Program PWSCF v.5.1.1 starts on 5Jun2015 at 8: 4:52 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaSe2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 46 36 10 1260 874 135 Max 48 37 11 1262 893 139 Sum 2221 1743 501 60515 42425 6539 bravais-lattice index = 14 lattice parameter (alat) = 16.2133 a.u. unit-cell volume = 1340.0837 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 38.0000 Ry charge density cutoff = 193.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 16.213277 celldm(2)= 1.000000 celldm(3)= 1.142879 celldm(4)= 0.829552 celldm(5)= 0.829552 celldm(6)= 0.834977 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.834977 0.550284 0.000000 ) a(3) = ( 0.948077 0.284315 0.571390 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.517356 -0.904234 ) b(2) = ( 0.000000 1.817242 -0.904234 ) b(3) = ( 0.000000 0.000000 1.750119 ) PseudoPot. # 1 for Ba read from file: /home/autes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Se read from file: /home/autes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 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 Ba 10.00 137.32700 Ba( 1.00) Se 6.00 78.96000 Se( 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: E 1 i 2 -E -1 -i -2 Cartesian axes number of k points= 312 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0128205 0.0038447 -0.0231855), wk = 0.0032051 k( 3) = ( 0.0256410 0.0076894 -0.0463710), wk = 0.0032051 k( 4) = ( 0.0384615 0.0115341 -0.0695564), wk = 0.0032051 k( 5) = ( 0.0512821 0.0153788 -0.0927419), wk = 0.0032051 k( 6) = ( 0.0641026 0.0192235 -0.1159274), wk = 0.0032051 k( 7) = ( 0.0769231 0.0230682 -0.1391129), wk = 0.0032051 k( 8) = ( 0.0897436 0.0269129 -0.1622984), wk = 0.0032051 k( 9) = ( 0.1025641 0.0307576 -0.1854838), wk = 0.0032051 k( 10) = ( 0.1153846 0.0346023 -0.2086693), wk = 0.0032051 k( 11) = ( 0.1282051 0.0384470 -0.2318548), wk = 0.0032051 k( 12) = ( 0.1410256 0.0422916 -0.2550403), wk = 0.0032051 k( 13) = ( 0.1538461 0.0461363 -0.2782258), wk = 0.0032051 k( 14) = ( 0.1666667 0.0499810 -0.3014113), wk = 0.0032051 k( 15) = ( 0.1794872 0.0538257 -0.3245967), wk = 0.0032051 k( 16) = ( 0.1923077 0.0576704 -0.3477822), wk = 0.0032051 k( 17) = ( 0.2051282 0.0615151 -0.3709677), wk = 0.0032051 k( 18) = ( 0.2179487 0.0653598 -0.3941532), wk = 0.0032051 k( 19) = ( 0.2307692 0.0692045 -0.4173387), wk = 0.0032051 k( 20) = ( 0.2435897 0.0730492 -0.4405241), wk = 0.0032051 k( 21) = ( 0.2564103 0.0768939 -0.4637096), wk = 0.0032051 k( 22) = ( 0.2692308 0.0807386 -0.4868951), wk = 0.0032051 k( 23) = ( 0.2820513 0.0845833 -0.5100806), wk = 0.0032051 k( 24) = ( 0.2948718 0.0884280 -0.5332661), wk = 0.0032051 k( 25) = ( 0.3076923 0.0922727 -0.5564515), wk = 0.0032051 k( 26) = ( 0.3205128 0.0961174 -0.5796370), wk = 0.0032051 k( 27) = ( 0.3333333 0.0999621 -0.6028225), wk = 0.0032051 k( 28) = ( 0.3461538 0.1038068 -0.6260080), wk = 0.0032051 k( 29) = ( 0.3589744 0.1076515 -0.6491935), wk = 0.0032051 k( 30) = ( 0.3717949 0.1114962 -0.6723789), wk = 0.0032051 k( 31) = ( 0.3846154 0.1153408 -0.6955644), wk = 0.0032051 k( 32) = ( 0.3974359 0.1191855 -0.7187499), wk = 0.0032051 k( 33) = ( 0.4102564 0.1230302 -0.7419354), wk = 0.0032051 k( 34) = ( 0.4230769 0.1268749 -0.7651209), wk = 0.0032051 k( 35) = ( 0.4358974 0.1307196 -0.7883064), wk = 0.0032051 k( 36) = ( 0.4487179 0.1345643 -0.8114918), wk = 0.0032051 k( 37) = ( 0.4615385 0.1384090 -0.8346773), wk = 0.0032051 k( 38) = ( 0.4743590 0.1422537 -0.8578628), wk = 0.0032051 k( 39) = ( 0.4871795 0.1460984 -0.8810483), wk = 0.0032051 k( 40) = ( 0.5000000 0.1499431 -0.9042338), wk = 0.0032051 k( 41) = ( 0.5000000 0.1499431 -0.9042338), wk = 0.0032051 k( 42) = ( 0.4838643 0.1451042 -0.9139584), wk = 0.0032051 k( 43) = ( 0.4677287 0.1402654 -0.9236831), wk = 0.0032051 k( 44) = ( 0.4515931 0.1354265 -0.9334078), wk = 0.0032051 k( 45) = ( 0.4515931 0.1354265 -0.9334078), wk = 0.0032051 k( 46) = ( 0.4530168 0.1358535 -0.9068127), wk = 0.0032051 k( 47) = ( 0.4544405 0.1362804 -0.8802176), wk = 0.0032051 k( 48) = ( 0.4558643 0.1367074 -0.8536224), wk = 0.0032051 k( 49) = ( 0.4572880 0.1371344 -0.8270273), wk = 0.0032051 k( 50) = ( 0.4587117 0.1375613 -0.8004322), wk = 0.0032051 k( 51) = ( 0.4601355 0.1379883 -0.7738371), wk = 0.0032051 k( 52) = ( 0.4615592 0.1384152 -0.7472420), wk = 0.0032051 k( 53) = ( 0.4629829 0.1388422 -0.7206469), wk = 0.0032051 k( 54) = ( 0.4644067 0.1392692 -0.6940518), wk = 0.0032051 k( 55) = ( 0.4658304 0.1396961 -0.6674567), wk = 0.0032051 k( 56) = ( 0.4672541 0.1401231 -0.6408616), wk = 0.0032051 k( 57) = ( 0.4686779 0.1405500 -0.6142664), wk = 0.0032051 k( 58) = ( 0.4701016 0.1409770 -0.5876713), wk = 0.0032051 k( 59) = ( 0.4715253 0.1414039 -0.5610762), wk = 0.0032051 k( 60) = ( 0.4729491 0.1418309 -0.5344811), wk = 0.0032051 k( 61) = ( 0.4743728 0.1422579 -0.5078860), wk = 0.0032051 k( 62) = ( 0.4757965 0.1426848 -0.4812909), wk = 0.0032051 k( 63) = ( 0.4772203 0.1431118 -0.4546958), wk = 0.0032051 k( 64) = ( 0.4786440 0.1435387 -0.4281007), wk = 0.0032051 k( 65) = ( 0.4800677 0.1439657 -0.4015056), wk = 0.0032051 k( 66) = ( 0.4814915 0.1443927 -0.3749105), wk = 0.0032051 k( 67) = ( 0.4829152 0.1448196 -0.3483153), wk = 0.0032051 k( 68) = ( 0.4843389 0.1452466 -0.3217202), wk = 0.0032051 k( 69) = ( 0.4857627 0.1456735 -0.2951251), wk = 0.0032051 k( 70) = ( 0.4871864 0.1461005 -0.2685300), wk = 0.0032051 k( 71) = ( 0.4886101 0.1465274 -0.2419349), wk = 0.0032051 k( 72) = ( 0.4900339 0.1469544 -0.2153398), wk = 0.0032051 k( 73) = ( 0.4914576 0.1473814 -0.1887447), wk = 0.0032051 k( 74) = ( 0.4928813 0.1478083 -0.1621496), wk = 0.0032051 k( 75) = ( 0.4943051 0.1482353 -0.1355545), wk = 0.0032051 k( 76) = ( 0.4957288 0.1486622 -0.1089594), wk = 0.0032051 k( 77) = ( 0.4971525 0.1490892 -0.0823642), wk = 0.0032051 k( 78) = ( 0.4985763 0.1495161 -0.0557691), wk = 0.0032051 k( 79) = ( 0.5000000 0.1499431 -0.0291740), wk = 0.0032051 k( 80) = ( 0.5000000 0.1499431 -0.0291740), wk = 0.0032051 k( 81) = ( 0.5076481 0.1244397 -0.0291740), wk = 0.0032051 k( 82) = ( 0.5152962 0.0989364 -0.0291740), wk = 0.0032051 k( 83) = ( 0.5229443 0.0734330 -0.0291740), wk = 0.0032051 k( 84) = ( 0.5305924 0.0479296 -0.0291740), wk = 0.0032051 k( 85) = ( 0.5382406 0.0224262 -0.0291740), wk = 0.0032051 k( 86) = ( 0.5458887 -0.0030772 -0.0291740), wk = 0.0032051 k( 87) = ( 0.5535368 -0.0285805 -0.0291740), wk = 0.0032051 k( 88) = ( 0.5611849 -0.0540839 -0.0291740), wk = 0.0032051 k( 89) = ( 0.5688330 -0.0795873 -0.0291740), wk = 0.0032051 k( 90) = ( 0.5764811 -0.1050907 -0.0291740), wk = 0.0032051 k( 91) = ( 0.5841292 -0.1305940 -0.0291740), wk = 0.0032051 k( 92) = ( 0.5917773 -0.1560974 -0.0291740), wk = 0.0032051 k( 93) = ( 0.5994254 -0.1816008 -0.0291740), wk = 0.0032051 k( 94) = ( 0.6070735 -0.2071042 -0.0291740), wk = 0.0032051 k( 95) = ( 0.6147217 -0.2326076 -0.0291740), wk = 0.0032051 k( 96) = ( 0.6223698 -0.2581109 -0.0291740), wk = 0.0032051 k( 97) = ( 0.6300179 -0.2836143 -0.0291740), wk = 0.0032051 k( 98) = ( 0.6376660 -0.3091177 -0.0291740), wk = 0.0032051 k( 99) = ( 0.6453141 -0.3346211 -0.0291740), wk = 0.0032051 k( 100) = ( 0.6529622 -0.3601244 -0.0291740), wk = 0.0032051 k( 101) = ( 0.6606103 -0.3856278 -0.0291740), wk = 0.0032051 k( 102) = ( 0.6682584 -0.4111312 -0.0291740), wk = 0.0032051 k( 103) = ( 0.6759065 -0.4366345 -0.0291740), wk = 0.0032051 k( 104) = ( 0.6835547 -0.4621379 -0.0291740), wk = 0.0032051 k( 105) = ( 0.6912028 -0.4876413 -0.0291740), wk = 0.0032051 k( 106) = ( 0.6988509 -0.5131447 -0.0291740), wk = 0.0032051 k( 107) = ( 0.7064990 -0.5386481 -0.0291740), wk = 0.0032051 k( 108) = ( 0.7141471 -0.5641514 -0.0291740), wk = 0.0032051 k( 109) = ( 0.7217952 -0.5896548 -0.0291740), wk = 0.0032051 k( 110) = ( 0.7294433 -0.6151582 -0.0291740), wk = 0.0032051 k( 111) = ( 0.7370914 -0.6406616 -0.0291740), wk = 0.0032051 k( 112) = ( 0.7447396 -0.6661649 -0.0291740), wk = 0.0032051 k( 113) = ( 0.7523877 -0.6916683 -0.0291740), wk = 0.0032051 k( 114) = ( 0.7600358 -0.7171717 -0.0291740), wk = 0.0032051 k( 115) = ( 0.7676839 -0.7426751 -0.0291740), wk = 0.0032051 k( 116) = ( 0.7753320 -0.7681785 -0.0291740), wk = 0.0032051 k( 117) = ( 0.7829801 -0.7936818 -0.0291740), wk = 0.0032051 k( 118) = ( 0.7906282 -0.8191852 -0.0291740), wk = 0.0032051 k( 119) = ( 0.2093718 -0.6981707 0.8750597), wk = 0.0032051 k( 120) = ( 0.2016173 -0.6723126 0.8750597), wk = 0.0032051 k( 121) = ( 0.1938628 -0.6464544 0.8750597), wk = 0.0032051 k( 122) = ( 0.1861083 -0.6205962 0.8750597), wk = 0.0032051 k( 123) = ( 0.1783537 -0.5947380 0.8750597), wk = 0.0032051 k( 124) = ( 0.1705992 -0.5688799 0.8750597), wk = 0.0032051 k( 125) = ( 0.1628447 -0.5430217 0.8750597), wk = 0.0032051 k( 126) = ( 0.1550902 -0.5171635 0.8750597), wk = 0.0032051 k( 127) = ( 0.1473357 -0.4913053 0.8750597), wk = 0.0032051 k( 128) = ( 0.1395812 -0.4654472 0.8750597), wk = 0.0032051 k( 129) = ( 0.1318267 -0.4395890 0.8750597), wk = 0.0032051 k( 130) = ( 0.1240722 -0.4137308 0.8750597), wk = 0.0032051 k( 131) = ( 0.1163177 -0.3878727 0.8750597), wk = 0.0032051 k( 132) = ( 0.1085631 -0.3620145 0.8750597), wk = 0.0032051 k( 133) = ( 0.1008086 -0.3361563 0.8750597), wk = 0.0032051 k( 134) = ( 0.0930541 -0.3102981 0.8750597), wk = 0.0032051 k( 135) = ( 0.0852996 -0.2844399 0.8750597), wk = 0.0032051 k( 136) = ( 0.0775451 -0.2585817 0.8750597), wk = 0.0032051 k( 137) = ( 0.0697906 -0.2327236 0.8750597), wk = 0.0032051 k( 138) = ( 0.0620361 -0.2068654 0.8750597), wk = 0.0032051 k( 139) = ( 0.0542816 -0.1810072 0.8750597), wk = 0.0032051 k( 140) = ( 0.0465271 -0.1551490 0.8750597), wk = 0.0032051 k( 141) = ( 0.0387726 -0.1292909 0.8750597), wk = 0.0032051 k( 142) = ( 0.0310180 -0.1034327 0.8750597), wk = 0.0032051 k( 143) = ( 0.0232635 -0.0775745 0.8750597), wk = 0.0032051 k( 144) = ( 0.0155090 -0.0517163 0.8750597), wk = 0.0032051 k( 145) = ( 0.0077545 -0.0258582 0.8750597), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.8750597), wk = 0.0032051 k( 147) = ( 0.0000000 0.0000000 0.8750597), wk = 0.0032051 k( 148) = ( 0.0261146 0.0078314 0.8750597), wk = 0.0032051 k( 149) = ( 0.0522292 0.0156628 0.8750598), wk = 0.0032051 k( 150) = ( 0.0783439 0.0234942 0.8750597), wk = 0.0032051 k( 151) = ( 0.1044585 0.0313257 0.8750598), wk = 0.0032051 k( 152) = ( 0.1305731 0.0391571 0.8750598), wk = 0.0032051 k( 153) = ( 0.1566877 0.0469885 0.8750597), wk = 0.0032051 k( 154) = ( 0.1828023 0.0548199 0.8750597), wk = 0.0032051 k( 155) = ( 0.2089169 0.0626513 0.8750597), wk = 0.0032051 k( 156) = ( 0.2350315 0.0704827 0.8750598), wk = 0.0032051 k( 157) = ( 0.2611462 0.0783141 0.8750597), wk = 0.0032051 k( 158) = ( 0.2872608 0.0861455 0.8750597), wk = 0.0032051 k( 159) = ( 0.3133754 0.0939770 0.8750598), wk = 0.0032051 k( 160) = ( 0.3394900 0.1018084 0.8750597), wk = 0.0032051 k( 161) = ( 0.3656046 0.1096398 0.8750597), wk = 0.0032051 k( 162) = ( 0.3917192 0.1174712 0.8750598), wk = 0.0032051 k( 163) = ( 0.4178339 0.1253026 0.8750597), wk = 0.0032051 k( 164) = ( 0.4439485 0.1331340 0.8750597), wk = 0.0032051 k( 165) = ( 0.4700631 0.1409654 0.8750598), wk = 0.0032051 k( 166) = ( 0.4961777 0.1487969 0.8750597), wk = 0.0032051 k( 167) = ( 0.5222923 0.1566283 0.8750597), wk = 0.0032051 k( 168) = ( 0.5484069 0.1644597 0.8750598), wk = 0.0032051 k( 169) = ( 0.5000000 0.1499431 -0.9042338), wk = 0.0032051 k( 170) = ( 0.5076215 0.1245283 -0.9042338), wk = 0.0032051 k( 171) = ( 0.5152431 0.0991135 -0.9042338), wk = 0.0032051 k( 172) = ( 0.5228647 0.0736987 -0.9042338), wk = 0.0032051 k( 173) = ( 0.5304862 0.0482838 -0.9042338), wk = 0.0032051 k( 174) = ( 0.5381078 0.0228690 -0.9042338), wk = 0.0032051 k( 175) = ( 0.5457293 -0.0025458 -0.9042338), wk = 0.0032051 k( 176) = ( 0.5533509 -0.0279606 -0.9042338), wk = 0.0032051 k( 177) = ( 0.5609724 -0.0533754 -0.9042338), wk = 0.0032051 k( 178) = ( 0.5685940 -0.0787902 -0.9042338), wk = 0.0032051 