0.0969 0.4696 0.4696 0.6286 0.6286 0.8872 0.8872 1.2131 1.2131 2.3246 2.3246 2.4233 2.4233 3.0579 3.0579 k = 0.0000 0.0000 0.1348 ( 16296 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4428 -11.4428 -11.2427 -11.2427 -8.7666 -8.7666 -8.3184 -8.3184 -6.4607 -6.4607 -5.7171 -5.7171 -5.3791 -5.3791 -4.9953 -4.9953 -4.6620 -4.6620 -4.1336 -4.1336 -3.3145 -3.3145 -2.8025 -2.8025 -2.5052 -2.5052 -1.6198 -1.6198 -1.3829 -1.3829 -1.0811 -1.0811 -0.7204 -0.7204 -0.1259 -0.1259 0.4688 0.4688 0.6291 0.6291 0.8836 0.8836 1.2184 1.2184 2.3169 2.3169 2.4073 2.4073 3.0887 3.0887 k = 0.0000 0.0000 0.1483 ( 16298 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4353 -11.4353 -11.2517 -11.2517 -8.7709 -8.7709 -8.3102 -8.3102 -6.4333 -6.4333 -5.7562 -5.7562 -5.3844 -5.3844 -4.9978 -4.9978 -4.6579 -4.6579 -4.1385 -4.1385 -3.3088 -3.3088 -2.8058 -2.8058 -2.4776 -2.4776 -1.6184 -1.6184 -1.3709 -1.3709 -1.0946 -1.0946 -0.7047 -0.7047 -0.1555 -0.1555 0.4676 0.4676 0.6298 0.6298 0.8799 0.8799 1.2231 1.2231 2.3081 2.3081 2.3944 2.3944 3.1166 3.1166 k = 0.0000 0.0000 0.1618 ( 16304 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4273 -11.4273 -11.2610 -11.2610 -8.7748 -8.7748 -8.3024 -8.3024 -6.4040 -6.4040 -5.7964 -5.7964 -5.3902 -5.3902 -4.9997 -4.9997 -4.6540 -4.6540 -4.1430 -4.1430 -3.3035 -3.3035 -2.8088 -2.8088 -2.4512 -2.4512 -1.6171 -1.6171 -1.3587 -1.3587 -1.1080 -1.1080 -0.6888 -0.6888 -0.1852 -0.1852 0.4662 0.4662 0.6304 0.6304 0.8754 0.8754 1.2280 1.2280 2.2987 2.2987 2.3845 2.3845 3.1413 3.1413 k = 0.0000 0.0000 0.1753 ( 16303 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4190 -11.4190 -11.2706 -11.2706 -8.7784 -8.7784 -8.2953 -8.2953 -6.3730 -6.3730 -5.8371 -5.8371 -5.3961 -5.3961 -5.0011 -5.0011 -4.6505 -4.6505 -4.1470 -4.1470 -3.2988 -3.2988 -2.8115 -2.8115 -2.4266 -2.4266 -1.6158 -1.6158 -1.3467 -1.3467 -1.1211 -1.1211 -0.6728 -0.6728 -0.2142 -0.2142 0.4650 0.4650 0.6312 0.6312 0.8717 0.8717 1.2326 1.2326 2.2898 2.2898 2.3772 2.3772 3.1629 3.1629 k = 0.0000 0.0000 0.1888 ( 16306 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4105 -11.4105 -11.2802 -11.2802 -8.7815 -8.7815 -8.2890 -8.2890 -6.3408 -6.3408 -5.8778 -5.8778 -5.4017 -5.4017 -5.0022 -5.0022 -4.6474 -4.6474 -4.1504 -4.1504 -3.2948 -3.2948 -2.8137 -2.8137 -2.4045 -2.4045 -1.6145 -1.6145 -1.3349 -1.3349 -1.1337 -1.1337 -0.6569 -0.6569 -0.2419 -0.2419 0.4640 0.4640 0.6313 0.6313 0.8682 0.8682 1.2365 1.2365 2.2815 2.2815 2.3715 2.3715 3.1812 3.1812 k = 0.0000 0.0000 0.2023 ( 16310 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4021 -11.4021 -11.2895 -11.2895 -8.7842 -8.7842 -8.2837 -8.2837 -6.3081 -6.3081 -5.9177 -5.9177 -5.4067 -5.4067 -5.0029 -5.0029 -4.6448 -4.6448 -4.1532 -4.1532 -3.2915 -3.2915 -2.8156 -2.8156 -2.3854 -2.3854 -1.6135 -1.6135 -1.3239 -1.3239 -1.1455 -1.1455 -0.6419 -0.6419 -0.2673 -0.2673 0.4630 0.4630 0.6313 0.6313 0.8651 0.8651 1.2398 1.2398 2.2745 2.2745 2.3672 2.3672 3.1962 3.1962 k = 0.0000 0.0000 0.2157 ( 16302 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.3942 -11.3942 -11.2983 -11.2983 -8.7862 -8.7862 -8.2794 -8.2794 -6.2759 -6.2759 -5.9556 -5.9556 -5.4108 -5.4108 -5.0033 -5.0033 -4.6427 -4.6427 -4.1554 -4.1554 -3.2888 -3.2888 -2.8171 -2.8171 -2.3700 -2.3700 -1.6126 -1.6126 -1.3141 -1.3141 -1.1559 -1.1559 -0.6284 -0.6284 -0.2892 -0.2892 0.4627 0.4627 0.6321 0.6321 0.8630 0.8630 1.2426 1.2426 2.2688 2.2688 2.3646 2.3646 3.2078 3.2078 k = 0.0000 0.0000 0.2292 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3872 -11.3872 -11.3057 -11.3057 -8.7878 -8.7878 -8.2763 -8.2763 -6.2465 -6.2465 -5.9891 -5.9891 -5.4139 -5.4139 -5.0036 -5.0036 -4.6412 -4.6412 -4.1570 -4.1570 -3.2870 -3.2870 -2.8182 -2.8182 -2.3586 -2.3586 -1.6120 -1.6120 -1.3061 -1.3061 -1.1642 -1.1642 -0.6175 -0.6175 -0.3064 -0.3064 0.4619 0.4619 0.6319 0.6319 0.8610 0.8610 1.2445 1.2445 2.2647 2.2647 2.3619 2.3619 3.2161 3.2161 k = 0.0000 0.0000 0.2427 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.3823 -11.3823 -11.3110 -11.3110 -8.7887 -8.7887 -8.2744 -8.2744 -6.2241 -6.2241 -6.0141 -6.0141 -5.4158 -5.4158 -5.0038 -5.0038 -4.6403 -4.6403 -4.1579 -4.1579 -3.2858 -3.2858 -2.8189 -2.8189 -2.3517 -2.3517 -1.6116 -1.6116 -1.3008 -1.3008 -1.1698 -1.1698 -0.6101 -0.6101 -0.3175 -0.3175 0.4613 0.4613 0.6321 0.6321 0.8598 0.8598 1.2458 1.2458 2.2622 2.2622 2.3609 2.3609 3.2211 3.2211 k = 0.0000 0.0000 0.2562 ( 16314 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.3805 -11.3805 -11.3130 -11.3130 -8.7890 -8.7890 -8.2738 -8.2738 -6.2152 -6.2152 -6.0239 -6.0239 -5.4164 -5.4164 -5.0039 -5.0039 -4.6400 -4.6400 -4.1582 -4.1582 -3.2855 -3.2855 -2.8191 -2.8191 -2.3493 -2.3493 -1.6115 -1.6115 -1.2989 -1.2989 -1.1717 -1.1717 -0.6076 -0.6076 -0.3214 -0.3214 0.4609 0.4609 0.6324 0.6324 0.8592 0.8592 1.2460 1.2460 2.2614 2.2614 2.3599 2.3599 3.2228 3.2228 k = 0.0000-0.4132 0.1228 ( 16282 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3055 -11.3055 -11.1534 -11.1534 -9.1313 -9.1313 -8.5574 -8.5574 -6.2979 -6.2979 -5.7796 -5.7796 -5.3162 -5.3162 -4.9262 -4.9262 -4.7217 -4.7217 -4.2074 -4.2074 -3.1548 -3.1548 -2.9060 -2.9060 -2.3941 -2.3941 -1.7866 -1.7866 -0.9912 -0.9912 -0.9570 -0.9570 -0.1042 -0.1042 -0.0813 -0.0813 0.3926 0.3926 0.6401 0.6401 0.6973 0.6973 1.0561 1.0561 2.4390 2.4390 2.6154 2.6154 2.9684 2.9684 k = 0.0000-0.3999 0.1188 ( 16282 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3061 -11.3061 -11.1534 -11.1534 -9.1302 -9.1302 -8.5570 -8.5570 -6.2999 -6.2999 -5.7773 -5.7773 -5.3161 -5.3161 -4.9266 -4.9266 -4.7217 -4.7217 -4.2073 -4.2073 -3.1553 -3.1553 -2.9058 -2.9058 -2.3950 -2.3950 -1.7859 -1.7859 -0.9951 -0.9951 -0.9546 -0.9546 -0.1079 -0.1079 -0.0809 -0.0809 0.3939 0.3939 0.6404 0.6404 0.6983 0.6983 1.0562 1.0562 2.4387 2.4387 2.6138 2.6138 2.9711 2.9711 k = 0.0000-0.3865 0.1149 ( 16282 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3077 -11.3077 -11.1537 -11.1537 -9.1269 -9.1269 -8.5559 -8.5559 -6.3058 -6.3058 -5.7706 -5.7706 -5.3156 -5.3156 -4.9275 -4.9275 -4.7218 -4.7218 -4.2071 -4.2071 -3.1567 -3.1567 -2.9054 -2.9054 -2.3978 -2.3978 -1.7839 -1.7839 -1.0045 -1.0045 -0.9493 -0.9493 -0.1186 -0.1186 -0.0797 -0.0797 0.3976 0.3976 0.6412 0.6412 0.7013 0.7013 1.0566 1.0566 2.4379 2.4379 2.6093 2.6093 2.9787 2.9787 k = 0.0000-0.3732 0.1109 ( 16281 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3103 -11.3103 -11.1541 -11.1541 -9.1215 -9.1215 -8.5539 -8.5539 -6.3153 -6.3153 -5.7598 -5.7598 -5.3147 -5.3147 -4.9291 -4.9291 -4.7219 -4.7219 -4.2068 -4.2068 -3.1590 -3.1590 -2.9047 -2.9047 -2.4024 -2.4024 -1.7806 -1.7806 -1.0170 -1.0170 -0.9436 -0.9436 -0.1352 -0.1352 -0.0781 -0.0781 0.4032 0.4032 0.6421 0.6421 0.7066 0.7066 1.0573 1.0573 2.4368 2.4368 2.6024 2.6024 2.9905 2.9905 k = 0.0000-0.3599 0.1070 ( 16278 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3139 -11.3139 -11.1548 -11.1548 -9.1139 -9.1139 -8.5513 -8.5513 -6.3276 -6.3276 -5.7456 -5.7456 -5.3136 -5.3136 -4.9312 -4.9312 -4.7220 -4.7220 -4.2062 -4.2062 -3.1621 -3.1621 -2.9037 -2.9037 -2.4085 -2.4085 -1.7761 -1.7761 -1.0315 -1.0315 -0.9386 -0.9386 -0.1571 -0.1571 -0.0762 -0.0762 0.4103 0.4103 0.6432 0.6432 0.7135 0.7135 1.0590 1.0590 2.4353 2.4353 2.5938 2.5938 3.0056 3.0056 k = 0.0000-0.3465 0.1030 ( 16279 PWs) bands (ev): -70.4470 -70.4470 -42.5421 -42.5421 -41.6227 -41.6227 -41.4604 -41.4604 -11.3185 -11.3185 -11.1556 -11.1556 -9.1044 -9.1044 -8.5478 -8.5478 -6.3422 -6.3422 -5.7287 -5.7287 -5.3122 -5.3122 -4.9339 -4.9339 -4.7222 -4.7222 -4.2055 -4.2055 -3.1661 -3.1661 -2.9024 -2.9024 -2.4161 -2.4161 -1.7708 -1.7708 -1.0474 -1.0474 -0.9346 -0.9346 -0.1832 -0.1832 -0.0739 -0.0739 0.4177 0.4177 0.6437 0.6437 0.7229 0.7229 1.0606 1.0606 2.4333 2.4333 2.5842 2.5842 3.0229 3.0229 k = 0.0000-0.3332 0.0990 ( 16272 PWs) bands (ev): -70.4468 -70.4468 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3239 -11.3239 -11.1566 -11.1566 -9.0929 -9.0929 -8.5437 -8.5437 -6.3585 -6.3585 -5.7099 -5.7099 -5.3106 -5.3106 -4.9371 -4.9371 -4.7224 -4.7224 -4.2044 -4.2044 -3.1710 -3.1710 -2.9009 -2.9009 -2.4249 -2.4249 -1.7649 -1.7649 -1.0644 -1.0644 -0.9316 -0.9316 -0.2127 -0.2127 -0.0712 -0.0712 0.4261 0.4261 0.6445 0.6445 0.7340 0.7340 1.0627 1.0627 2.4309 2.4309 2.5742 2.5742 3.0412 3.0412 k = 0.0000-0.3199 0.0951 ( 16268 PWs) bands (ev): -70.4467 -70.4467 -42.5420 -42.5420 -41.6226 -41.6226 -41.4604 -41.4604 -11.3301 -11.3301 -11.1577 -11.1577 -9.0798 -9.0798 -8.5390 -8.5390 -6.3758 -6.3758 -5.6898 -5.6898 -5.3089 -5.3089 -4.9407 -4.9407 -4.7226 -4.7226 -4.2031 -4.2031 -3.1767 -3.1767 -2.8991 -2.8991 -2.4347 -2.4347 -1.7584 -1.7584 -1.0823 -1.0823 -0.9297 -0.9297 -0.2448 -0.2448 -0.0680 -0.0680 0.4341 0.4341 0.6443 0.6443 0.7467 0.7467 1.0657 1.0657 2.4283 2.4283 2.5643 2.5643 3.0596 3.0596 k = 0.0000-0.3066 0.0911 ( 16266 PWs) bands (ev): -70.4467 -70.4467 -42.5420 -42.5420 -41.6226 -41.6226 -41.4604 -41.4604 -11.3369 -11.3369 -11.1590 -11.1590 -9.0650 -9.0650 -8.5336 -8.5336 -6.3938 -6.3938 -5.6690 -5.6690 -5.3071 -5.3071 -4.9447 -4.9447 -4.7227 -4.7227 -4.2013 -4.2013 -3.1831 -3.1831 -2.8971 -2.8971 -2.4453 -2.4453 -1.7517 -1.7517 -1.1009 -1.1009 -0.9289 -0.9289 -0.2789 -0.2789 -0.0643 -0.0643 0.4418 0.4418 0.6440 0.6440 0.7598 0.7598 1.0689 1.0689 2.4254 2.4254 2.5548 2.5548 3.0770 3.0770 k = 0.0000-0.2932 0.0871 ( 16271 PWs) bands (ev): -70.4468 -70.4468 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3444 -11.3444 -11.1605 -11.1605 -9.0487 -9.0487 -8.5276 -8.5276 -6.4118 -6.4118 -5.6481 -5.6481 -5.3055 -5.3055 -4.9488 -4.9488 -4.7229 -4.7229 -4.1991 -4.1991 -3.1903 -3.1903 -2.8947 -2.8947 -2.4564 -2.4564 -1.7451 -1.7451 -1.1200 -1.1200 -0.9290 -0.9290 -0.3143 -0.3143 -0.0603 -0.0603 0.4480 0.4480 0.6431 0.6431 0.7735 0.7735 1.0726 1.0726 2.4223 2.4223 2.5461 2.5461 3.0927 3.0927 k = 0.0000-0.2799 0.0832 ( 16275 PWs) bands (ev): -70.4469 -70.4469 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3523 -11.3523 -11.1622 -11.1622 -9.0312 -9.0312 -8.5211 -8.5211 -6.4297 -6.4297 -5.6276 -5.6276 -5.3041 -5.3041 -4.9530 -4.9530 -4.7230 -4.7230 -4.1963 -4.1963 -3.1981 -3.1981 -2.8921 -2.8921 -2.4680 -2.4680 -1.7385 -1.7385 -1.1394 -1.1394 -0.9300 -0.9300 -0.3505 -0.3505 -0.0558 -0.0558 0.4536 0.4536 0.6422 0.6422 0.7876 0.7876 1.0762 1.0762 2.4192 2.4192 2.5381 2.5381 3.1058 3.1058 k = 0.0000-0.2666 0.0792 ( 16275 PWs) bands (ev): -70.4469 -70.4469 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3607 -11.3607 -11.1640 -11.1640 -9.0127 -9.0127 -8.5142 -8.5142 -6.4471 -6.4471 -5.6076 -5.6076 -5.3030 -5.3030 -4.9571 -4.9571 -4.7230 -4.7230 -4.1931 -4.1931 -3.2065 -3.2065 -2.8892 -2.8892 -2.4798 -2.4798 -1.7322 -1.7322 -1.1588 -1.1588 -0.9319 -0.9319 -0.3869 -0.3869 -0.0508 -0.0508 0.4590 0.4590 0.6412 0.6412 0.8015 0.8015 1.0809 1.0809 2.4159 2.4159 2.5312 2.5312 3.1158 3.1158 k = 0.0000-0.2532 0.0753 ( 16271 PWs) bands (ev): -70.4468 -70.4468 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3693 -11.3693 -11.1658 -11.1658 -8.9933 -8.9933 -8.5068 -8.5068 -6.4638 -6.4638 -5.5887 -5.5887 -5.3026 -5.3026 -4.9610 -4.9610 -4.7228 -4.7228 -4.1893 -4.1893 -3.2155 -3.2155 -2.8860 -2.8860 -2.4918 -2.4918 -1.7263 -1.7263 -1.1782 -1.1782 -0.9344 -0.9344 -0.4233 -0.4233 -0.0454 -0.0454 0.4641 0.4641 0.6405 0.6405 0.8148 0.8148 1.0860 1.0860 2.4126 2.4126 2.5254 2.5254 3.1222 3.1222 k = 0.0000-0.2399 0.0713 ( 16268 PWs) bands (ev): -70.4467 -70.4467 -42.5420 -42.5420 -41.6226 -41.6226 -41.4604 -41.4604 -11.3781 -11.3781 -11.1678 -11.1678 -8.9733 -8.9733 -8.4990 -8.4990 -6.4797 -6.4797 -5.5709 -5.5709 -5.3030 -5.3030 -4.9644 -4.9644 -4.7225 -4.7225 -4.1849 -4.1849 -3.2249 -3.2249 -2.8824 -2.8824 -2.5039 -2.5039 -1.7208 -1.7208 -1.1974 -1.1974 -0.9375 -0.9375 -0.4592 -0.4592 -0.0397 -0.0397 0.4678 0.4678 0.6396 0.6396 0.8275 0.8275 1.0924 1.0924 2.4091 2.4091 2.5208 2.5208 3.1246 3.1246 k = 0.0000-0.2266 0.0673 ( 16273 PWs) bands (ev): -70.4468 -70.4468 -42.5420 -42.5420 -41.6227 -41.6227 -41.4604 -41.4604 -11.3870 -11.3870 -11.1699 -11.1699 -8.9529 -8.9529 -8.4909 -8.4909 -6.4946 -6.4946 -5.5545 -5.5545 -5.3044 -5.3044 -4.9672 -4.9672 -4.7220 -4.7220 -4.1800 -4.1800 -3.2348 -3.2348 -2.8785 -2.8785 -2.5161 -2.5161 -1.7156 -1.7156 -1.2164 -1.2164 -0.9411 -0.9411 -0.4945 -0.4945 -0.0336 -0.0336 0.4710 0.4710 0.6382 0.6382 0.8389 0.8389 1.0982 1.0982 2.4054 2.4054 2.5175 2.5175 3.1226 3.1226 k = 0.0000-0.2133 0.0634 ( 16287 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.3959 -11.3959 -11.1720 -11.1720 -8.9323 -8.9323 -8.4825 -8.4825 -6.5085 -6.5085 -5.5395 -5.5395 -5.3070 -5.3070 -4.9694 -4.9694 -4.7213 -4.7213 -4.1745 -4.1745 -3.2450 -3.2450 -2.8742 -2.8742 -2.5282 -2.5282 -1.7108 -1.7108 -1.2350 -1.2350 -0.9450 -0.9450 -0.5287 -0.5287 -0.0273 -0.0273 0.4731 0.4731 0.6362 0.6362 0.8489 0.8489 1.1042 1.1042 2.4012 2.4012 2.5155 2.5155 3.1164 3.1164 k = 0.0000-0.1999 0.0594 ( 16286 PWs) bands (ev): -70.4471 -70.4471 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4047 -11.4047 -11.1741 -11.1741 -8.9118 -8.9118 -8.4740 -8.4740 -6.5212 -6.5212 -5.5259 -5.5259 -5.3108 -5.3108 -4.9708 -4.9708 -4.7203 -4.7203 -4.1686 -4.1686 -3.2554 -3.2554 -2.8694 -2.8694 -2.5404 -2.5404 -1.7063 -1.7063 -1.2532 -1.2532 -0.9492 -0.9492 -0.5618 -0.5618 -0.0206 -0.0206 0.4759 0.4759 0.6350 0.6350 0.8580 0.8580 1.1114 1.1114 2.3970 2.3970 2.5151 2.5151 3.1059 3.1059 k = 0.0000-0.1866 0.0555 ( 16291 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4133 -11.4133 -11.1763 -11.1763 -8.8916 -8.8916 -8.4652 -8.4652 -6.5328 -6.5328 -5.5138 -5.5138 -5.3158 -5.3158 -4.9715 -4.9715 -4.7190 -4.7190 -4.1622 -4.1622 -3.2659 -3.2659 -2.8642 -2.8642 -2.5526 -2.5526 -1.7019 -1.7019 -1.2711 -1.2711 -0.9536 -0.9536 -0.5933 -0.5933 -0.0139 -0.0139 0.4772 0.4772 0.6338 0.6338 0.8661 0.8661 1.1181 1.1181 2.3930 2.3930 2.5161 2.5161 3.0914 3.0914 k = 0.0000-0.1733 0.0515 ( 16292 PWs) bands (ev): -70.4472 -70.4472 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4217 -11.4217 -11.1784 -11.1784 -8.8719 -8.8719 -8.4564 -8.4564 -6.5433 -6.5433 -5.5030 -5.5030 -5.3221 -5.3221 -4.9715 -4.9715 -4.7174 -4.7174 -4.1556 -4.1556 -3.2765 -3.2765 -2.8585 -2.8585 -2.5648 -2.5648 -1.6974 -1.6974 -1.2886 -1.2886 -0.9579 -0.9579 -0.6232 -0.6232 -0.0070 -0.0070 0.4788 0.4788 0.6323 0.6323 0.8734 0.8734 1.1255 1.1255 2.3883 2.3883 2.5188 2.5188 3.0732 3.0732 k = 0.0000-0.1599 0.0475 ( 16301 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4298 -11.4298 -11.1805 -11.1805 -8.8530 -8.8530 -8.4475 -8.4475 -6.5527 -6.5527 -5.4935 -5.4935 -5.3295 -5.3295 -4.9709 -4.9709 -4.7156 -4.7156 -4.1487 -4.1487 -3.2870 -3.2870 -2.8522 -2.8522 -2.5770 -2.5770 -1.6928 -1.6928 -1.3059 -1.3059 -0.9622 -0.9622 -0.6514 -0.6514 -0.0001 -0.0001 0.4790 0.4790 0.6309 0.6309 0.8791 0.8791 1.1325 1.1325 2.3838 2.3838 2.5230 2.5230 3.0517 3.0517 k = 0.0000-0.1466 0.0436 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6228 -41.6228 -41.4605 -41.4605 -11.4374 -11.4374 -11.1824 -11.1824 -8.8350 -8.8350 -8.4387 -8.4387 -6.5610 -6.5610 -5.4851 -5.4851 -5.3377 -5.3377 -4.9699 -4.9699 -4.7136 -4.7136 -4.1416 -4.1416 -3.2973 -3.2973 -2.8454 -2.8454 -2.5894 -2.5894 -1.6879 -1.6879 -1.3228 -1.3228 -0.9663 -0.9663 -0.6776 -0.6776 0.0067 0.0067 0.4793 0.4793 0.6303 0.6303 0.8843 0.8843 1.1395 1.1395 2.3795 2.3795 2.5289 2.5289 3.0273 3.0273 k = 0.0000-0.1333 0.0396 ( 16301 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.4446 -11.4446 -11.1843 -11.1843 -8.8181 -8.8181 -8.4300 -8.4300 -6.5683 -6.5683 -5.4777 -5.4777 -5.3467 -5.3467 -4.9686 -4.9686 -4.7113 -4.7113 -4.1346 -4.1346 -3.3072 -3.3072 -2.8380 -2.8380 -2.6018 -2.6018 -1.6826 -1.6826 -1.3395 -1.3395 -0.9701 -0.9701 -0.7018 -0.7018 0.0134 0.0134 0.4795 0.4795 0.6292 0.6292 0.8887 0.8887 1.1466 1.1466 2.3750 2.3750 2.5365 2.5365 3.0007 3.0007 k = 0.0000-0.1200 0.0357 ( 16303 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4513 -11.4513 -11.1861 -11.1861 -8.8025 -8.8025 -8.4216 -8.4216 -6.5745 -6.5745 -5.4712 -5.4712 -5.3560 -5.3560 -4.9672 -4.9672 -4.7090 -4.7090 -4.1277 -4.1277 -3.3168 -3.3168 -2.8300 -2.8300 -2.6144 -2.6144 -1.6767 -1.6767 -1.3559 -1.3559 -0.9737 -0.9737 -0.7240 -0.7240 0.0198 0.0198 0.4792 0.4792 0.6283 0.6283 0.8924 0.8924 1.1528 1.1528 2.3708 2.3708 2.5457 2.5457 2.9722 2.9722 k = 0.0000-0.1066 0.0317 ( 16305 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4574 -11.4574 -11.1878 -11.1878 -8.7883 -8.7883 -8.4135 -8.4135 -6.5799 -6.5799 -5.4655 -5.4655 -5.3656 -5.3656 -4.9658 -4.9658 -4.7065 -4.7065 -4.1211 -4.1211 -3.3257 -3.3257 -2.8214 -2.8214 -2.6271 -2.6271 -1.6704 -1.6704 -1.3719 -1.3719 -0.9769 -0.9769 -0.7439 -0.7439 0.0259 0.0259 0.4789 0.4789 0.6272 0.6272 0.8951 0.8951 1.1592 1.1592 2.3668 2.3668 2.5566 2.5566 2.9424 2.9424 k = 0.0000-0.0933 0.0277 ( 16308 PWs) bands (ev): -70.4476 -70.4476 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4629 -11.4629 -11.1893 -11.1893 -8.7756 -8.7756 -8.4060 -8.4060 -6.5845 -6.5845 -5.4604 -5.4604 -5.3751 -5.3751 -4.9644 -4.9644 -4.7041 -4.7041 -4.1148 -4.1148 -3.3339 -3.3339 -2.8123 -2.8123 -2.6399 -2.6399 -1.6636 -1.6636 -1.3875 -1.3875 -0.9797 -0.9797 -0.7616 -0.7616 0.0315 0.0315 0.4784 0.4784 0.6264 0.6264 0.8971 0.8971 1.1646 1.1646 2.3633 2.3633 2.5692 2.5692 2.9119 2.9119 k = 0.0000-0.0800 0.0238 ( 16306 PWs) bands (ev): -70.4475 -70.4475 -42.5421 -42.5421 -41.6228 -41.6228 -41.4606 -41.4606 -11.4678 -11.4678 -11.1906 -11.1906 -8.7645 -8.7645 -8.3990 -8.3990 -6.5882 -6.5882 -5.4557 -5.4557 -5.3843 -5.3843 -4.9631 -4.9631 -4.7018 -4.7018 -4.1091 -4.1091 -3.3414 -3.3414 -2.8026 -2.8026 -2.6527 -2.6527 -1.6564 -1.6564 -1.4024 -1.4024 -0.9821 -0.9821 -0.7769 -0.7769 0.0367 0.0367 0.4774 0.4774 0.6255 0.6255 0.8996 0.8996 1.1699 1.1699 2.3602 2.3602 2.5836 2.5836 2.8810 2.8810 k = 0.0000-0.0666 0.0198 ( 16297 PWs) bands (ev): -70.4473 -70.4473 -42.5421 -42.5421 -41.6227 -41.6227 -41.4605 -41.4605 -11.4720 -11.4720 -11.1918 -11.1918 -8.7550 -8.7550 -8.3929 -8.3929 -6.5913 -6.5913 -5.4514 -5.4514 -5.3931 -5.3931 -4.9620 -4.9620 -4.6997 -4.6997 -4.1040 -4.1040 -3.3478 -3.3478 -2.7924 -2.7924 -2.6656 -2.6656 -1.6491 -1.6491 -1.4164 -1.4164 -0.9842 -0.9842 -0.7899 -0.7899 0.0412 0.0412 0.4773 0.4773 0.6256 0.6256 0.9016 0.9016 1.1742 1.1742 2.3575 2.3575 2.5997 2.5997 2.8501 2.8501 k = 0.0000-0.0533 0.0158 ( 16300 PWs) bands (ev): -70.4474 -70.4474 -42.5421 -42.5421 -41.6227 -41.6227 -41.4606 -41.4606 -11.4754 -11.4754 -11.1927 -11.1927 -8.7473 -8.7473 -8.3876 -8.3876 -6.5937 -6.5937 -5.4472 -5.4472 -5.4013 -5.4013 -4.9612 -4.9612 -4.6979 -4.6979 -4.0996 -4.0996 -3.3534 -3.3534 -2.7819 -2.7819 -2.6784 -2.6784 -1.6420 -1.6420 -1.4290 -1.4290 -0.9858 -0.9858 -0.8006 -0.8006 0.0450 0.0450 0.4767 0.4767 0.6247 0.6247 0.9028 0.9028 1.1777 1.1777 2.3548 2.3548 2.6175 2.6175 2.8196 2.8196 k = 0.0000-0.0400 0.0119 ( 16311 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4781 -11.4781 -11.1935 -11.1935 -8.7412 -8.7412 -8.3834 -8.3834 -6.5955 -6.5955 -5.4430 -5.4430 -5.4088 -5.4088 -4.9605 -4.9605 -4.6964 -4.6964 -4.0961 -4.0961 -3.3578 -3.3578 -2.7711 -2.7711 -2.6909 -2.6909 -1.6355 -1.6355 -1.4399 -1.4399 -0.9871 -0.9871 -0.8091 -0.8091 0.0480 0.0480 0.4753 0.4753 0.6237 0.6237 0.9039 0.9039 1.1799 1.1799 2.3525 2.3525 2.6371 2.6371 2.7899 2.7899 k = 0.0000-0.0267 0.0079 ( 16313 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4801 -11.4801 -11.1940 -11.1940 -8.7369 -8.7369 -8.3803 -8.3803 -6.5968 -6.5968 -5.4388 -5.4388 -5.4156 -5.4156 -4.9600 -4.9600 -4.6953 -4.6953 -4.0936 -4.0936 -3.3610 -3.3610 -2.7603 -2.7603 -2.7029 -2.7029 -1.6301 -1.6301 -1.4483 -1.4483 -0.9880 -0.9880 -0.8151 -0.8151 0.0503 0.0503 0.4748 0.4748 0.6235 0.6235 0.9041 0.9041 1.1820 1.1820 2.3511 2.3511 2.6583 2.6583 2.7612 2.7612 k = 0.0000-0.0133 0.0040 ( 16314 PWs) bands (ev): -70.4477 -70.4477 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4812 -11.4812 -11.1944 -11.1944 -8.7343 -8.7343 -8.3784 -8.3784 -6.5976 -6.5976 -5.4347 -5.4347 -5.4213 -5.4213 -4.9597 -4.9597 -4.6946 -4.6946 -4.0920 -4.0920 -3.3630 -3.3630 -2.7506 -2.7506 -2.7134 -2.7134 -1.6266 -1.6266 -1.4537 -1.4537 -0.9885 -0.9885 -0.8187 -0.8187 0.0516 0.0516 0.4739 0.4739 0.6233 0.6233 0.9049 0.9049 1.1836 1.1836 2.3500 2.3500 2.6808 2.6808 2.7342 2.7342 k = 0.0000 0.0000 0.0000 ( 16309 PWs) bands (ev): -70.4476 -70.4476 -42.5422 -42.5422 -41.6228 -41.6228 -41.4606 -41.4606 -11.4816 -11.4816 -11.1945 -11.1945 -8.7334 -8.7334 -8.3778 -8.3778 -6.5978 -6.5978 -5.4321 -5.4321 -5.4244 -5.4244 -4.9596 -4.9596 -4.6944 -4.6944 -4.0915 -4.0915 -3.3636 -3.3636 -2.7458 -2.7458 -2.7184 -2.7184 -1.6254 -1.6254 -1.4555 -1.4555 -0.9887 -0.9887 -0.8199 -0.8199 0.0521 0.0521 0.4736 0.4736 0.6234 0.6234 0.9057 0.9057 1.1845 1.1845 2.3498 2.3498 2.6987 2.6987 2.7148 2.7148 Writing output data file CrxB3H8x2.save init_run : 0.90s CPU 0.92s WALL ( 1 calls) electrons : 318.39s CPU 241.29s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.02s WALL ( 1 calls) potinit : 0.24s CPU 0.46s WALL ( 1 calls) Called by electrons: c_bands : 318.38s CPU 241.28s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.08s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.54s CPU 0.52s WALL ( 266 calls) cegterg : 233.87s CPU 189.75s WALL ( 266 calls) Called by sum_band: Called by *egterg: h_psi : 196.90s CPU 136.64s WALL ( 4043 calls) s_psi : 11.17s CPU 8.02s WALL ( 4043 calls) g_psi : 0.74s CPU 0.68s WALL ( 3511 calls) cdiaghg : 37.51s CPU 34.98s WALL ( 3777 calls) cegterg:over : 16.09s CPU 14.81s WALL ( 3511 calls) cegterg:upda : 15.90s CPU 14.08s WALL ( 3511 calls) cegterg:last : 8.64s CPU 8.70s WALL ( 798 calls) cdiaghg:chol : 1.92s CPU 2.03s WALL ( 3777 calls) cdiaghg:inve : 1.55s CPU 1.36s WALL ( 3777 calls) cdiaghg:para : 2.26s CPU 2.08s WALL ( 7554 calls) Called by h_psi: h_psi:vloc : 168.62s CPU 115.69s WALL ( 4043 calls) h_psi:vnl : 27.43s CPU 20.19s WALL ( 4043 calls) add_vuspsi : 13.19s CPU 9.61s WALL ( 4043 calls) General routines calbec : 14.20s CPU 10.56s WALL ( 4043 calls) fft : 0.07s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 156.38s CPU 106.50s WALL ( 621784 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.65s CPU 2.22s WALL ( 532 calls) Parallel routines fft_scatter : 74.80s CPU 55.23s WALL ( 621807 calls) PWSCF : 5m56.67s CPU 5m51.18s WALL This run was terminated on: 20:20:52 3Aug2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=