k( 179) = ( 0.5762155 -0.1042050 -0.9042338), wk = 0.0032051 k( 180) = ( 0.5838371 -0.1296198 -0.9042338), wk = 0.0032051 k( 181) = ( 0.5914586 -0.1550346 -0.9042338), wk = 0.0032051 k( 182) = ( 0.5990802 -0.1804495 -0.9042338), wk = 0.0032051 k( 183) = ( 0.6067017 -0.2058643 -0.9042338), wk = 0.0032051 k( 184) = ( 0.6143233 -0.2312791 -0.9042338), wk = 0.0032051 k( 185) = ( 0.6219448 -0.2566939 -0.9042338), wk = 0.0032051 k( 186) = ( 0.6295664 -0.2821087 -0.9042338), wk = 0.0032051 k( 187) = ( 0.6371879 -0.3075235 -0.9042338), wk = 0.0032051 k( 188) = ( 0.6448095 -0.3329383 -0.9042338), wk = 0.0032051 k( 189) = ( 0.6524310 -0.3583532 -0.9042338), wk = 0.0032051 k( 190) = ( 0.6600526 -0.3837680 -0.9042338), wk = 0.0032051 k( 191) = ( 0.3399474 -1.1335880 -0.0000000), wk = 0.0032051 k( 192) = ( 0.3322213 -1.1078246 -0.0000000), wk = 0.0032051 k( 193) = ( 0.3244953 -1.0820613 -0.0000000), wk = 0.0032051 k( 194) = ( 0.3167692 -1.0562979 -0.0000000), wk = 0.0032051 k( 195) = ( 0.3090431 -1.0305345 -0.0000000), wk = 0.0032051 k( 196) = ( 0.3013170 -1.0047712 -0.0000000), wk = 0.0032051 k( 197) = ( 0.2935909 -0.9790078 -0.0000000), wk = 0.0032051 k( 198) = ( 0.2858649 -0.9532445 -0.0000000), wk = 0.0032051 k( 199) = ( 0.2781388 -0.9274811 -0.0000000), wk = 0.0032051 k( 200) = ( 0.2704127 -0.9017177 -0.0000000), wk = 0.0032051 k( 201) = ( 0.2626866 -0.8759543 -0.0000000), wk = 0.0032051 k( 202) = ( 0.2549606 -0.8501910 -0.0000000), wk = 0.0032051 k( 203) = ( 0.2472345 -0.8244276 -0.0000000), wk = 0.0032051 k( 204) = ( 0.2395084 -0.7986643 -0.0000000), wk = 0.0032051 k( 205) = ( 0.2317823 -0.7729009 -0.0000000), wk = 0.0032051 k( 206) = ( 0.2240563 -0.7471376 -0.0000000), wk = 0.0032051 k( 207) = ( 0.2163302 -0.7213742 -0.0000000), wk = 0.0032051 k( 208) = ( 0.2086041 -0.6956108 -0.0000000), wk = 0.0032051 k( 209) = ( 0.2008780 -0.6698474 -0.0000000), wk = 0.0032051 k( 210) = ( 0.1931519 -0.6440841 -0.0000000), wk = 0.0032051 k( 211) = ( 0.1854259 -0.6183207 -0.0000000), wk = 0.0032051 k( 212) = ( 0.1776998 -0.5925574 -0.0000000), wk = 0.0032051 k( 213) = ( 0.1699737 -0.5667940 -0.0000000), wk = 0.0032051 k( 214) = ( 0.1622476 -0.5410306 -0.0000000), wk = 0.0032051 k( 215) = ( 0.1545216 -0.5152673 -0.0000000), wk = 0.0032051 k( 216) = ( 0.1467955 -0.4895039 -0.0000000), wk = 0.0032051 k( 217) = ( 0.1390694 -0.4637405 -0.0000000), wk = 0.0032051 k( 218) = ( 0.1313433 -0.4379772 -0.0000000), wk = 0.0032051 k( 219) = ( 0.1236172 -0.4122138 -0.0000000), wk = 0.0032051 k( 220) = ( 0.1158912 -0.3864504 -0.0000000), wk = 0.0032051 k( 221) = ( 0.1081651 -0.3606871 -0.0000000), wk = 0.0032051 k( 222) = ( 0.1004390 -0.3349237 -0.0000000), wk = 0.0032051 k( 223) = ( 0.0927129 -0.3091604 -0.0000000), wk = 0.0032051 k( 224) = ( 0.0849869 -0.2833970 -0.0000000), wk = 0.0032051 k( 225) = ( 0.0772608 -0.2576336 -0.0000000), wk = 0.0032051 k( 226) = ( 0.0695347 -0.2318703 -0.0000000), wk = 0.0032051 k( 227) = ( 0.0618086 -0.2061069 -0.0000000), wk = 0.0032051 k( 228) = ( 0.0540825 -0.1803435 -0.0000000), wk = 0.0032051 k( 229) = ( 0.0463565 -0.1545802 -0.0000000), wk = 0.0032051 k( 230) = ( 0.0386304 -0.1288168 -0.0000000), wk = 0.0032051 k( 231) = ( 0.0309043 -0.1030535 -0.0000000), wk = 0.0032051 k( 232) = ( 0.0231782 -0.0772901 -0.0000000), wk = 0.0032051 k( 233) = ( 0.0154521 -0.0515267 -0.0000000), wk = 0.0032051 k( 234) = ( 0.0077261 -0.0257634 -0.0000000), wk = 0.0032051 k( 235) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 236) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 237) = ( 0.0131579 -0.0199652 -0.0118978), wk = 0.0032051 k( 238) = ( 0.0263158 -0.0399304 -0.0237956), wk = 0.0032051 k( 239) = ( 0.0394737 -0.0598956 -0.0356934), wk = 0.0032051 k( 240) = ( 0.0526316 -0.0798608 -0.0475913), wk = 0.0032051 k( 241) = ( 0.0657895 -0.0998260 -0.0594891), wk = 0.0032051 k( 242) = ( 0.0789474 -0.1197913 -0.0713869), wk = 0.0032051 k( 243) = ( 0.0921053 -0.1397565 -0.0832847), wk = 0.0032051 k( 244) = ( 0.1052632 -0.1597217 -0.0951825), wk = 0.0032051 k( 245) = ( 0.1184210 -0.1796869 -0.1070803), wk = 0.0032051 k( 246) = ( 0.1315790 -0.1996521 -0.1189781), wk = 0.0032051 k( 247) = ( 0.1447368 -0.2196173 -0.1308759), wk = 0.0032051 k( 248) = ( 0.1578947 -0.2395825 -0.1427738), wk = 0.0032051 k( 249) = ( 0.1710526 -0.2595477 -0.1546716), wk = 0.0032051 k( 250) = ( 0.1842105 -0.2795129 -0.1665694), wk = 0.0032051 k( 251) = ( 0.1973684 -0.2994781 -0.1784672), wk = 0.0032051 k( 252) = ( 0.2105263 -0.3194434 -0.1903650), wk = 0.0032051 k( 253) = ( 0.2236842 -0.3394086 -0.2022628), wk = 0.0032051 k( 254) = ( 0.2368421 -0.3593738 -0.2141606), wk = 0.0032051 k( 255) = ( 0.2500000 -0.3793390 -0.2260584), wk = 0.0032051 k( 256) = ( 0.2631579 -0.3993042 -0.2379562), wk = 0.0032051 k( 257) = ( 0.2763158 -0.4192694 -0.2498541), wk = 0.0032051 k( 258) = ( 0.2894737 -0.4392346 -0.2617519), wk = 0.0032051 k( 259) = ( 0.3026316 -0.4591998 -0.2736497), wk = 0.0032051 k( 260) = ( 0.3157895 -0.4791650 -0.2855475), wk = 0.0032051 k( 261) = ( 0.3289474 -0.4991303 -0.2974453), wk = 0.0032051 k( 262) = ( 0.3421053 -0.5190955 -0.3093431), wk = 0.0032051 k( 263) = ( 0.3552632 -0.5390607 -0.3212409), wk = 0.0032051 k( 264) = ( 0.3684211 -0.5590259 -0.3331388), wk = 0.0032051 k( 265) = ( 0.3815789 -0.5789911 -0.3450366), wk = 0.0032051 k( 266) = ( 0.3947368 -0.5989563 -0.3569344), wk = 0.0032051 k( 267) = ( 0.4078947 -0.6189215 -0.3688322), wk = 0.0032051 k( 268) = ( 0.4210526 -0.6388867 -0.3807300), wk = 0.0032051 k( 269) = ( 0.4342105 -0.6588519 -0.3926278), wk = 0.0032051 k( 270) = ( 0.4473684 -0.6788171 -0.4045256), wk = 0.0032051 k( 271) = ( 0.4605263 -0.6987824 -0.4164234), wk = 0.0032051 k( 272) = ( 0.4736842 -0.7187476 -0.4283213), wk = 0.0032051 k( 273) = ( 0.4868421 -0.7387128 -0.4402191), wk = 0.0032051 k( 274) = ( 0.5000000 -0.7586780 -0.4521169), wk = 0.0032051 k( 275) = ( 0.5000000 -0.7586780 0.4229429), wk = 0.0032051 k( 276) = ( 0.4864865 -0.7381732 0.4115120), wk = 0.0032051 k( 277) = ( 0.4729730 -0.7176684 0.4000811), wk = 0.0032051 k( 278) = ( 0.4594595 -0.6971635 0.3886502), wk = 0.0032051 k( 279) = ( 0.4459459 -0.6766587 0.3772193), wk = 0.0032051 k( 280) = ( 0.4324324 -0.6561539 0.3657884), wk = 0.0032051 k( 281) = ( 0.4189189 -0.6356491 0.3543575), wk = 0.0032051 k( 282) = ( 0.4054054 -0.6151443 0.3429267), wk = 0.0032051 k( 283) = ( 0.3918919 -0.5946395 0.3314958), wk = 0.0032051 k( 284) = ( 0.3783784 -0.5741347 0.3200649), wk = 0.0032051 k( 285) = ( 0.3648649 -0.5536299 0.3086340), wk = 0.0032051 k( 286) = ( 0.3513514 -0.5331251 0.2972031), wk = 0.0032051 k( 287) = ( 0.3378378 -0.5126203 0.2857722), wk = 0.0032051 k( 288) = ( 0.3243243 -0.4921154 0.2743413), wk = 0.0032051 k( 289) = ( 0.3108108 -0.4716106 0.2629104), wk = 0.0032051 k( 290) = ( 0.2972973 -0.4511058 0.2514795), wk = 0.0032051 k( 291) = ( 0.2837838 -0.4306010 0.2400487), wk = 0.0032051 k( 292) = ( 0.2702703 -0.4100962 0.2286178), wk = 0.0032051 k( 293) = ( 0.2567568 -0.3895914 0.2171869), wk = 0.0032051 k( 294) = ( 0.2432432 -0.3690866 0.2057560), wk = 0.0032051 k( 295) = ( 0.2297297 -0.3485818 0.1943251), wk = 0.0032051 k( 296) = ( 0.2162162 -0.3280770 0.1828942), wk = 0.0032051 k( 297) = ( 0.2027027 -0.3075721 0.1714633), wk = 0.0032051 k( 298) = ( 0.1891892 -0.2870673 0.1600324), wk = 0.0032051 k( 299) = ( 0.1756757 -0.2665625 0.1486016), wk = 0.0032051 k( 300) = ( 0.1621622 -0.2460577 0.1371707), wk = 0.0032051 k( 301) = ( 0.1486486 -0.2255529 0.1257398), wk = 0.0032051 k( 302) = ( 0.1351351 -0.2050481 0.1143089), wk = 0.0032051 k( 303) = ( 0.1216216 -0.1845433 0.1028780), wk = 0.0032051 k( 304) = ( 0.1081081 -0.1640385 0.0914471), wk = 0.0032051 k( 305) = ( 0.0945946 -0.1435337 0.0800162), wk = 0.0032051 k( 306) = ( 0.0810811 -0.1230289 0.0685853), wk = 0.0032051 k( 307) = ( 0.0675676 -0.1025241 0.0571544), wk = 0.0032051 k( 308) = ( 0.0540540 -0.0820192 0.0457235), wk = 0.0032051 k( 309) = ( 0.0405405 -0.0615144 0.0342927), wk = 0.0032051 k( 310) = ( 0.0270270 -0.0410096 0.0228618), wk = 0.0032051 k( 311) = ( 0.0135135 -0.0205048 0.0114309), wk = 0.0032051 k( 312) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 2) = ( 0.0128205 0.0128205 0.0000000), wk = 0.0032051 k( 3) = ( 0.0256410 0.0256410 0.0000000), wk = 0.0032051 k( 4) = ( 0.0384615 0.0384615 0.0000000), wk = 0.0032051 k( 5) = ( 0.0512821 0.0512821 0.0000000), wk = 0.0032051 k( 6) = ( 0.0641026 0.0641026 0.0000000), wk = 0.0032051 k( 7) = ( 0.0769231 0.0769231 0.0000000), wk = 0.0032051 k( 8) = ( 0.0897436 0.0897436 0.0000000), wk = 0.0032051 k( 9) = ( 0.1025641 0.1025641 0.0000000), wk = 0.0032051 k( 10) = ( 0.1153846 0.1153846 0.0000000), wk = 0.0032051 k( 11) = ( 0.1282051 0.1282051 0.0000000), wk = 0.0032051 k( 12) = ( 0.1410256 0.1410256 0.0000000), wk = 0.0032051 k( 13) = ( 0.1538461 0.1538462 0.0000000), wk = 0.0032051 k( 14) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0032051 k( 15) = ( 0.1794872 0.1794872 0.0000000), wk = 0.0032051 k( 16) = ( 0.1923077 0.1923077 0.0000000), wk = 0.0032051 k( 17) = ( 0.2051282 0.2051282 0.0000000), wk = 0.0032051 k( 18) = ( 0.2179487 0.2179487 0.0000000), wk = 0.0032051 k( 19) = ( 0.2307692 0.2307692 0.0000000), wk = 0.0032051 k( 20) = ( 0.2435897 0.2435897 0.0000000), wk = 0.0032051 k( 21) = ( 0.2564103 0.2564103 0.0000000), wk = 0.0032051 k( 22) = ( 0.2692308 0.2692308 0.0000000), wk = 0.0032051 k( 23) = ( 0.2820513 0.2820513 0.0000000), wk = 0.0032051 k( 24) = ( 0.2948718 0.2948718 0.0000000), wk = 0.0032051 k( 25) = ( 0.3076923 0.3076923 0.0000000), wk = 0.0032051 k( 26) = ( 0.3205128 0.3205128 0.0000000), wk = 0.0032051 k( 27) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0032051 k( 28) = ( 0.3461538 0.3461539 0.0000000), wk = 0.0032051 k( 29) = ( 0.3589744 0.3589744 0.0000000), wk = 0.0032051 k( 30) = ( 0.3717949 0.3717949 0.0000000), wk = 0.0032051 k( 31) = ( 0.3846154 0.3846154 0.0000000), wk = 0.0032051 k( 32) = ( 0.3974359 0.3974359 0.0000000), wk = 0.0032051 k( 33) = ( 0.4102564 0.4102564 0.0000000), wk = 0.0032051 k( 34) = ( 0.4230769 0.4230769 0.0000000), wk = 0.0032051 k( 35) = ( 0.4358974 0.4358974 0.0000000), wk = 0.0032051 k( 36) = ( 0.4487179 0.4487180 0.0000000), wk = 0.0032051 k( 37) = ( 0.4615385 0.4615385 0.0000000), wk = 0.0032051 k( 38) = ( 0.4743590 0.4743590 0.0000000), wk = 0.0032051 k( 39) = ( 0.4871795 0.4871795 0.0000000), wk = 0.0032051 k( 40) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 41) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 42) = ( 0.4838643 0.4838643 -0.0222302), wk = 0.0032051 k( 43) = ( 0.4677287 0.4677287 -0.0444603), wk = 0.0032051 k( 44) = ( 0.4515931 0.4515931 -0.0666905), wk = 0.0032051 k( 45) = ( 0.4515931 0.4515931 -0.0666905), wk = 0.0032051 k( 46) = ( 0.4530168 0.4530168 -0.0500232), wk = 0.0032051 k( 47) = ( 0.4544405 0.4544405 -0.0333558), wk = 0.0032051 k( 48) = ( 0.4558643 0.4558643 -0.0166884), wk = 0.0032051 k( 49) = ( 0.4572880 0.4572880 -0.0000210), wk = 0.0032051 k( 50) = ( 0.4587117 0.4587117 0.0166463), wk = 0.0032051 k( 51) = ( 0.4601355 0.4601355 0.0333137), wk = 0.0032051 k( 52) = ( 0.4615592 0.4615592 0.0499811), wk = 0.0032051 k( 53) = ( 0.4629829 0.4629829 0.0666484), wk = 0.0032051 k( 54) = ( 0.4644067 0.4644067 0.0833158), wk = 0.0032051 k( 55) = ( 0.4658304 0.4658304 0.0999832), wk = 0.0032051 k( 56) = ( 0.4672541 0.4672541 0.1166505), wk = 0.0032051 k( 57) = ( 0.4686779 0.4686779 0.1333179), wk = 0.0032051 k( 58) = ( 0.4701016 0.4701016 0.1499853), wk = 0.0032051 k( 59) = ( 0.4715253 0.4715253 0.1666526), wk = 0.0032051 k( 60) = ( 0.4729491 0.4729491 0.1833200), wk = 0.0032051 k( 61) = ( 0.4743728 0.4743728 0.1999874), wk = 0.0032051 k( 62) = ( 0.4757965 0.4757965 0.2166547), wk = 0.0032051 k( 63) = ( 0.4772203 0.4772203 0.2333221), wk = 0.0032051 k( 64) = ( 0.4786440 0.4786440 0.2499895), wk = 0.0032051 k( 65) = ( 0.4800677 0.4800677 0.2666568), wk = 0.0032051 k( 66) = ( 0.4814915 0.4814915 0.2833242), wk = 0.0032051 k( 67) = ( 0.4829152 0.4829152 0.2999916), wk = 0.0032051 k( 68) = ( 0.4843389 0.4843389 0.3166590), wk = 0.0032051 k( 69) = ( 0.4857627 0.4857627 0.3333263), wk = 0.0032051 k( 70) = ( 0.4871864 0.4871864 0.3499937), wk = 0.0032051 k( 71) = ( 0.4886101 0.4886101 0.3666611), wk = 0.0032051 k( 72) = ( 0.4900339 0.4900339 0.3833284), wk = 0.0032051 k( 73) = ( 0.4914576 0.4914576 0.3999958), wk = 0.0032051 k( 74) = ( 0.4928813 0.4928813 0.4166632), wk = 0.0032051 k( 75) = ( 0.4943051 0.4943051 0.4333305), wk = 0.0032051 k( 76) = ( 0.4957288 0.4957288 0.4499979), wk = 0.0032051 k( 77) = ( 0.4971525 0.4971525 0.4666653), wk = 0.0032051 k( 78) = ( 0.4985763 0.4985763 0.4833326), wk = 0.0032051 k( 79) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 80) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032051 k( 81) = ( 0.5076481 0.4923519 0.5000000), wk = 0.0032051 k( 82) = ( 0.5152962 0.4847038 0.5000000), wk = 0.0032051 k( 83) = ( 0.5229443 0.4770557 0.5000000), wk = 0.0032051 k( 84) = ( 0.5305924 0.4694076 0.5000000), wk = 0.0032051 k( 85) = ( 0.5382406 0.4617594 0.5000000), wk = 0.0032051 k( 86) = ( 0.5458887 0.4541113 0.5000000), wk = 0.0032051 k( 87) = ( 0.5535368 0.4464632 0.5000000), wk = 0.0032051 k( 88) = ( 0.5611849 0.4388151 0.5000000), wk = 0.0032051 k( 89) = ( 0.5688330 0.4311670 0.5000000), wk = 0.0032051 k( 90) = ( 0.5764811 0.4235189 0.5000000), wk = 0.0032051 k( 91) = ( 0.5841292 0.4158708 0.5000000), wk = 0.0032051 k( 92) = ( 0.5917773 0.4082227 0.5000000), wk = 0.0032051 k( 93) = ( 0.5994254 0.4005746 0.5000000), wk = 0.0032051 k( 94) = ( 0.6070735 0.3929264 0.5000000), wk = 0.0032051 k( 95) = ( 0.6147217 0.3852783 0.5000000), wk = 0.0032051 k( 96) = ( 0.6223698 0.3776302 0.5000000), wk = 0.0032051 k( 97) = ( 0.6300179 0.3699821 0.5000000), wk = 0.0032051 k( 98) = ( 0.6376660 0.3623340 0.5000000), wk = 0.0032051 k( 99) = ( 0.6453141 0.3546859 0.5000000), wk = 0.0032051 k( 100) = ( 0.6529622 0.3470378 0.5000000), wk = 0.0032051 k( 101) = ( 0.6606103 0.3393897 0.5000000), wk = 0.0032051 k( 102) = ( 0.6682584 0.3317416 0.5000000), wk = 0.0032051 k( 103) = ( 0.6759065 0.3240935 0.5000000), wk = 0.0032051 k( 104) = ( 0.6835547 0.3164453 0.5000000), wk = 0.0032051 k( 105) = ( 0.6912028 0.3087972 0.5000000), wk = 0.0032051 k( 106) = ( 0.6988509 0.3011491 0.5000000), wk = 0.0032051 k( 107) = ( 0.7064990 0.2935010 0.5000000), wk = 0.0032051 k( 108) = ( 0.7141471 0.2858529 0.5000000), wk = 0.0032051 k( 109) = ( 0.7217952 0.2782048 0.5000000), wk = 0.0032051 k( 110) = ( 0.7294433 0.2705567 0.5000000), wk = 0.0032051 k( 111) = ( 0.7370914 0.2629086 0.5000000), wk = 0.0032051 k( 112) = ( 0.7447396 0.2552605 0.5000000), wk = 0.0032051 k( 113) = ( 0.7523877 0.2476123 0.5000000), wk = 0.0032051 k( 114) = ( 0.7600358 0.2399642 0.5000000), wk = 0.0032051 k( 115) = ( 0.7676839 0.2323161 0.5000000), wk = 0.0032051 k( 116) = ( 0.7753320 0.2246680 0.5000000), wk = 0.0032051 k( 117) = ( 0.7829801 0.2170199 0.5000000), wk = 0.0032051 k( 118) = ( 0.7906282 0.2093718 0.5000000), wk = 0.0032051 k( 119) = ( 0.2093718 -0.2093718 0.5000000), wk = 0.0032051 k( 120) = ( 0.2016173 -0.2016173 0.5000000), wk = 0.0032051 k( 121) = ( 0.1938628 -0.1938628 0.5000000), wk = 0.0032051 k( 122) = ( 0.1861083 -0.1861083 0.5000000), wk = 0.0032051 k( 123) = ( 0.1783537 -0.1783537 0.5000000), wk = 0.0032051 k( 124) = ( 0.1705992 -0.1705992 0.5000000), wk = 0.0032051 k( 125) = ( 0.1628447 -0.1628447 0.5000000), wk = 0.0032051 k( 126) = ( 0.1550902 -0.1550902 0.5000000), wk = 0.0032051 k( 127) = ( 0.1473357 -0.1473357 0.5000000), wk = 0.0032051 k( 128) = ( 0.1395812 -0.1395812 0.5000000), wk = 0.0032051 k( 129) = ( 0.1318267 -0.1318267 0.5000000), wk = 0.0032051 k( 130) = ( 0.1240722 -0.1240722 0.5000000), wk = 0.0032051 k( 131) = ( 0.1163177 -0.1163177 0.5000000), wk = 0.0032051 k( 132) = ( 0.1085631 -0.1085631 0.5000000), wk = 0.0032051 k( 133) = ( 0.1008086 -0.1008086 0.5000000), wk = 0.0032051 k( 134) = ( 0.0930541 -0.0930541 0.5000000), wk = 0.0032051 k( 135) = ( 0.0852996 -0.0852996 0.5000000), wk = 0.0032051 k( 136) = ( 0.0775451 -0.0775451 0.5000000), wk = 0.0032051 k( 137) = ( 0.0697906 -0.0697906 0.5000000), wk = 0.0032051 k( 138) = ( 0.0620361 -0.0620361 0.5000000), wk = 0.0032051 k( 139) = ( 0.0542816 -0.0542816 0.5000000), wk = 0.0032051 k( 140) = ( 0.0465271 -0.0465271 0.5000000), wk = 0.0032051 k( 141) = ( 0.0387726 -0.0387725 0.5000000), wk = 0.0032051 k( 142) = ( 0.0310180 -0.0310180 0.5000000), wk = 0.0032051 k( 143) = ( 0.0232635 -0.0232635 0.5000000), wk = 0.0032051 k( 144) = ( 0.0155090 -0.0155090 0.5000000), wk = 0.0032051 k( 145) = ( 0.0077545 -0.0077545 0.5000000), wk = 0.0032051 k( 146) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 147) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032051 k( 148) = ( 0.0261146 0.0261146 0.5269853), wk = 0.0032051 k( 149) = ( 0.0522292 0.0522292 0.5539705), wk = 0.0032051 k( 150) = ( 0.0783439 0.0783439 0.5809558), wk = 0.0032051 k( 151) = ( 0.1044585 0.1044585 0.6079410), wk = 0.0032051 k( 152) = ( 0.1305731 0.1305731 0.6349263), wk = 0.0032051 k( 153) = ( 0.1566877 0.1566877 0.6619116), wk = 0.0032051 k( 154) = ( 0.1828023 0.1828023 0.6888968), wk = 0.0032051 k( 155) = ( 0.2089169 0.2089169 0.7158821), wk = 0.0032051 k( 156) = ( 0.2350315 0.2350315 0.7428674), wk = 0.0032051 k( 157) = ( 0.2611462 0.2611462 0.7698526), wk = 0.0032051 k( 158) = ( 0.2872608 0.2872608 0.7968379), wk = 0.0032051 k( 159) = ( 0.3133754 0.3133754 0.8238232), wk = 0.0032051 k( 160) = ( 0.3394900 0.3394900 0.8508084), wk = 0.0032051 k( 161) = ( 0.3656046 0.3656046 0.8777937), wk = 0.0032051 k( 162) = ( 0.3917192 0.3917192 0.9047790), wk = 0.0032051 k( 163) = ( 0.4178339 0.4178339 0.9317642), wk = 0.0032051 k( 164) = ( 0.4439485 0.4439485 0.9587495), wk = 0.0032051 k( 165) = ( 0.4700631 0.4700631 0.9857347), wk = 0.0032051 k( 166) = ( 0.4961777 0.4961777 1.0127200), wk = 0.0032051 k( 167) = ( 0.5222923 0.5222923 1.0397053), wk = 0.0032051 k( 168) = ( 0.5484069 0.5484069 1.0666905), wk = 0.0032051 k( 169) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0032051 k( 170) = ( 0.5076215 0.4923785 0.0000000), wk = 0.0032051 k( 171) = ( 0.5152431 0.4847569 0.0000000), wk = 0.0032051 k( 172) = ( 0.5228647 0.4771353 0.0000000), wk = 0.0032051 k( 173) = ( 0.5304862 0.4695138 0.0000000), wk = 0.0032051 k( 174) = ( 0.5381078 0.4618922 0.0000000), wk = 0.0032051 k( 175) = ( 0.5457293 0.4542707 0.0000000), wk = 0.0032051 k( 176) = ( 0.5533509 0.4466491 0.0000000), wk = 0.0032051 k( 177) = ( 0.5609724 0.4390276 0.0000000), wk = 0.0032051 k( 178) = ( 0.5685940 0.4314060 0.0000000), wk = 0.0032051 k( 179) = ( 0.5762155 0.4237845 0.0000000), wk = 0.0032051 k( 180) = ( 0.5838371 0.4161629 0.0000000), wk = 0.0032051 k( 181) = ( 0.5914586 0.4085414 0.0000000), wk = 0.0032051 k( 182) = ( 0.5990802 0.4009198 0.0000000), wk = 0.0032051 k( 183) = ( 0.6067017 0.3932983 0.0000000), wk = 0.0032051 k( 184) = ( 0.6143233 0.3856767 0.0000000), wk = 0.0032051 k( 185) = ( 0.6219448 0.3780552 0.0000000), wk = 0.0032051 k( 186) = ( 0.6295664 0.3704336 0.0000000), wk = 0.0032051 k( 187) = ( 0.6371879 0.3628121 0.0000000), wk = 0.0032051 k( 188) = ( 0.6448095 0.3551905 0.0000000), wk = 0.0032051 k( 189) = ( 0.6524310 0.3475690 0.0000000), wk = 0.0032051 k( 190) = ( 0.6600526 0.3399474 0.0000000), wk = 0.0032051 k( 191) = ( 0.3399474 -0.3399474 -0.0000000), wk = 0.0032051 k( 192) = ( 0.3322213 -0.3322213 0.0000000), wk = 0.0032051 k( 193) = ( 0.3244953 -0.3244952 0.0000000), wk = 0.0032051 k( 194) = ( 0.3167692 -0.3167692 0.0000000), wk = 0.0032051 k( 195) = ( 0.3090431 -0.3090431 0.0000000), wk = 0.0032051 k( 196) = ( 0.3013170 -0.3013170 -0.0000000), wk = 0.0032051 k( 197) = ( 0.2935909 -0.2935909 0.0000000), wk = 0.0032051 k( 198) = ( 0.2858649 -0.2858649 0.0000000), wk = 0.0032051 k( 199) = ( 0.2781388 -0.2781388 -0.0000000), wk = 0.0032051 k( 200) = ( 0.2704127 -0.2704127 0.0000000), wk = 0.0032051 k( 201) = ( 0.2626866 -0.2626866 0.0000000), wk = 0.0032051 k( 202) = ( 0.2549606 -0.2549606 0.0000000), wk = 0.0032051 k( 203) = ( 0.2472345 -0.2472345 0.0000000), wk = 0.0032051 k( 204) = ( 0.2395084 -0.2395084 0.0000000), wk = 0.0032051 k( 205) = ( 0.2317823 -0.2317823 0.0000000), wk = 0.0032051 k( 206) = ( 0.2240563 -0.2240563 0.0000000), wk = 0.0032051 k( 207) = ( 0.2163302 -0.2163302 0.0000000), wk = 0.0032051 k( 208) = ( 0.2086041 -0.2086041 0.0000000), wk = 0.0032051 k( 209) = ( 0.2008780 -0.2008780 0.0000000), wk = 0.0032051 k( 210) = ( 0.1931519 -0.1931519 0.0000000), wk = 0.0032051 k( 211) = ( 0.1854259 -0.1854259 0.0000000), wk = 0.0032051 k( 212) = ( 0.1776998 -0.1776998 0.0000000), wk = 0.0032051 k( 213) = ( 0.1699737 -0.1699737 0.0000000), wk = 0.0032051 k( 214) = ( 0.1622476 -0.1622476 0.0000000), wk = 0.0032051 k( 215) = ( 0.1545216 -0.1545215 0.0000000), wk = 0.0032051 k( 216) = ( 0.1467955 -0.1467955 0.0000000), wk = 0.0032051 k( 217) = ( 0.1390694 -0.1390694 0.0000000), wk = 0.0032051 k( 218) = ( 0.1313433 -0.1313433 0.0000000), wk = 0.0032051 k( 219) = ( 0.1236172 -0.1236172 0.0000000), wk = 0.0032051 k( 220) = ( 0.1158912 -0.1158912 0.0000000), wk = 0.0032051 k( 221) = ( 0.1081651 -0.1081651 0.0000000), wk = 0.0032051 k( 222) = ( 0.1004390 -0.1004390 0.0000000), wk = 0.0032051 k( 223) = ( 0.0927129 -0.0927129 0.0000000), wk = 0.0032051 k( 224) = ( 0.0849869 -0.0849869 0.0000000), wk = 0.0032051 k( 225) = ( 0.0772608 -0.0772608 0.0000000), wk = 0.0032051 k( 226) = ( 0.0695347 -0.0695347 0.0000000), wk = 0.0032051 k( 227) = ( 0.0618086 -0.0618086 0.0000000), wk = 0.0032051 k( 228) = ( 0.0540825 -0.0540825 0.0000000), wk = 0.0032051 k( 229) = ( 0.0463565 -0.0463565 0.0000000), wk = 0.0032051 k( 230) = ( 0.0386304 -0.0386304 0.0000000), wk = 0.0032051 k( 231) = ( 0.0309043 -0.0309043 0.0000000), wk = 0.0032051 k( 232) = ( 0.0231782 -0.0231782 0.0000000), wk = 0.0032051 k( 233) = ( 0.0154521 -0.0154521 0.0000000), wk = 0.0032051 k( 234) = ( 0.0077261 -0.0077261 0.0000000), wk = 0.0032051 k( 235) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 236) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 k( 237) = ( 0.0131579 0.0000000 0.0000000), wk = 0.0032051 k( 238) = ( 0.0263158 0.0000000 0.0000000), wk = 0.0032051 k( 239) = ( 0.0394737 0.0000000 0.0000000), wk = 0.0032051 k( 240) = ( 0.0526316 0.0000000 0.0000000), wk = 0.0032051 k( 241) = ( 0.0657895 0.0000000 0.0000000), wk = 0.0032051 k( 242) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0032051 k( 243) = ( 0.0921053 0.0000000 0.0000000), wk = 0.0032051 k( 244) = ( 0.1052632 0.0000000 0.0000000), wk = 0.0032051 k( 245) = ( 0.1184210 0.0000000 0.0000000), wk = 0.0032051 k( 246) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0032051 k( 247) = ( 0.1447368 0.0000000 0.0000000), wk = 0.0032051 k( 248) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0032051 k( 249) = ( 0.1710526 0.0000000 0.0000000), wk = 0.0032051 k( 250) = ( 0.1842105 0.0000000 0.0000000), wk = 0.0032051 k( 251) = ( 0.1973684 0.0000000 0.0000000), wk = 0.0032051 k( 252) = ( 0.2105263 0.0000000 0.0000000), wk = 0.0032051 k( 253) = ( 0.2236842 0.0000000 0.0000000), wk = 0.0032051 k( 254) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0032051 k( 255) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0032051 k( 256) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0032051 k( 257) = ( 0.2763158 0.0000000 0.0000000), wk = 0.0032051 k( 258) = ( 0.2894737 0.0000000 0.0000000), wk = 0.0032051 k( 259) = ( 0.3026316 0.0000000 0.0000000), wk = 0.0032051 k( 260) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0032051 k( 261) = ( 0.3289474 0.0000000 0.0000000), wk = 0.0032051 k( 262) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0032051 k( 263) = ( 0.3552632 0.0000000 0.0000000), wk = 0.0032051 k( 264) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0032051 k( 265) = ( 0.3815789 0.0000000 0.0000000), wk = 0.0032051 k( 266) = ( 0.3947368 0.0000000 0.0000000), wk = 0.0032051 k( 267) = ( 0.4078947 0.0000000 0.0000000), wk = 0.0032051 k( 268) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0032051 k( 269) = ( 0.4342105 0.0000000 0.0000000), wk = 0.0032051 k( 270) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0032051 k( 271) = ( 0.4605263 0.0000000 0.0000000), wk = 0.0032051 k( 272) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0032051 k( 273) = ( 0.4868421 0.0000000 0.0000000), wk = 0.0032051 k( 274) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0032051 k( 275) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032051 k( 276) = ( 0.4864865 0.0000000 0.4864865), wk = 0.0032051 k( 277) = ( 0.4729730 0.0000000 0.4729730), wk = 0.0032051 k( 278) = ( 0.4594595 0.0000000 0.4594595), wk = 0.0032051 k( 279) = ( 0.4459459 0.0000000 0.4459460), wk = 0.0032051 k( 280) = ( 0.4324324 0.0000000 0.4324324), wk = 0.0032051 k( 281) = ( 0.4189189 0.0000000 0.4189189), wk = 0.0032051 k( 282) = ( 0.4054054 0.0000000 0.4054054), wk = 0.0032051 k( 283) = ( 0.3918919 0.0000000 0.3918919), wk = 0.0032051 k( 284) = ( 0.3783784 0.0000000 0.3783784), wk = 0.0032051 k( 285) = ( 0.3648649 0.0000000 0.3648649), wk = 0.0032051 k( 286) = ( 0.3513514 0.0000000 0.3513514), wk = 0.0032051 k( 287) = ( 0.3378378 0.0000000 0.3378378), wk = 0.0032051 k( 288) = ( 0.3243243 0.0000000 0.3243243), wk = 0.0032051 k( 289) = ( 0.3108108 0.0000000 0.3108108), wk = 0.0032051 k( 290) = ( 0.2972973 0.0000000 0.2972973), wk = 0.0032051 k( 291) = ( 0.2837838 0.0000000 0.2837838), wk = 0.0032051 k( 292) = ( 0.2702703 0.0000000 0.2702703), wk = 0.0032051 k( 293) = ( 0.2567568 0.0000000 0.2567568), wk = 0.0032051 k( 294) = ( 0.2432432 0.0000000 0.2432432), wk = 0.0032051 k( 295) = ( 0.2297297 0.0000000 0.2297297), wk = 0.0032051 k( 296) = ( 0.2162162 0.0000000 0.2162162), wk = 0.0032051 k( 297) = ( 0.2027027 0.0000000 0.2027027), wk = 0.0032051 k( 298) = ( 0.1891892 0.0000000 0.1891892), wk = 0.0032051 k( 299) = ( 0.1756757 0.0000000 0.1756757), wk = 0.0032051 k( 300) = ( 0.1621622 0.0000000 0.1621622), wk = 0.0032051 k( 301) = ( 0.1486486 0.0000000 0.1486487), wk = 0.0032051 k( 302) = ( 0.1351351 0.0000000 0.1351351), wk = 0.0032051 k( 303) = ( 0.1216216 0.0000000 0.1216216), wk = 0.0032051 k( 304) = ( 0.1081081 0.0000000 0.1081081), wk = 0.0032051 k( 305) = ( 0.0945946 0.0000000 0.0945946), wk = 0.0032051 k( 306) = ( 0.0810811 0.0000000 0.0810811), wk = 0.0032051 k( 307) = ( 0.0675676 0.0000000 0.0675676), wk = 0.0032051 k( 308) = ( 0.0540540 0.0000000 0.0540541), wk = 0.0032051 k( 309) = ( 0.0405405 0.0000000 0.0405405), wk = 0.0032051 k( 310) = ( 0.0270270 0.0000000 0.0270270), wk = 0.0032051 k( 311) = ( 0.0135135 0.0000000 0.0135135), wk = 0.0032051 k( 312) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032051 Dense grid: 60515 G-vectors FFT dimensions: ( 72, 72, 81) Smooth grid: 42425 G-vectors FFT dimensions: ( 64, 64, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 228, 52) NL pseudopotentials 0.22 Mb ( 114, 126) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1261) G-vector shells 0.01 Mb ( 1227) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.72 Mb ( 228, 208) Each subspace H/S matrix 0.66 Mb ( 208, 208) Each matrix 0.20 Mb ( 126, 2, 52) The potential is recalculated from file : ./BaSe2.save/charge-density.dat Starting wfc are 52 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.9 secs Computing kpt #: 2 total cpu time spent up to now is 49.2 secs Computing kpt #: 3 total cpu time spent up to now is 52.7 secs Computing kpt #: 4 total cpu time spent up to now is 56.0 secs Computing kpt #: 5 total cpu time spent up to now is 59.0 secs Computing kpt #: 6 total cpu time spent up to now is 61.9 secs Computing kpt #: 7 total cpu time spent up to now is 64.7 secs Computing kpt #: 8 total cpu time spent up to now is 67.6 secs Computing kpt #: 9 total cpu time spent up to now is 70.4 secs Computing kpt #: 10 total cpu time spent up to now is 73.3 secs Computing kpt #: 11 total cpu time spent up to now is 76.2 secs Computing kpt #: 12 total cpu time spent up to now is 79.1 secs Computing kpt #: 13 total cpu time spent up to now is 82.0 secs Computing kpt #: 14 total cpu time spent up to now is 84.9 secs Computing kpt #: 15 total cpu time spent up to now is 87.8 secs Computing kpt #: 16 total cpu time spent up to now is 90.9 secs Computing kpt #: 17 total cpu time spent up to now is 93.8 secs Computing kpt #: 18 total cpu time spent up to now is 97.1 secs Computing kpt #: 19 total cpu time spent up to now is 100.1 secs Computing kpt #: 20 total cpu time spent up to now is 103.1 secs Computing kpt #: 21 total cpu time spent up to now is 106.1 secs Computing kpt #: 22 total cpu time spent up to now is 109.4 secs Computing kpt #: 23 total cpu time spent up to now is 112.4 secs Computing kpt #: 24 total cpu time spent up to now is 115.4 secs Computing kpt #: 25 total cpu time spent up to now is 118.3 secs Computing kpt #: 26 total cpu time spent up to now is 121.2 secs Computing kpt #: 27 total cpu time spent up to now is 124.1 secs Computing kpt #: 28 total cpu time spent up to now is 127.0 secs Computing kpt #: 29 total cpu time spent up to now is 129.9 secs Computing kpt #: 30 total cpu time spent up to now is 132.7 secs Computing kpt #: 31 total cpu time spent up to now is 135.6 secs Computing kpt #: 32 total cpu time spent up to now is 138.5 secs Computing kpt #: 33 total cpu time spent up to now is 141.4 secs Computing kpt #: 34 total cpu time spent up to now is 144.3 secs Computing kpt #: 35 total cpu time spent up to now is 147.3 secs Computing kpt #: 36 total cpu time spent up to now is 150.2 secs Computing kpt #: 37 total cpu time spent up to now is 153.1 secs Computing kpt #: 38 total cpu time spent up to now is 155.9 secs Computing kpt #: 39 total cpu time spent up to now is 158.8 secs Computing kpt #: 40 total cpu time spent up to now is 161.7 secs Computing kpt #: 41 total cpu time spent up to now is 164.4 secs Computing kpt #: 42 total cpu time spent up to now is 167.3 secs Computing kpt #: 43 total cpu time spent up to now is 170.4 secs Computing kpt #: 44 total cpu time spent up to now is 173.3 secs Computing kpt #: 45 total cpu time spent up to now is 176.1 secs Computing kpt #: 46 total cpu time spent up to now is 179.1 secs Computing kpt #: 47 total cpu time spent up to now is 182.0 secs Computing kpt #: 48 total cpu time spent up to now is 184.9 secs Computing kpt #: 49 total cpu time spent up to now is 187.9 secs Computing kpt #: 50 total cpu time spent up to now is 190.8 secs Computing kpt #: 51 total cpu time spent up to now is 193.7 secs Computing kpt #: 52 total cpu time spent up to now is 196.6 secs Computing kpt #: 53 total cpu time spent up to now is 199.4 secs Computing kpt #: 54 total cpu time spent up to now is 202.2 secs Computing kpt #: 55 total cpu time spent up to now is 205.0 secs Computing kpt #: 56 total cpu time spent up to now is 207.8 secs Computing kpt #: 57 total cpu time spent up to now is 210.7 secs Computing kpt #: 58 total cpu time spent up to now is 213.5 secs Computing kpt #: 59 total cpu time spent up to now is 216.2 secs Computing kpt #: 60 total cpu time spent up to now is 219.0 secs Computing kpt #: 61 total cpu time spent up to now is 221.7 secs Computing kpt #: 62 total cpu time spent up to now is 224.4 secs Computing kpt #: 63 total cpu time spent up to now is 227.2 secs Computing kpt #: 64 total cpu time spent up to now is 229.9 secs Computing kpt #: 65 total cpu time spent up to now is 232.7 secs Computing kpt #: 66 total cpu time spent up to now is 235.5 secs Computing kpt #: 67 total cpu time spent up to now is 238.3 secs Computing kpt #: 68 total cpu time spent up to now is 241.5 secs Computing kpt #: 69 total cpu time spent up to now is 244.3 secs Computing kpt #: 70 total cpu time spent up to now is 247.2 secs Computing kpt #: 71 total cpu time spent up to now is 249.9 secs Computing kpt #: 72 total cpu time spent up to now is 252.7 secs Computing kpt #: 73 total cpu time spent up to now is 255.4 secs Computing kpt #: 74 total cpu time spent up to now is 258.1 secs Computing kpt #: 75 total cpu time spent up to now is 260.7 secs Computing kpt #: 76 total cpu time spent up to now is 263.3 secs Computing kpt #: 77 total cpu time spent up to now is 265.8 secs Computing kpt #: 78 total cpu time spent up to now is 268.3 secs Computing kpt #: 79 total cpu time spent up to now is 270.9 secs Computing kpt #: 80 total cpu time spent up to now is 273.4 secs Computing kpt #: 81 total cpu time spent up to now is 276.0 secs Computing kpt #: 82 total cpu time spent up to now is 278.6 secs Computing kpt #: 83 total cpu time spent up to now is 281.1 secs Computing kpt #: 84 total cpu time spent up to now is 283.7 secs Computing kpt #: 85 total cpu time spent up to now is 286.3 secs Computing kpt #: 86 total cpu time spent up to now is 289.2 secs Computing kpt #: 87 total cpu time spent up to now is 291.9 secs Computing kpt #: 88 total cpu time spent up to now is 294.6 secs Computing kpt #: 89 total cpu time spent up to now is 297.3 secs Computing kpt #: 90 total cpu time spent up to now is 300.1 secs Computing kpt #: 91 total cpu time spent up to now is 303.1 secs Computing kpt #: 92 total cpu time spent up to now is 306.2 secs Computing kpt #: 93 total cpu time spent up to now is 309.3 secs Computing kpt #: 94 total cpu time spent up to now is 312.4 secs Computing kpt #: 95 total cpu time spent up to now is 315.5 secs Computing kpt #: 96 total cpu time spent up to now is 318.7 secs Computing kpt #: 97 total cpu time spent up to now is 321.8 secs Computing kpt #: 98 total cpu time spent up to now is 324.8 secs Computing kpt #: 99 total cpu time spent up to now is 327.8 secs Computing kpt #: 100 total cpu time spent up to now is 330.7 secs Computing kpt #: 101 total cpu time spent up to now is 333.5 secs Computing kpt #: 102 total cpu time spent up to now is 336.3 secs Computing kpt #: 103 total cpu time spent up to now is 339.0 secs Computing kpt #: 104 total cpu time spent up to now is 341.7 secs Computing kpt #: 105 total cpu time spent up to now is 344.5 secs Computing kpt #: 106 total cpu time spent up to now is 347.2 secs Computing kpt #: 107 total cpu time spent up to now is 350.0 secs Computing kpt #: 108 total cpu time spent up to now is 352.7 secs Computing kpt #: 109 total cpu time spent up to now is 355.5 secs Computing kpt #: 110 total cpu time spent up to now is 358.2 secs Computing kpt #: 111 total cpu time spent up to now is 361.1 secs Computing kpt #: 112 total cpu time spent up to now is 363.9 secs Computing kpt #: 113 total cpu time spent up to now is 366.8 secs Computing kpt #: 114 total cpu time spent up to now is 369.7 secs Computing kpt #: 115 total cpu time spent up to now is 372.5 secs Computing kpt #: 116 total cpu time spent up to now is 375.2 secs Computing kpt #: 117 total cpu time spent up to now is 378.0 secs Computing kpt #: 118 total cpu time spent up to now is 380.7 secs Computing kpt #: 119 total cpu time spent up to now is 383.5 secs Computing kpt #: 120 total cpu time spent up to now is 386.3 secs Computing kpt #: 121 total cpu time spent up to now is 389.2 secs Computing kpt #: 122 total cpu time spent up to now is 392.0 secs Computing kpt #: 123 total cpu time spent up to now is 394.8 secs Computing kpt #: 124 total cpu time spent up to now is 397.6 secs Computing kpt #: 125 total cpu time spent up to now is 400.4 secs Computing kpt #: 126 total cpu time spent up to now is 403.3 secs Computing kpt #: 127 total cpu time spent up to now is 406.1 secs Computing kpt #: 128 total cpu time spent up to now is 409.2 secs Computing kpt #: 129 total cpu time spent up to now is 412.0 secs Computing kpt #: 130 total cpu time spent up to now is 415.0 secs Computing kpt #: 131 total cpu time spent up to now is 417.8 secs Computing kpt #: 132 total cpu time spent up to now is 420.9 secs Computing kpt #: 133 total cpu time spent up to now is 424.0 secs Computing kpt #: 134 total cpu time spent up to now is 427.2 secs Computing kpt #: 135 total cpu time spent up to now is 430.2 secs Computing kpt #: 136 total cpu time spent up to now is 433.2 secs Computing kpt #: 137 total cpu time spent up to now is 436.5 secs Computing kpt #: 138 total cpu time spent up to now is 439.9 secs Computing kpt #: 139 total cpu time spent up to now is 442.8 secs Computing kpt #: 140 total cpu time spent up to now is 446.2 secs Computing kpt #: 141 total cpu time spent up to now is 449.6 secs Computing kpt #: 142 total cpu time spent up to now is 452.6 secs Computing kpt #: 143 total cpu time spent up to now is 455.9 secs Computing kpt #: 144 total cpu time spent up to now is 459.5 secs Computing kpt #: 145 total cpu time spent up to now is 462.8 secs Computing kpt #: 146 total cpu time spent up to now is 466.2 secs Computing kpt #: 147 total cpu time spent up to now is 469.5 secs Computing kpt #: 148 total cpu time spent up to now is 472.8 secs Computing kpt #: 149 total cpu time spent up to now is 476.1 secs Computing kpt #: 150 total cpu time spent up to now is 479.6 secs Computing kpt #: 151 total cpu time spent up to now is 482.9 secs Computing kpt #: 152 total cpu time spent up to now is 486.3 secs Computing kpt #: 153 total cpu time spent up to now is 489.7 secs Computing kpt #: 154 total cpu time spent up to now is 493.4 secs Computing kpt #: 155 total cpu time spent up to now is 497.4 secs Computing kpt #: 156 total cpu time spent up to now is 500.8 secs Computing kpt #: 157 total cpu time spent up to now is 504.2 secs Computing kpt #: 158 total cpu time spent up to now is 507.5 secs Computing kpt #: 159 total cpu time spent up to now is 510.8 secs Computing kpt #: 160 total cpu time spent up to now is 513.9 secs Computing kpt #: 161 total cpu time spent up to now is 517.2 secs Computing kpt #: 162 total cpu time spent up to now is 520.1 secs Computing kpt #: 163 total cpu time spent up to now is 523.0 secs Computing kpt #: 164 total cpu time spent up to now is 525.8 secs Computing kpt #: 165 total cpu time spent up to now is 528.6 secs Computing kpt #: 166 total cpu time spent up to now is 531.4 secs Computing kpt #: 167 total cpu time spent up to now is 534.2 secs Computing kpt #: 168 total cpu time spent up to now is 537.0 secs Computing kpt #: 169 total cpu time spent up to now is 539.8 secs Computing kpt #: 170 total cpu time spent up to now is 542.7 secs Computing kpt #: 171 total cpu time spent up to now is 545.8 secs Computing kpt #: 172 total cpu time spent up to now is 548.9 secs Computing kpt #: 173 total cpu time spent up to now is 552.1 secs Computing kpt #: 174 total cpu time spent up to now is 555.3 secs Computing kpt #: 175 total cpu time spent up to now is 558.4 secs Computing kpt #: 176 total cpu time spent up to now is 561.4 secs Computing kpt #: 177 total cpu time spent up to now is 564.4 secs Computing kpt #: 178 total cpu time spent up to now is 567.7 secs Computing kpt #: 179 total cpu time spent up to now is 570.8 secs Computing kpt #: 180 total cpu time spent up to now is 573.7 secs Computing kpt #: 181 total cpu time spent up to now is 576.7 secs Computing kpt #: 182 total cpu time spent up to now is 579.6 secs Computing kpt #: 183 total cpu time spent up to now is 582.4 secs Computing kpt #: 184 total cpu time spent up to now is 585.1 secs Computing kpt #: 185 total cpu time spent up to now is 588.1 secs Computing kpt #: 186 total cpu time spent up to now is 591.0 secs Computing kpt #: 187 total cpu time spent up to now is 593.9 secs Computing kpt #: 188 total cpu time spent up to now is 597.2 secs Computing kpt #: 189 total cpu time spent up to now is 600.4 secs Computing kpt #: 190 total cpu time spent up to now is 603.6 secs Computing kpt #: 191 total cpu time spent up to now is 606.9 secs Computing kpt #: 192 total cpu time spent up to now is 610.2 secs Computing kpt #: 193 total cpu time spent up to now is 613.6 secs Computing kpt #: 194 total cpu time spent up to now is 616.8 secs Computing kpt #: 195 total cpu time spent up to now is 620.1 secs Computing kpt #: 196 total cpu time spent up to now is 623.5 secs Computing kpt #: 197 total cpu time spent up to now is 626.8 secs Computing kpt #: 198 total cpu time spent up to now is 630.1 secs Computing kpt #: 199 total cpu time spent up to now is 633.1 secs Computing kpt #: 200 total cpu time spent up to now is 636.4 secs Computing kpt #: 201 total cpu time spent up to now is 639.9 secs Computing kpt #: 202 total cpu time spent up to now is 643.1 secs Computing kpt #: 203 total cpu time spent up to now is 647.3 secs Computing kpt #: 204 total cpu time spent up to now is 650.8 secs Computing kpt #: 205 total cpu time spent up to now is 653.6 secs Computing kpt #: 206 total cpu time spent up to now is 657.1 secs Computing kpt #: 207 total cpu time spent up to now is 660.5 secs Computing kpt #: 208 total cpu time spent up to now is 664.0 secs Computing kpt #: 209 total cpu time spent up to now is 667.5 secs Computing kpt #: 210 total cpu time spent up to now is 671.1 secs Computing kpt #: 211 total cpu time spent up to now is 674.6 secs Computing kpt #: 212 total cpu time spent up to now is 678.6 secs Computing kpt #: 213 total cpu time spent up to now is 682.1 secs Computing kpt #: 214 total cpu time spent up to now is 685.6 secs Computing kpt #: 215 total cpu time spent up to now is 689.6 secs Computing kpt #: 216 total cpu time spent up to now is 693.8 secs Computing kpt #: 217 total cpu time spent up to now is 697.8 secs Computing kpt #: 218 total cpu time spent up to now is 702.0 secs Computing kpt #: 219 total cpu time spent up to now is 706.1 secs Computing kpt #: 220 total cpu time spent up to now is 710.0 secs Computing kpt #: 221 total cpu time spent up to now is 714.0 secs Computing kpt #: 222 total cpu time spent up to now is 717.9 secs Computing kpt #: 223 total cpu time spent up to now is 721.9 secs Computing kpt #: 224 total cpu time spent up to now is 725.9 secs Computing kpt #: 225 total cpu time spent up to now is 730.0 secs Computing kpt #: 226 total cpu time spent up to now is 733.7 secs Computing kpt #: 227 total cpu time spent up to now is 737.0 secs Computing kpt #: 228 total cpu time spent up to now is 740.3 secs Computing kpt #: 229 total cpu time spent up to now is 743.7 secs Computing kpt #: 230 total cpu time spent up to now is 747.1 secs Computing kpt #: 231 total cpu time spent up to now is 750.4 secs Computing kpt #: 232 total cpu time spent up to now is 753.9 secs Computing kpt #: 233 total cpu time spent up to now is 757.7 secs Computing kpt #: 234 total cpu time spent up to now is 762.7 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 768.4 secs Computing kpt #: 236 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 773.8 secs Computing kpt #: 237 total cpu time spent up to now is 778.0 secs Computing kpt #: 238 total cpu time spent up to now is 781.9 secs Computing kpt #: 239 total cpu time spent up to now is 785.4 secs Computing kpt #: 240 total cpu time spent up to now is 788.7 secs Computing kpt #: 241 total cpu time spent up to now is 791.8 secs Computing kpt #: 242 total cpu time spent up to now is 794.8 secs Computing kpt #: 243 total cpu time spent up to now is 798.1 secs Computing kpt #: 244 total cpu time spent up to now is 801.2 secs Computing kpt #: 245 total cpu time spent up to now is 804.4 secs Computing kpt #: 246 total cpu time spent up to now is 807.8 secs Computing kpt #: 247 total cpu time spent up to now is 810.6 secs Computing kpt #: 248 total cpu time spent up to now is 813.4 secs Computing kpt #: 249 total cpu time spent up to now is 816.0 secs Computing kpt #: 250 total cpu time spent up to now is 818.8 secs Computing kpt #: 251 total cpu time spent up to now is 821.5 secs Computing kpt #: 252 total cpu time spent up to now is 824.2 secs Computing kpt #: 253 total cpu time spent up to now is 826.9 secs Computing kpt #: 254 total cpu time spent up to now is 829.7 secs Computing kpt #: 255 total cpu time spent up to now is 832.4 secs Computing kpt #: 256 total cpu time spent up to now is 835.1 secs Computing kpt #: 257 total cpu time spent up to now is 837.9 secs Computing kpt #: 258 total cpu time spent up to now is 840.7 secs Computing kpt #: 259 total cpu time spent up to now is 843.5 secs Computing kpt #: 260 total cpu time spent up to now is 846.3 secs Computing kpt #: 261 total cpu time spent up to now is 849.6 secs Computing kpt #: 262 total cpu time spent up to now is 853.2 secs Computing kpt #: 263 total cpu time spent up to now is 856.7 secs Computing kpt #: 264 total cpu time spent up to now is 860.4 secs Computing kpt #: 265 total cpu time spent up to now is 863.9 secs Computing kpt #: 266 total cpu time spent up to now is 867.3 secs Computing kpt #: 267 total cpu time spent up to now is 870.6 secs Computing kpt #: 268 total cpu time spent up to now is 873.9 secs Computing kpt #: 269 total cpu time spent up to now is 877.2 secs Computing kpt #: 270 total cpu time spent up to now is 880.2 secs Computing kpt #: 271 total cpu time spent up to now is 883.1 secs Computing kpt #: 272 total cpu time spent up to now is 886.1 secs Computing kpt #: 273 total cpu time spent up to now is 889.0 secs Computing kpt #: 274 total cpu time spent up to now is 892.0 secs Computing kpt #: 275 total cpu time spent up to now is 894.8 secs Computing kpt #: 276 total cpu time spent up to now is 897.6 secs Computing kpt #: 277 total cpu time spent up to now is 900.4 secs Computing kpt #: 278 total cpu time spent up to now is 903.3 secs Computing kpt #: 279 total cpu time spent up to now is 906.2 secs Computing kpt #: 280 total cpu time spent up to now is 909.0 secs Computing kpt #: 281 total cpu time spent up to now is 912.0 secs Computing kpt #: 282 total cpu time spent up to now is 914.9 secs Computing kpt #: 283 total cpu time spent up to now is 917.7 secs Computing kpt #: 284 total cpu time spent up to now is 920.5 secs Computing kpt #: 285 total cpu time spent up to now is 923.4 secs Computing kpt #: 286 total cpu time spent up to now is 926.3 secs Computing kpt #: 287 total cpu time spent up to now is 929.1 secs Computing kpt #: 288 total cpu time spent up to now is 931.9 secs Computing kpt #: 289 total cpu time spent up to now is 934.7 secs Computing kpt #: 290 total cpu time spent up to now is 937.4 secs Computing kpt #: 291 total cpu time spent up to now is 940.1 secs Computing kpt #: 292 total cpu time spent up to now is 942.8 secs Computing kpt #: 293 total cpu time spent up to now is 945.6 secs Computing kpt #: 294 total cpu time spent up to now is 948.2 secs Computing kpt #: 295 total cpu time spent up to now is 950.9 secs Computing kpt #: 296 total cpu time spent up to now is 953.5 secs Computing kpt #: 297 total cpu time spent up to now is 956.2 secs Computing kpt #: 298 total cpu time spent up to now is 958.8 secs Computing kpt #: 299 total cpu time spent up to now is 961.4 secs Computing kpt #: 300 total cpu time spent up to now is 964.1 secs Computing kpt #: 301 total cpu time spent up to now is 967.0 secs Computing kpt #: 302 total cpu time spent up to now is 970.5 secs Computing kpt #: 303 total cpu time spent up to now is 974.0 secs Computing kpt #: 304 total cpu time spent up to now is 977.3 secs Computing kpt #: 305 total cpu time spent up to now is 980.6 secs Computing kpt #: 306 total cpu time spent up to now is 983.5 secs Computing kpt #: 307 total cpu time spent up to now is 986.5 secs Computing kpt #: 308 total cpu time spent up to now is 990.0 secs Computing kpt #: 309 total cpu time spent up to now is 993.5 secs Computing kpt #: 310 total cpu time spent up to now is 997.2 secs Computing kpt #: 311 total cpu time spent up to now is 1001.2 secs Computing kpt #: 312 total cpu time spent up to now is 1006.4 secs ethr = 2.27E-11, avg # of iterations = 39.4 total cpu time spent up to now is 1006.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5333 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5924 -8.5924 -8.0810 -8.0810 -7.8171 -7.8171 -7.4816 -7.4816 -5.8312 -5.8312 -5.8278 -5.8278 -5.7875 -5.7875 -5.4591 -5.4591 -4.5495 -4.5495 -4.4454 -4.4454 1.1210 1.1210 1.1794 1.1794 2.1952 2.1952 3.1814 3.1814 3.4843 3.4843 3.8019 3.8019 4.6091 4.6091 4.9469 4.9469 5.3121 5.3121 5.6630 5.6630 8.3549 8.3549 8.8114 8.8114 9.0881 9.0881 9.6000 9.6000 k = 0.0128 0.0038-0.0232 ( 5326 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5920 -8.5920 -8.0815 -8.0815 -7.8165 -7.8165 -7.4817 -7.4817 -5.8318 -5.8318 -5.8279 -5.8279 -5.7874 -5.7874 -5.4595 -5.4595 -4.5495 -4.5495 -4.4466 -4.4466 1.1228 1.1228 1.1820 1.1820 2.1974 2.1974 3.1811 3.1811 3.4845 3.4845 3.8009 3.8009 4.6093 4.6093 4.9482 4.9482 5.3101 5.3101 5.6620 5.6620 8.3546 8.3546 8.8114 8.8114 9.0877 9.0877 9.5788 9.5788 k = 0.0256 0.0077-0.0464 ( 5320 PWs) bands (ev): -21.1723 -21.1723 -21.1595 -21.1595 -8.5908 -8.5908 -8.0829 -8.0829 -7.8148 -7.8148 -7.4818 -7.4818 -5.8337 -5.8337 -5.8281 -5.8281 -5.7872 -5.7872 -5.4605 -5.4605 -4.5493 -4.5493 -4.4504 -4.4504 1.1283 1.1283 1.1899 1.1899 2.2036 2.2036 3.1803 3.1803 3.4851 3.4851 3.7979 3.7979 4.6098 4.6098 4.9522 4.9522 5.3039 5.3039 5.6591 5.6591 8.3537 8.3537 8.8115 8.8115 9.0864 9.0864 9.5321 9.5321 k = 0.0385 0.0115-0.0696 ( 5317 PWs) bands (ev): -21.1722 -21.1722 -21.1596 -21.1596 -8.5889 -8.5889 -8.0853 -8.0853 -7.8121 -7.8121 -7.4821 -7.4821 -5.8367 -5.8367 -5.8286 -5.8286 -5.7869 -5.7869 -5.4623 -5.4623 -4.5492 -4.5492 -4.4564 -4.4564 1.1371 1.1371 1.2031 1.2031 2.2141 2.2141 3.1790 3.1790 3.4860 3.4860 3.7931 3.7931 4.6105 4.6105 4.9586 4.9586 5.2937 5.2937 5.6543 5.6543 8.3523 8.3523 8.8121 8.8121 9.0835 9.0835 9.4763 9.4763 k = 0.0513 0.0154-0.0927 ( 5311 PWs) bands (ev): -21.1721 -21.1721 -21.1596 -21.1596 -8.5861 -8.5861 -8.0884 -8.0884 -7.8084 -7.8084 -7.4825 -7.4825 -5.8409 -5.8409 -5.8292 -5.8292 -5.7865 -5.7865 -5.4646 -5.4646 -4.5491 -4.5491 -4.4647 -4.4647 1.1493 1.1493 1.2219 1.2219 2.2285 2.2285 3.1772 3.1772 3.4872 3.4872 3.7868 3.7868 4.6111 4.6111 4.9672 4.9672 5.2797 5.2797 5.6476 5.6476 8.3508 8.3508 8.8139 8.8139 9.0777 9.0777 9.4192 9.4192 k = 0.0641 0.0192-0.1159 ( 5311 PWs) bands (ev): -21.1720 -21.1720 -21.1597 -21.1597 -8.5827 -8.5827 -8.0921 -8.0921 -7.8040 -7.8040 -7.4829 -7.4829 -5.8462 -5.8462 -5.8300 -5.8300 -5.7862 -5.7862 -5.4674 -5.4674 -4.5492 -4.5492 -4.4750 -4.4750 1.1645 1.1645 1.2462 1.2462 2.2469 2.2469 3.1749 3.1749 3.4886 3.4886 3.7795 3.7795 4.6115 4.6115 4.9776 4.9776 5.2622 5.2622 5.6390 5.6390 8.3494 8.3494 8.8175 8.8175 9.0668 9.0668 9.3662 9.3662 k = 0.0769 0.0231-0.1391 ( 5309 PWs) bands (ev): -21.1718 -21.1718 -21.1598 -21.1598 -8.5786 -8.5786 -8.0962 -8.0962 -7.7991 -7.7991 -7.4833 -7.4833 -5.8525 -5.8525 -5.8310 -5.8310 -5.7861 -5.7861 -5.4705 -5.4705 -4.5498 -4.5498 -4.4870 -4.4870 1.1828 1.1828 1.2760 1.2760 2.2689 2.2689 3.1723 3.1723 3.4901 3.4901 3.7717 3.7717 4.6114 4.6114 4.9894 4.9894 5.2416 5.2416 5.6285 5.6285 8.3487 8.3487 8.8236 8.8236 9.0482 9.0482 9.3220 9.3220 k = 0.0897 0.0269-0.1623 ( 5303 PWs) bands (ev): -21.1716 -21.1716 -21.1599 -21.1599 -8.5739 -8.5739 -8.1006 -8.1006 -7.7937 -7.7937 -7.4836 -7.4836 -5.8596 -5.8596 -5.8323 -5.8323 -5.7864 -5.7864 -5.4739 -5.4739 -4.5510 -4.5510 -4.5004 -4.5004 1.2041 1.2041 1.3112 1.3112 2.2945 2.2945 3.1693 3.1693 3.4916 3.4916 3.7636 3.7636 4.6106 4.6106 5.0020 5.0020 5.2185 5.2185 5.6161 5.6161 8.3489 8.3489 8.8329 8.8329 9.0199 9.0199 9.2898 9.2898 k = 0.1026 0.0308-0.1855 ( 5293 PWs) bands (ev): -21.1714 -21.1714 -21.1600 -21.1600 -8.5686 -8.5686 -8.1050 -8.1050 -7.7882 -7.7882 -7.4839 -7.4839 -5.8676 -5.8676 -5.8337 -5.8337 -5.7872 -5.7872 -5.4775 -5.4775 -4.5532 -4.5532 -4.5147 -4.5147 1.2286 1.2286 1.3515 1.3515 2.3234 2.3234 3.1660 3.1660 3.4930 3.4930 3.7559 3.7559 4.6090 4.6090 5.0144 5.0144 5.1935 5.1935 5.6018 5.6018 8.3504 8.3504 8.8457 8.8457 8.9824 8.9824 9.2702 9.2702 k = 0.1154 0.0346-0.2087 ( 5292 PWs) bands (ev): -21.1711 -21.1711 -21.1601 -21.1601 -8.5628 -8.5628 -8.1094 -8.1094 -7.7826 -7.7826 -7.4841 -7.4841 -5.8762 -5.8762 -5.8354 -5.8354 -5.7887 -5.7887 -5.4810 -5.4810 -4.5568 -4.5568 -4.5293 -4.5293 1.2564 1.2564 1.3965 1.3965 2.3554 2.3554 3.1627 3.1627 3.4940 3.4940 3.7488 3.7488 4.6065 4.6065 5.0257 5.0257 5.1678 5.1678 5.5858 5.5858 8.3536 8.3536 8.8622 8.8622 8.9389 8.9389 9.2606 9.2606 k = 0.1282 0.0384-0.2319 ( 5298 PWs) bands (ev): -21.1708 -21.1708 -21.1602 -21.1602 -8.5565 -8.5565 -8.1135 -8.1135 -7.7771 -7.7771 -7.4840 -7.4840 -5.8853 -5.8853 -5.8374 -5.8374 -5.7911 -5.7911 -5.4845 -5.4845 -4.5625 -4.5625 -4.5433 -4.5433 1.2874 1.2874 1.4460 1.4460 2.3902 2.3902 3.1593 3.1593 3.4947 3.4947 3.7426 3.7426 4.6030 4.6030 5.0337 5.0337 5.1432 5.1432 5.5681 5.5681 8.3586 8.3586 8.8787 8.8787 8.8962 8.8962 9.2580 9.2580 k = 0.1410 0.0423-0.2550 ( 5295 PWs) bands (ev): -21.1705 -21.1705 -21.1603 -21.1603 -8.5499 -8.5499 -8.1173 -8.1173 -7.7718 -7.7718 -7.4838 -7.4838 -5.8948 -5.8948 -5.8398 -5.8398 -5.7945 -5.7945 -5.4877 -5.4877 -4.5717 -4.5717 -4.5551 -4.5551 1.3218 1.3218 1.4996 1.4996 2.4275 2.4275 3.1560 3.1560 3.4950 3.4950 3.7374 3.7374 4.5986 4.5986 5.0350 5.0350 5.1234 5.1234 5.5488 5.5488 8.3658 8.3658 8.8437 8.8437 8.9079 8.9079 9.2598 9.2598 k = 0.1538 0.0461-0.2782 ( 5284 PWs) bands (ev): -21.1702 -21.1702 -21.1605 -21.1605 -8.5431 -8.5431 -8.1206 -8.1206 -7.7669 -7.7669 -7.4832 -7.4832 -5.9046 -5.9046 -5.8428 -5.8428 -5.7989 -5.7989 -5.4905 -5.4905 -4.5840 -4.5840 -4.5647 -4.5647 1.3597 1.3597 1.5570 1.5570 2.4670 2.4670 3.1531 3.1531 3.4947 3.4947 3.7332 3.7332 4.5934 4.5934 5.0252 5.0252 5.1126 5.1126 5.5280 5.5280 8.3751 8.3751 8.7983 8.7983 8.9327 8.9327 9.2644 9.2644 k = 0.1667 0.0500-0.3014 ( 5283 PWs) bands (ev): -21.1699 -21.1699 -21.1606 -21.1606 -8.5360 -8.5360 -8.1233 -8.1233 -7.7624 -7.7624 -7.4822 -7.4822 -5.9144 -5.9144 -5.8465 -5.8465 -5.8042 -5.8042 -5.4930 -5.4930 -4.5973 -4.5973 -4.5742 -4.5742 1.4009 1.4009 1.6178 1.6178 2.5084 2.5084 3.1506 3.1506 3.4939 3.4939 3.7299 3.7299 4.5873 4.5873 5.0051 5.0051 5.1104 5.1104 5.5059 5.5059 8.3864 8.3864 8.7544 8.7544 8.9572 8.9572 9.2706 9.2706 k = 0.1795 0.0538-0.3246 ( 5285 PWs) bands (ev): -21.1695 -21.1695 -21.1608 -21.1608 -8.5289 -8.5289 -8.1253 -8.1253 -7.7585 -7.7585 -7.4809 -7.4809 -5.9244 -5.9244 -5.8514 -5.8514 -5.8101 -5.8101 -5.4950 -5.4950 -4.6103 -4.6103 -4.5846 -4.5846 1.4455 1.4455 1.6817 1.6817 2.5515 2.5515 3.1488 3.1488 3.4926 3.4926 3.7274 3.7274 4.5805 4.5805 4.9797 4.9797 5.1120 5.1120 5.4827 5.4827 8.3993 8.3993 8.7120 8.7120 8.9770 8.9770 9.2774 9.2774 k = 0.1923 0.0577-0.3478 ( 5280 PWs) bands (ev): -21.1691 -21.1691 -21.1609 -21.1609 -8.5217 -8.5217 -8.1266 -8.1266 -7.7551 -7.7551 -7.4792 -7.4792 -5.9343 -5.9343 -5.8580 -5.8580 -5.8160 -5.8160 -5.4966 -5.4966 -4.6222 -4.6222 -4.5964 -4.5964 1.4934 1.4934 1.7484 1.7484 2.5958 2.5958 3.1479 3.1479 3.4909 3.4909 3.7253 3.7253 4.5731 4.5731 4.9527 4.9527 5.1138 5.1138 5.4587 5.4587 8.4130 8.4130 8.6708 8.6708 8.9858 8.9858 9.2839 9.2839 k = 0.2051 0.0615-0.3710 ( 5276 PWs) bands (ev): -21.1687 -21.1687 -21.1611 -21.1611 -8.5146 -8.5146 -8.1272 -8.1272 -7.7523 -7.7523 -7.4770 -7.4770 -5.9444 -5.9444 -5.8668 -5.8668 -5.8213 -5.8213 -5.4976 -5.4976 -4.6328 -4.6328 -4.6098 -4.6098 1.5445 1.5445 1.8173 1.8173 2.6411 2.6411 3.1481 3.1481 3.4888 3.4888 3.7234 3.7234 4.5653 4.5653 4.9260 4.9260 5.1144 5.1144 5.4340 5.4340 8.4261 8.4261 8.6296 8.6296 8.9763 8.9763 9.2890 9.2890 k = 0.2179 0.0654-0.3942 ( 5288 PWs) bands (ev): -21.1684 -21.1684 -21.1613 -21.1613 -8.5076 -8.5076 -8.1268 -8.1268 -7.7502 -7.7502 -7.4743 -7.4743 -5.9547 -5.9547 -5.8778 -5.8778 -5.8256 -5.8256 -5.4982 -5.4982 -4.6419 -4.6419 -4.6247 -4.6247 1.5986 1.5986 1.8883 1.8883 2.6868 2.6868 3.1494 3.1494 3.4863 3.4863 3.7213 3.7213 4.5574 4.5574 4.9006 4.9006 5.1129 5.1129 5.4090 5.4090 8.4357 8.4357 8.5871 8.5871 8.9454 8.9454 9.2913 9.2913 k = 0.2308 0.0692-0.4173 ( 5293 PWs) bands (ev): -21.1680 -21.1680 -21.1615 -21.1615 -8.5009 -8.5009 -8.1257 -8.1257 -7.7488 -7.7488 -7.4711 -7.4711 -5.9656 -5.9656 -5.8905 -5.8905 -5.8289 -5.8289 -5.4983 -5.4983 -4.6508 -4.6508 -4.6398 -4.6398 1.6557 1.6557 1.9608 1.9608 2.7328 2.7328 3.1522 3.1522 3.4835 3.4835 3.7187 3.7187 4.5494 4.5494 4.8774 4.8774 5.1090 5.1090 5.3840 5.3840 8.4369 8.4369 8.5418 8.5418 8.8996 8.8996 9.2891 9.2891 k = 0.2436 0.0730-0.4405 ( 5296 PWs) bands (ev): -21.1676 -21.1676 -21.1616 -21.1616 -8.4945 -8.4945 -8.1236 -8.1236 -7.7481 -7.7481 -7.4674 -7.4674 -5.9779 -5.9779 -5.9037 -5.9037 -5.8313 -5.8313 -5.4979 -5.4979 -4.6647 -4.6647 -4.6497 -4.6497 1.7155 1.7155 2.0345 2.0345 2.7784 2.7784 3.1566 3.1566 3.4803 3.4803 3.7154 3.7154 4.5416 4.5416 4.8566 4.8566 5.1027 5.1027 5.3592 5.3592 8.4216 8.4216 8.4919 8.4919 8.8534 8.8534 9.2821 9.2821 k = 0.2564 0.0769-0.4637 ( 5298 PWs) bands (ev): -21.1671 -21.1671 -21.1618 -21.1618 -8.4884 -8.4884 -8.1206 -8.1206 -7.7481 -7.7481 -7.4631 -7.4631 -5.9923 -5.9923 -5.9161 -5.9161 -5.8329 -5.8329 -5.4972 -5.4972 -4.6843 -4.6843 -4.6539 -4.6539 1.7778 1.7778 2.1090 2.1090 2.8234 2.8234 3.1627 3.1627 3.4767 3.4767 3.7111 3.7111 4.5344 4.5344 4.8387 4.8387 5.0941 5.0941 5.3350 5.3350 8.3813 8.3813 8.4354 8.4354 8.8221 8.8221 9.2717 9.2717 k = 0.2692 0.0807-0.4869 ( 5296 PWs) bands (ev): -21.1667 -21.1667 -21.1620 -21.1620 -8.4827 -8.4827 -8.1167 -8.1167 -7.7489 -7.7489 -7.4584 -7.4584 -6.0096 -6.0096 -5.9267 -5.9267 -5.8338 -5.8338 -5.4961 -5.4961 -4.7063 -4.7063 -4.6555 -4.6555 1.8423 1.8423 2.1839 2.1839 2.8671 2.8671 3.1706 3.1706 3.4727 3.4727 3.7059 3.7059 4.5279 4.5279 4.8236 4.8236 5.0835 5.0835 5.3117 5.3117 8.3135 8.3135 8.3709 8.3709 8.8133 8.8133 9.2611 9.2611 k = 0.2821 0.0846-0.5101 ( 5306 PWs) bands (ev): -21.1663 -21.1663 -21.1622 -21.1622 -8.4774 -8.4774 -8.1118 -8.1118 -7.7505 -7.7505 -7.4531 -7.4531 -6.0299 -6.0299 -5.9349 -5.9349 -5.8341 -5.8341 -5.4946 -5.4946 -4.7300 -4.7300 -4.6552 -4.6552 1.9088 1.9088 2.2587 2.2587 2.9092 2.9092 3.1803 3.1803 3.4681 3.4681 3.6996 3.6996 4.5223 4.5223 4.8115 4.8115 5.0712 5.0712 5.2894 5.2894 8.2239 8.2239 8.2982 8.2982 8.8239 8.8239 9.2536 9.2536 k = 0.2949 0.0884-0.5333 ( 5308 PWs) bands (ev): -21.1660 -21.1660 -21.1623 -21.1623 -8.4726 -8.4726 -8.1061 -8.1061 -7.7530 -7.7530 -7.4473 -7.4473 -6.0529 -6.0529 -5.9407 -5.9407 -5.8337 -5.8337 -5.4929 -5.4929 -4.7553 -4.7553 -4.6534 -4.6534 1.9770 1.9770 2.3330 2.3330 2.9492 2.9492 3.1918 3.1918 3.4629 3.4629 3.6924 3.6924 4.5178 4.5178 4.8021 4.8021 5.0576 5.0576 5.2685 5.2685 8.1201 8.1201 8.2183 8.2183 8.8475 8.8475 9.2516 9.2516 k = 0.3077 0.0923-0.5565 ( 5312 PWs) bands (ev): -21.1656 -21.1656 -21.1625 -21.1625 -8.4683 -8.4683 -8.0994 -8.0994 -7.7563 -7.7563 -7.4410 -7.4410 -6.0777 -6.0777 -5.9445 -5.9445 -5.8326 -5.8326 -5.4908 -5.4908 -4.7818 -4.7818 -4.6502 -4.6502 2.0466 2.0466 2.4064 2.4064 2.9865 2.9865 3.2050 3.2050 3.4570 3.4570 3.6844 3.6844 4.5146 4.5146 4.7953 4.7953 5.0431 5.0431 5.2493 5.2493 8.0084 8.0084 8.1322 8.1322 8.8791 8.8791 9.2559 9.2559 k = 0.3205 0.0961-0.5796 ( 5317 PWs) bands (ev): -21.1652 -21.1652 -21.1627 -21.1627 -8.4645 -8.4645 -8.0919 -8.0919 -7.7605 -7.7605 -7.4342 -7.4342 -6.1038 -6.1038 -5.9467 -5.9467 -5.8308 -5.8308 -5.4885 -5.4885 -4.8095 -4.8095 -4.6459 -4.6459 2.1171 2.1171 2.4784 2.4784 3.0209 3.0209 3.2196 3.2196 3.4504 3.4504 3.6759 3.6759 4.5129 4.5129 4.7908 4.7908 5.0282 5.0282 5.2323 5.2323 7.8932 7.8932 8.0413 8.0413 8.9151 8.9151 9.2668 9.2668 k = 0.3333 0.1000-0.6028 ( 5318 PWs) bands (ev): -21.1648 -21.1648 -21.1628 -21.1628 -8.4611 -8.4611 -8.0835 -8.0835 -7.7656 -7.7656 -7.4271 -7.4271 -6.1305 -6.1305 -5.9478 -5.9478 -5.8281 -5.8281 -5.4858 -5.4858 -4.8380 -4.8380 -4.6408 -4.6408 2.1884 2.1884 2.5485 2.5485 3.0520 3.0520 3.2353 3.2353 3.4431 3.4431 3.6669 3.6669 4.5127 4.5127 4.7882 4.7882 5.0133 5.0133 5.2178 5.2178 7.7769 7.7769 7.9472 7.9472 8.9531 8.9531 9.2834 9.2834 k = 0.3462 0.1038-0.6260 ( 5308 PWs) bands (ev): -21.1645 -21.1645 -21.1630 -21.1630 -8.4582 -8.4582 -8.0743 -8.0743 -7.7717 -7.7717 -7.4197 -7.4197 -6.1572 -6.1572 -5.9480 -5.9480 -5.8247 -5.8247 -5.4829 -5.4829 -4.8671 -4.8671 -4.6350 -4.6350 2.2599 2.2599 2.6163 2.6163 3.0795 3.0795 3.2516 3.2516 3.4351 3.4351 3.6576 3.6576 4.5140 4.5140 4.7872 4.7872 4.9987 4.9987 5.2062 5.2062 7.6617 7.6617 7.8514 7.8514 8.9914 8.9914 9.3051 9.3051 k = 0.3590 0.1077-0.6492 ( 5305 PWs) bands (ev): -21.1642 -21.1642 -21.1631 -21.1631 -8.4557 -8.4557 -8.0642 -8.0642 -7.7787 -7.7787 -7.4120 -7.4120 -6.1836 -6.1836 -5.9476 -5.9476 -5.8204 -5.8204 -5.4796 -5.4796 -4.8966 -4.8966 -4.6288 -4.6288 2.3313 2.3313 2.6813 2.6813 3.1033 3.1033 3.2678 3.2678 3.4264 3.4264 3.6482 3.6482 4.5166 4.5166 4.7876 4.7876 4.9848 4.9848 5.1980 5.1980 7.5489 7.5489 7.7554 7.7554 9.0283 9.0283 9.3307 9.3307 k = 0.3718 0.1115-0.6724 ( 5308 PWs) bands (ev): -21.1639 -21.1639 -21.1632 -21.1632 -8.4537 -8.4537 -8.0535 -8.0535 -7.7866 -7.7866 -7.4043 -7.4043 -6.2091 -6.2091 -5.9469 -5.9469 -5.8152 -5.8152 -5.4760 -5.4760 -4.9262 -4.9262 -4.6224 -4.6224 2.4023 2.4023 2.7431 2.7431 3.1231 3.1231 3.2835 3.2835 3.4173 3.4173 3.6387 3.6387 4.5205 4.5205 4.7890 4.7890 4.9720 4.9720 5.1934 5.1934 7.4398 7.4398 7.6608 7.6608 9.0628 9.0628 9.3592 9.3592 k = 0.3846 0.1153-0.6956 ( 5304 PWs) bands (ev): -21.1636 -21.1636 -21.1634 -21.1634 -8.4520 -8.4520 -8.0420 -8.0420 -7.7954 -7.7954 -7.3966 -7.3966 -6.2335 -6.2335 -5.9459 -5.9459 -5.8094 -5.8094 -5.4720 -5.4720 -4.9555 -4.9555 -4.6160 -4.6160 2.4724 2.4724 2.8011 2.8011 3.1385 3.1385 3.2982 3.2982 3.4080 3.4080 3.6292 3.6292 4.5252 4.5252 4.7911 4.7911 4.9607 4.9607 5.1923 5.1923 7.3357 7.3357 7.5688 7.5688 9.0937 9.0937 9.3895 9.3895 k = 0.3974 0.1192-0.7187 ( 5306 PWs) bands (ev): -21.1635 -21.1635 -21.1633 -21.1633 -8.4506 -8.4506 -8.0300 -8.0300 -7.8051 -7.8051 -7.3891 -7.3891 -6.2564 -6.2564 -5.9449 -5.9449 -5.8030 -5.8030 -5.4676 -5.4676 -4.9842 -4.9842 -4.6098 -4.6098 2.5412 2.5412 2.8551 2.8551 3.1493 3.1493 3.3116 3.3116 3.3986 3.3986 3.6198 3.6198 4.5303 4.5303 4.7936 4.7936 4.9516 4.9516 5.1944 5.1944 7.2376 7.2376 7.4810 7.4810 9.1204 9.1204 9.4206 9.4206 k = 0.4103 0.1230-0.7419 ( 5294 PWs) bands (ev): -21.1636 -21.1636 -21.1631 -21.1631 -8.4495 -8.4495 -8.0174 -8.0174 -7.8155 -7.8155 -7.3819 -7.3819 -6.2774 -6.2774 -5.9439 -5.9439 -5.7962 -5.7962 -5.4630 -5.4630 -5.0118 -5.0118 -4.6039 -4.6039 2.6083 2.6083 2.9045 2.9045 3.1548 3.1548 3.3233 3.3233 3.3899 3.3899 3.6105 3.6105 4.5353 4.5353 4.7964 4.7964 4.9452 4.9452 5.1994 5.1994 7.1467 7.1467 7.3986 7.3986 9.1426 9.1426 9.4515 9.4515 k = 0.4231 0.1269-0.7651 ( 5293 PWs) bands (ev): -21.1637 -21.1637 -21.1629 -21.1629 -8.4487 -8.4487 -8.0045 -8.0045 -7.8265 -7.8265 -7.3752 -7.3752 -6.2963 -6.2963 -5.9430 -5.9430 -5.7893 -5.7893 -5.4580 -5.4580 -5.0378 -5.0378 -4.5985 -4.5985 2.6731 2.6731 2.9490 2.9490 3.1548 3.1548 3.3320 3.3320 3.3829 3.3829 3.6015 3.6015 4.5397 4.5397 4.7993 4.7993 4.9416 4.9416 5.2064 5.2064 7.0642 7.0642 7.3231 7.3231 9.1603 9.1603 9.4810 9.4810 k = 0.4359 0.1307-0.7883 ( 5294 PWs) bands (ev): -21.1637 -21.1637 -21.1627 -21.1627 -8.4481 -8.4481 -7.9913 -7.9913 -7.8381 -7.8381 -7.3693 -7.3693 -6.3127 -6.3127 -5.9422 -5.9422 -5.7827 -5.7827 -5.4529 -5.4529 -5.0617 -5.0617 -4.5937 -4.5937 2.7352 2.7352 2.9881 2.9881 3.1489 3.1489 3.3360 3.3360 3.3797 3.3797 3.5931 3.5931 4.5431 4.5431 4.8020 4.8020 4.9408 4.9408 5.2146 5.2146 6.9913 6.9913 7.2559 7.2559 9.1738 9.1738 9.5083 9.5083 k = 0.4487 0.1346-0.8115 ( 5300 PWs) bands (ev): -21.1638 -21.1638 -21.1626 -21.1626 -8.4476 -8.4476 -7.9781 -7.9781 -7.8500 -7.8500 -7.3641 -7.3641 -6.3266 -6.3266 -5.9416 -5.9416 -5.7767 -5.7767 -5.4479 -5.4479 -5.0827 -5.0827 -4.5896 -4.5896 2.7938 2.7938 3.0213 3.0213 3.1371 3.1371 3.3344 3.3344 3.3813 3.3813 3.5855 3.5855 4.5453 4.5453 4.8047 4.8047 4.9421 4.9421 5.2232 5.2232 6.9293 6.9293 7.1984 7.1984 9.1838 9.1838 9.5322 9.5322 k = 0.4615 0.1384-0.8347 ( 5297 PWs) bands (ev): -21.1638 -21.1638 -21.1625 -21.1625 -8.4473 -8.4473 -7.9652 -7.9652 -7.8618 -7.8618 -7.3599 -7.3599 -6.3375 -6.3375 -5.9411 -5.9411 -5.7716 -5.7716 -5.4433 -5.4433 -5.1003 -5.1003 -4.5864 -4.5864 2.8480 2.8480 3.0481 3.0481 3.1200 3.1200 3.3297 3.3297 3.3856 3.3856 3.5791 3.5791 4.5465 4.5465 4.8072 4.8072 4.9446 4.9446 5.2311 5.2311 6.8795 6.8795 7.1520 7.1520 9.1907 9.1907 9.5519 9.5519 k = 0.4744 0.1423-0.8579 ( 5296 PWs) bands (ev): -21.1639 -21.1639 -21.1624 -21.1624 -8.4471 -8.4471 -7.9535 -7.9535 -7.8728 -7.8728 -7.3569 -7.3569 -6.3455 -6.3455 -5.9407 -5.9407 -5.7678 -5.7678 -5.4396 -5.4396 -5.1135 -5.1135 -4.5840 -4.5840 2.8959 2.8959 3.0676 3.0676 3.0992 3.0992 3.3247 3.3247 3.3899 3.3899 3.5742 3.5742 4.5470 4.5470 4.8093 4.8093 4.9473 4.9473 5.2375 5.2375 6.8430 6.8430 7.1178 7.1178 9.1952 9.1952 9.5667 9.5667 k = 0.4872 0.1461-0.8810 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4470 -8.4470 -7.9443 -7.9443 -7.8816 -7.8816 -7.3550 -7.3550 -6.3503 -6.3503 -5.9405 -5.9405 -5.7654 -5.7654 -5.4371 -5.4371 -5.1218 -5.1218 -4.5826 -4.5826 2.9334 2.9334 3.0733 3.0733 3.0843 3.0843 3.3212 3.3212 3.3929 3.3929 3.5712 3.5712 4.5471 4.5471 4.8106 4.8106 4.9494 4.9494 5.2417 5.2417 6.8207 6.8207 7.0968 7.0968 9.1977 9.1977 9.5758 9.5758 k = 0.5000 0.1499-0.9042 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4470 -8.4470 -7.9406 -7.9406 -7.8851 -7.8851 -7.3544 -7.3544 -6.3520 -6.3520 -5.9405 -5.9405 -5.7645 -5.7645 -5.4362 -5.4362 -5.1247 -5.1247 -4.5821 -4.5821 2.9494 2.9494 3.0649 3.0649 3.0863 3.0863 3.3199 3.3199 3.3940 3.3940 3.5701 3.5701 4.5471 4.5471 4.8111 4.8111 4.9501 4.9501 5.2432 5.2432 6.8131 6.8131 7.0898 7.0898 9.1985 9.1985 9.5789 9.5789 k = 0.5000 0.1499-0.9042 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4470 -8.4470 -7.9406 -7.9406 -7.8851 -7.8851 -7.3544 -7.3544 -6.3520 -6.3520 -5.9405 -5.9405 -5.7645 -5.7645 -5.4362 -5.4362 -5.1247 -5.1247 -4.5821 -4.5821 2.9494 2.9494 3.0649 3.0649 3.0863 3.0863 3.3199 3.3199 3.3940 3.3940 3.5701 3.5701 4.5471 4.5471 4.8111 4.8111 4.9501 4.9501 5.2432 5.2432 6.8131 6.8131 7.0898 7.0898 9.1985 9.1985 9.5789 9.5789 k = 0.4839 0.1451-0.9140 ( 5296 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4467 -8.4467 -7.9449 -7.9449 -7.8810 -7.8810 -7.3547 -7.3547 -6.3516 -6.3516 -5.9403 -5.9403 -5.7645 -5.7645 -5.4368 -5.4368 -5.1240 -5.1240 -4.5821 -4.5821 2.9478 2.9478 3.0655 3.0655 3.0843 3.0843 3.3201 3.3201 3.3945 3.3945 3.5692 3.5692 4.5477 4.5477 4.8115 4.8115 4.9510 4.9510 5.2430 5.2430 6.8150 6.8150 7.0912 7.0912 9.1985 9.1985 9.5789 9.5789 k = 0.4677 0.1403-0.9237 ( 5300 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4457 -8.4457 -7.9554 -7.9554 -7.8712 -7.8712 -7.3558 -7.3558 -6.3504 -6.3504 -5.9396 -5.9396 -5.7645 -5.7645 -5.4386 -5.4386 -5.1220 -5.1220 -4.5824 -4.5824 2.9433 2.9433 3.0669 3.0669 3.0788 3.0788 3.3207 3.3207 3.3960 3.3960 3.5666 3.5666 4.5493 4.5493 4.8125 4.8125 4.9534 4.9534 5.2424 5.2424 6.8205 6.8205 7.0954 7.0954 9.1986 9.1986 9.5789 9.5789 k = 0.4516 0.1354-0.9334 ( 5298 PWs) bands (ev): -21.1640 -21.1640 -21.1623 -21.1623 -8.4442 -8.4442 -7.9689 -7.9689 -7.8589 -7.8589 -7.3575 -7.3575 -6.3485 -6.3485 -5.9386 -5.9386 -5.7644 -5.7644 -5.4414 -5.4414 -5.1188 -5.1188 -4.5828 -4.5828 2.9361 2.9361 3.0645 3.0645 3.0743 3.0743 3.3215 3.3215 3.3983 3.3983 3.5622 3.5622 4.5522 4.5522 4.8140 4.8140 4.9576 4.9576 5.2415 5.2415 6.8296 6.8296 7.1025 7.1025 9.1988 9.1988 9.5787 9.5787 k = 0.4516 0.1354-0.9334 ( 5298 PWs) bands (ev): -21.1640 -21.1640 -21.1623 -21.1623 -8.4442 -8.4442 -7.9689 -7.9689 -7.8589 -7.8589 -7.3575 -7.3575 -6.3485 -6.3485 -5.9386 -5.9386 -5.7644 -5.7644 -5.4414 -5.4414 -5.1188 -5.1188 -4.5828 -4.5828 2.9361 2.9361 3.0645 3.0645 3.0743 3.0743 3.3215 3.3215 3.3983 3.3983 3.5622 3.5622 4.5522 4.5522 4.8140 4.8140 4.9576 4.9576 5.2415 5.2415 6.8296 6.8296 7.1025 7.1025 9.1988 9.1988 9.5787 9.5787 k = 0.4530 0.1359-0.9068 ( 5298 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4451 -8.4451 -7.9585 -7.9585 -7.8677 -7.8677 -7.3567 -7.3567 -6.3498 -6.3498 -5.9403 -5.9403 -5.7661 -5.7661 -5.4395 -5.4395 -5.1193 -5.1193 -4.5838 -4.5838 2.9503 2.9503 3.0627 3.0627 3.0835 3.0835 3.3195 3.3195 3.3949 3.3949 3.5648 3.5648 4.5520 4.5520 4.8141 4.8141 4.9565 4.9565 5.2452 5.2452 6.8151 6.8151 7.0892 7.0892 9.2025 9.2025 9.5801 9.5801 k = 0.4544 0.1363-0.8802 ( 5302 PWs) bands (ev): -21.1639 -21.1639 -21.1624 -21.1624 -8.4460 -8.4460 -7.9547 -7.9547 -7.8709 -7.8709 -7.3571 -7.3571 -6.3478 -6.3478 -5.9412 -5.9412 -5.7682 -5.7682 -5.4395 -5.4395 -5.1154 -5.1154 -4.5849 -4.5849 2.9281 2.9281 3.0744 3.0744 3.0881 3.0881 3.3208 3.3208 3.3910 3.3910 3.5689 3.5689 4.5511 4.5511 4.8127 4.8127 4.9535 4.9535 5.2441 5.2441 6.8213 6.8213 7.0957 7.0957 9.2022 9.2022 9.5748 9.5748 k = 0.4559 0.1367-0.8536 ( 5301 PWs) bands (ev): -21.1638 -21.1638 -21.1624 -21.1624 -8.4467 -8.4467 -7.9589 -7.9589 -7.8670 -7.8670 -7.3586 -7.3586 -6.3426 -6.3426 -5.9416 -5.9416 -5.7706 -5.7706 -5.4414 -5.4414 -5.1071 -5.1071 -4.5861 -4.5861 2.8846 2.8846 3.0668 3.0668 3.1055 3.1055 3.3254 3.3254 3.3871 3.3871 3.5745 3.5745 4.5492 4.5492 4.8100 4.8100 4.9489 4.9489 5.2383 5.2383 6.8482 6.8482 7.1216 7.1216 9.1976 9.1976 9.5632 9.5632 k = 0.4573 0.1371-0.8270 ( 5299 PWs) bands (ev): -21.1638 -21.1638 -21.1625 -21.1625 -8.4474 -8.4474 -7.9694 -7.9694 -7.8579 -7.8579 -7.3612 -7.3612 -6.3342 -6.3342 -5.9412 -5.9412 -5.7732 -5.7732 -5.4448 -5.4448 -5.0949 -5.0949 -4.5874 -4.5874 2.8306 2.8306 3.0400 3.0400 3.1262 3.1262 3.3314 3.3314 3.3841 3.3841 3.5811 3.5811 4.5462 4.5462 4.8064 4.8064 4.9437 4.9437 5.2286 5.2286 6.8945 6.8945 7.1660 7.1660 9.1887 9.1887 9.5459 9.5459 k = 0.4587 0.1376-0.8004 ( 5296 PWs) bands (ev): -21.1638 -21.1638 -21.1626 -21.1626 -8.4480 -8.4480 -7.9836 -7.9836 -7.8462 -7.8462 -7.3648 -7.3648 -6.3228 -6.3228 -5.9402 -5.9402 -5.7760 -5.7760 -5.4494 -5.4494 -5.0792 -5.0792 -4.5887 -4.5887 2.7699 2.7699 3.0013 3.0013 3.1422 3.1422 3.3361 3.3361 3.3834 3.3834 3.5875 3.5875 4.5421 4.5421 4.8024 4.8024 4.9395 4.9395 5.2160 5.2160 6.9587 6.9587 7.2272 7.2272 9.1756 9.1756 9.5236 9.5236 k = 0.4601 0.1380-0.7738 ( 5289 PWs) bands (ev): -21.1638 -21.1638 -21.1627 -21.1627 -8.4486 -8.4486 -7.9998 -7.9998 -7.8333 -7.8333 -7.3693 -7.3693 -6.3086 -6.3086 -5.9386 -5.9386 -5.7789 -5.7789 -5.4550 -5.4550 -5.0606 -5.0606 -4.5901 -4.5901 2.7040 2.7040 2.9527 2.9527 3.1529 3.1529 3.3362 3.3362 3.3863 3.3863 3.5928 3.5928 4.5370 4.5370 4.7982 4.7982 4.9381 4.9381 5.2016 5.2016 7.0384 7.0384 7.3032 7.3032 9.1586 9.1586 9.4967 9.4967 k = 0.4616 0.1384-0.7472 ( 5293 PWs) bands (ev): -21.1639 -21.1639 -21.1628 -21.1628 -8.4490 -8.4490 -8.0171 -8.0171 -7.8202 -7.8202 -7.3747 -7.3747 -6.2916 -6.2916 -5.9363 -5.9363 -5.7818 -5.7818 -5.4611 -5.4611 -5.0393 -5.0393 -4.5914 -4.5914 2.6338 2.6338 2.8962 2.8962 3.1587 3.1587 3.3314 3.3314 3.3916 3.3916 3.5960 3.5960 4.5319 4.5319 4.7939 4.7939 4.9407 4.9407 5.1866 5.1866 7.1315 7.1315 7.3922 7.3922 9.1381 9.1381 9.4658 9.4658 k = 0.4630 0.1388-0.7206 ( 5300 PWs) bands (ev): -21.1639 -21.1639 -21.1629 -21.1629 -8.4494 -8.4494 -8.0352 -8.0352 -7.8072 -7.8072 -7.3807 -7.3807 -6.2723 -6.2723 -5.9335 -5.9335 -5.7845 -5.7845 -5.4677 -5.4677 -5.0160 -5.0160 -4.5927 -4.5927 2.5601 2.5601 2.8328 2.8328 3.1602 3.1602 3.3230 3.3230 3.3968 3.3968 3.5969 3.5969 4.5277 4.5277 4.7898 4.7898 4.9479 4.9479 5.1720 5.1720 7.2355 7.2355 7.4918 7.4918 9.1149 9.1149 9.4315 9.4315 k = 0.4644 0.1393-0.6941 ( 5298 PWs) bands (ev): -21.1640 -21.1640 -21.1630 -21.1630 -8.4498 -8.4498 -8.0536 -8.0536 -7.7946 -7.7946 -7.3873 -7.3873 -6.2508 -6.2508 -5.9301 -5.9301 -5.7870 -5.7870 -5.4745 -5.4745 -4.9909 -4.9909 -4.5939 -4.5939 2.4835 2.4835 2.7638 2.7638 3.1579 3.1579 3.3121 3.3121 3.3998 3.3998 3.5955 3.5955 4.5254 4.5254 4.7866 4.7866 4.9594 4.9594 5.1587 5.1587 7.3483 7.3483 7.6004 7.6004 9.0897 9.0897 9.3943 9.3943 k = 0.4658 0.1397-0.6675 ( 5303 PWs) bands (ev): -21.1640 -21.1640 -21.1632 -21.1632 -8.4501 -8.4501 -8.0723 -8.0723 -7.7824 -7.7824 -7.3945 -7.3945 -6.2274 -6.2274 -5.9261 -5.9261 -5.7891 -5.7891 -5.4814 -5.4814 -4.9644 -4.9644 -4.5949 -4.5949 2.4046 2.4046 2.6900 2.6900 3.1524 3.1524 3.2993 3.2993 3.3996 3.3996 3.5921 3.5921 4.5259 4.5259 4.7848 4.7848 4.9740 4.9740 5.1478 5.1478 7.4677 7.4677 7.7159 7.7159 9.0635 9.0635 9.3545 9.3545 k = 0.4673 0.1401-0.6409 ( 5303 PWs) bands (ev): -21.1641 -21.1641 -21.1633 -21.1633 -8.4504 -8.4504 -8.0910 -8.0910 -7.7707 -7.7707 -7.4020 -7.4020 -6.2024 -6.2024 -5.9218 -5.9218 -5.7907 -5.7907 -5.4884 -5.4884 -4.9368 -4.9368 -4.5957 -4.5957 2.3239 2.3239 2.6123 2.6123 3.1439 3.1439 3.2846 3.2846 3.3958 3.3958 3.5875 3.5875 4.5297 4.5297 4.7851 4.7851 4.9900 4.9900 5.1401 5.1401 7.5915 7.5915 7.8368 7.8368 9.0374 9.0374 9.3126 9.3126 k = 0.4687 0.1406-0.6143 ( 5309 PWs) bands (ev): -21.1642 -21.1642 -21.1634 -21.1634 -8.4506 -8.4506 -8.1098 -8.1098 -7.7596 -7.7596 -7.4098 -7.4098 -6.1762 -6.1762 -5.9170 -5.9170 -5.7917 -5.7917 -5.4953 -5.4953 -4.9084 -4.9084 -4.5963 -4.5963 2.2420 2.2420 2.5315 2.5315 3.1327 3.1327 3.2682 3.2682 3.3888 3.3888 3.5820 3.5820 4.5370 4.5370 4.7878 4.7878 5.0055 5.0055 5.1372 5.1372 7.7176 7.7176 7.9614 7.9614 9.0128 9.0128 9.2689 9.2689 k = 0.4701 0.1410-0.5877 ( 5301 PWs) bands (ev): -21.1643 -21.1643 -21.1636 -21.1636 -8.4507 -8.4507 -8.1284 -8.1284 -7.7489 -7.7489 -7.4179 -7.4179 -6.1491 -6.1491 -5.9119 -5.9119 -5.7919 -5.7919 -5.5022 -5.5022 -4.8794 -4.8794 -4.5964 -4.5964 2.1595 2.1595 2.4483 2.4483 3.1192 3.1192 3.2501 3.2501 3.3792 3.3792 3.5763 3.5763 4.5477 4.5477 4.7930 4.7930 5.0183 5.0183 5.1404 5.1404 7.8435 7.8435 8.0882 8.0882 8.9914 8.9914 9.2236 9.2236 k = 0.4715 0.1414-0.5611 ( 5305 PWs) bands (ev): -21.1644 -21.1644 -21.1637 -21.1637 -8.4508 -8.4508 -8.1467 -8.1467 -7.7387 -7.7387 -7.4260 -7.4260 -6.1214 -6.1214 -5.9066 -5.9066 -5.7913 -5.7913 -5.5091 -5.5091 -4.8501 -4.8501 -4.5962 -4.5962 2.0769 2.0769 2.3634 2.3634 3.1035 3.1035 3.2302 3.2302 3.3678 3.3678 3.5703 3.5703 4.5615 4.5615 4.8008 4.8008 5.0273 5.0273 5.1502 5.1502 7.9662 7.9662 8.2157 8.2157 8.9753 8.9753 9.1771 9.1771 k = 0.4729 0.1418-0.5345 ( 5301 PWs) bands (ev): -21.1645 -21.1645 -21.1639 -21.1639 -8.4508 -8.4508 -8.1648 -8.1648 -7.7289 -7.7289 -7.4343 -7.4343 -6.0934 -6.0934 -5.9011 -5.9011 -5.7898 -5.7898 -5.5158 -5.5158 -4.8207 -4.8207 -4.5955 -4.5955 1.9947 1.9947 2.2774 2.2774 3.0862 3.0862 3.2087 3.2087 3.3556 3.3556 3.5643 3.5643 4.5781 4.5781 4.8109 4.8109 5.0328 5.0328 5.1657 5.1657 8.0816 8.0816 8.3424 8.3424 8.9676 8.9676 9.1296 9.1296 k = 0.4744 0.1423-0.5079 ( 5300 PWs) bands (ev): -21.1646 -21.1646 -21.1641 -21.1641 -8.4507 -8.4507 -8.1826 -8.1826 -7.7195 -7.7195 -7.4426 -7.4426 -6.0655 -6.0655 -5.8956 -5.8956 -5.7871 -5.7871 -5.5226 -5.5226 -4.7914 -4.7914 -4.5942 -4.5942 1.9135 1.9135 2.1911 2.1911 3.0676 3.0676 3.1857 3.1857 3.3432 3.3432 3.5579 3.5579 4.5970 4.5970 4.8232 4.8232 5.0365 5.0365 5.1848 5.1848 8.1851 8.1851 8.4667 8.4667 8.9713 8.9713 9.0821 9.0821 k = 0.4758 0.1427-0.4813 ( 5294 PWs) bands (ev): -21.1647 -21.1647 -21.1642 -21.1642 -8.4506 -8.4506 -8.2000 -8.2000 -7.7105 -7.7105 -7.4509 -7.4509 -6.0381 -6.0381 -5.8900 -5.8900 -5.7834 -5.7834 -5.5293 -5.5293 -4.7626 -4.7626 -4.5923 -4.5923 1.8339 1.8339 2.1050 2.1050 3.0480 3.0480 3.1617 3.1617 3.3313 3.3313 3.5512 3.5512 4.6178 4.6178 4.8374 4.8374 5.0396 5.0396 5.2056 5.2056 8.2708 8.2708 8.5869 8.5869 8.9860 8.9860 9.0400 9.0400 k = 0.4772 0.1431-0.4547 ( 5295 PWs) bands (ev): -21.1648 -21.1648 -21.1644 -21.1644 -8.4502 -8.4502 -8.2169 -8.2169 -7.7019 -7.7019 -7.4591 -7.4591 -6.0116 -6.0116 -5.8845 -5.8845 -5.7784 -5.7784 -5.5359 -5.5359 -4.7343 -4.7343 -4.5897 -4.5897 1.7564 1.7564 2.0197 2.0197 3.0280 3.0280 3.1370 3.1370 3.3201 3.3201 3.5438 3.5438 4.6402 4.6402 4.8532 4.8532 5.0432 5.0432 5.2267 5.2267 8.3345 8.3345 8.7013 8.7013 8.9694 8.9694 9.0493 9.0493 k = 0.4786 0.1435-0.4281 ( 5293 PWs) bands (ev): -21.1649 -21.1649 -21.1645 -21.1645 -8.4498 -8.4498 -8.2334 -8.2334 -7.6935 -7.6935 -7.4673 -7.4673 -5.9862 -5.9862 -5.8791 -5.8791 -5.7723 -5.7723 -5.5425 -5.5425 -4.7068 -4.7068 -4.5864 -4.5864 1.6814 1.6814 1.9357 1.9357 3.0079 3.0079 3.1119 3.1119 3.3102 3.3102 3.5356 3.5356 4.6639 4.6639 4.8703 4.8703 5.0477 5.0477 5.2471 5.2471 8.3750 8.3750 8.8062 8.8062 8.9253 8.9253 9.1076 9.1076 k = 0.4801 0.1440-0.4015 ( 5286 PWs) bands (ev): -21.1650 -21.1650 -21.1647 -21.1647 -8.4492 -8.4492 -8.2493 -8.2493 -7.6853 -7.6853 -7.4754 -7.4754 -5.9622 -5.9622 -5.8738 -5.8738 -5.7649 -5.7649 -5.5490 -5.5490 -4.6804 -4.6804 -4.5823 -4.5823 1.6095 1.6095 1.8537 1.8537 2.9881 2.9881 3.0868 3.0868 3.3015 3.3015 3.5266 3.5266 4.6885 4.6885 4.8885 4.8885 5.0533 5.0533 5.2662 5.2662 8.3957 8.3957 8.8569 8.8569 8.9237 8.9237 9.1835 9.1835 k = 0.4815 0.1444-0.3749 ( 5286 PWs) bands (ev): -21.1651 -21.1651 -21.1648 -21.1648 -8.4484 -8.4484 -8.2646 -8.2646 -7.6774 -7.6774 -7.4835 -7.4835 -5.9400 -5.9400 -5.8686 -5.8686 -5.7564 -5.7564 -5.5554 -5.5554 -4.6552 -4.6552 -4.5774 -4.5774 1.5412 1.5412 1.7740 1.7740 2.9689 2.9689 3.0621 3.0621 3.2942 3.2942 3.5165 3.5165 4.7137 4.7137 4.9074 4.9074 5.0601 5.0601 5.2836 5.2836 8.4020 8.4020 8.8138 8.8138 9.0058 9.0058 9.2664 9.2664 k = 0.4829 0.1448-0.3483 ( 5296 PWs) bands (ev): -21.1653 -21.1653 -21.1650 -21.1650 -8.4473 -8.4473 -8.2794 -8.2794 -7.6697 -7.6697 -7.4914 -7.4914 -5.9198 -5.9198 -5.8636 -5.8636 -5.7469 -5.7469 -5.5618 -5.5618 -4.6315 -4.6315 -4.5717 -4.5717 1.4768 1.4768 1.6972 1.6972 2.9505 2.9505 3.0380 3.0380 3.2884 3.2884 3.5054 3.5054 4.7393 4.7393 4.9265 4.9265 5.0684 5.0684 5.2988 5.2988 8.3987 8.3987 8.7639 8.7639 9.0848 9.0848 9.3471 9.3471 k = 0.4843 0.1452-0.3217 ( 5289 PWs) bands (ev): -21.1654 -21.1654 -21.1651 -21.1651 -8.4460 -8.4460 -8.2935 -8.2935 -7.6620 -7.6620 -7.4993 -7.4993 -5.9017 -5.9017 -5.8586 -5.8586 -5.7366 -5.7366 -5.5680 -5.5680 -4.6094 -4.6094 -4.5653 -4.5653 1.4169 1.4169 1.6238 1.6238 2.9334 2.9334 3.0147 3.0147 3.2841 3.2841 3.4934 3.4934 4.7651 4.7651 4.9453 4.9453 5.0781 5.0781 5.3116 5.3116 8.3896 8.3896 8.7138 8.7138 9.1544 9.1544 9.4169 9.4169 k = 0.4858 0.1457-0.2951 ( 5293 PWs) bands (ev): -21.1655 -21.1655 -21.1652 -21.1652 -8.4444 -8.4444 -8.3070 -8.3070 -7.6545 -7.6545 -7.5071 -7.5071 -5.8857 -5.8857 -5.8538 -5.8538 -5.7256 -5.7256 -5.5742 -5.5742 -4.5894 -4.5894 -4.5580 -4.5580 1.3619 1.3619 1.5541 1.5541 2.9175 2.9175 2.9926 2.9926 3.2813 3.2813 3.4804 3.4804 4.7908 4.7908 4.9630 4.9630 5.0895 5.0895 5.3218 5.3218 8.3773 8.3773 8.6646 8.6646 9.2147 9.2147 9.4695 9.4695 k = 0.4872 0.1461-0.2685 ( 5293 PWs) bands (ev): -21.1656 -21.1656 -21.1654 -21.1654 -8.4425 -8.4425 -8.3199 -8.3199 -7.6471 -7.6471 -7.5148 -7.5148 -5.8719 -5.8719 -5.8490 -5.8490 -5.7144 -5.7144 -5.5802 -5.5802 -4.5715 -4.5715 -4.5500 -4.5500 1.3120 1.3120 1.4886 1.4886 2.9032 2.9032 2.9717 2.9717 3.2802 3.2802 3.4666 3.4666 4.8162 4.8162 4.9788 4.9788 5.1028 5.1028 5.3294 5.3294 8.3636 8.3636 8.6170 8.6170 9.2664 9.2664 9.5028 9.5028 k = 0.4886 0.1465-0.2419 ( 5289 PWs) bands (ev): -21.1656 -21.1656 -21.1655 -21.1655 -8.4402 -8.4402 -8.3321 -8.3321 -7.6398 -7.6398 -7.5224 -7.5224 -5.8601 -5.8601 -5.8444 -5.8444 -5.7032 -5.7032 -5.5862 -5.5862 -4.5562 -4.5562 -4.5410 -4.5410 1.2677 1.2677 1.4276 1.4276 2.8906 2.8906 2.9522 2.9522 3.2806 3.2806 3.4522 3.4522 4.8410 4.8410 4.9921 4.9921 5.1183 5.1183 5.3342 5.3342 8.3499 8.3499 8.5714 8.5714 9.3103 9.3103 9.5202 9.5202 k = 0.4900 0.1470-0.2153 ( 5288 PWs) bands (ev): -21.1657 -21.1657 -21.1656 -21.1656 -8.4376 -8.4376 -8.3436 -8.3436 -7.6325 -7.6325 -7.5300 -7.5300 -5.8503 -5.8503 -5.8398 -5.8398 -5.6922 -5.6922 -5.5920 -5.5920 -4.5438 -4.5438 -4.5313 -4.5313 1.2292 1.2292 1.3714 1.3714 2.8797 2.8797 2.9342 2.9342 3.2826 3.2826 3.4374 3.4374 4.8650 4.8650 5.0023 5.0023 5.1359 5.1359 5.3362 5.3362 8.3371 8.3371 8.5283 8.5283 9.3477 9.3477 9.5268 9.5268 k = 0.4915 0.1474-0.1887 ( 5290 PWs) bands (ev): -21.1658 -21.1658 -21.1657 -21.1657 -8.4345 -8.4345 -8.3544 -8.3544 -7.6252 -7.6252 -7.5375 -7.5375 -5.8424 -5.8424 -5.8353 -5.8353 -5.6817 -5.6817 -5.5977 -5.5977 -4.5335 -4.5335 -4.5215 -4.5215 1.1968 1.1968 1.3206 1.3206 2.8708 2.8708 2.9179 2.9179 3.2861 3.2861 3.4223 3.4223 4.8879 4.8879 5.0093 5.0093 5.1552 5.1552 5.3353 5.3353 8.3261 8.3261 8.4882 8.4882 9.3794 9.3794 9.5271 9.5271 k = 0.4929 0.1478-0.1621 ( 5290 PWs) bands (ev): -21.1658 -21.1658 -21.1657 -21.1657 -8.4309 -8.4309 -8.3646 -8.3646 -7.6180 -7.6180 -7.5450 -7.5450 -5.8362 -5.8362 -5.8311 -5.8311 -5.6718 -5.6718 -5.6033 -5.6033 -4.5248 -4.5248 -4.5128 -4.5128 1.1708 1.1708 1.2752 1.2752 2.8637 2.8637 2.9033 2.9033 3.2912 3.2912 3.4071 3.4071 4.9096 4.9096 5.0132 5.0132 5.1756 5.1756 5.3317 5.3317 8.3176 8.3176 8.4514 8.4514 9.4063 9.4063 9.5239 9.5239 k = 0.4943 0.1482-0.1356 ( 5299 PWs) bands (ev): -21.1659 -21.1659 -21.1658 -21.1658 -8.4269 -8.4269 -8.3740 -8.3740 -7.6107 -7.6107 -7.5524 -7.5524 -5.8315 -5.8315 -5.8274 -5.8274 -5.6626 -5.6626 -5.6089 -5.6089 -4.5171 -4.5171 -4.5058 -4.5058 1.1512 1.1512 1.2357 1.2357 2.8586 2.8586 2.8905 2.8905 3.2977 3.2977 3.3921 3.3921 4.9297 4.9297 5.0141 5.0141 5.1966 5.1966 5.3253 5.3253 8.3121 8.3121 8.4185 8.4185 9.4290 9.4290 9.5189 9.5189 k = 0.4957 0.1487-0.1090 ( 5297 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4224 -8.4224 -8.3829 -8.3829 -7.6035 -7.6035 -7.5598 -7.5598 -5.8278 -5.8278 -5.8245 -5.8245 -5.6541 -5.6541 -5.6145 -5.6145 -4.5104 -4.5104 -4.5009 -4.5009 1.1384 1.1384 1.2022 1.2022 2.8555 2.8555 2.8796 2.8796 3.3057 3.3057 3.3774 3.3774 4.9480 4.9480 5.0121 5.0121 5.2175 5.2175 5.3162 5.3162 8.3102 8.3102 8.3896 8.3896 9.4480 9.4480 9.5128 9.5128 k = 0.4972 0.1491-0.0824 ( 5294 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4173 -8.4173 -8.3910 -8.3910 -7.5962 -7.5962 -7.5671 -7.5671 -5.8250 -5.8250 -5.8226 -5.8226 -5.6463 -5.6463 -5.6202 -5.6202 -4.5048 -4.5048 -4.4979 -4.4979 1.1322 1.1322 1.1751 1.1751 2.8545 2.8545 2.8706 2.8706 3.3150 3.3150 3.3632 3.3632 4.9644 4.9644 5.0075 5.0075 5.2379 5.2379 5.3047 5.3047 8.3123 8.3123 8.3650 8.3650 9.4640 9.4640 9.5057 9.5057 k = 0.4986 0.1495-0.0558 ( 5290 PWs) bands (ev): -21.1660 -21.1660 -21.1659 -21.1659 -8.4116 -8.4116 -8.3985 -8.3985 -7.5890 -7.5890 -7.5744 -7.5744 -5.8230 -5.8230 -5.8217 -5.8217 -5.6391 -5.6391 -5.6261 -5.6261 -4.5006 -4.5006 -4.4970 -4.4970 1.1329 1.1329 1.1544 1.1544 2.8555 2.8555 2.8636 2.8636 3.3255 3.3255 3.3497 3.3497 4.9787 4.9787 5.0003 5.0003 5.2571 5.2571 5.2908 5.2908 8.3187 8.3187 8.3450 8.3450 9.4772 9.4772 9.4977 9.4977 k = 0.5000 0.1499-0.0292 ( 5286 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4054 -8.4054 -8.4054 -8.4054 -7.5817 -7.5817 -7.5817 -7.5817 -5.8219 -5.8219 -5.8219 -5.8219 -5.6324 -5.6324 -5.6324 -5.6324 -4.4980 -4.4980 -4.4979 -4.4979 1.1403 1.1403 1.1403 1.1403 2.8585 2.8585 2.8585 2.8585 3.3371 3.3371 3.3371 3.3371 4.9907 4.9907 4.9907 4.9907 5.2749 5.2749 5.2749 5.2749 8.3295 8.3295 8.3295 8.3295 9.4883 9.4883 9.4883 9.4883 k = 0.5000 0.1499-0.0292 ( 5286 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4054 -8.4054 -8.4054 -8.4054 -7.5817 -7.5817 -7.5817 -7.5817 -5.8219 -5.8219 -5.8219 -5.8219 -5.6324 -5.6324 -5.6324 -5.6324 -4.4980 -4.4980 -4.4979 -4.4979 1.1403 1.1403 1.1403 1.1403 2.8585 2.8585 2.8585 2.8585 3.3371 3.3371 3.3371 3.3371 4.9907 4.9907 4.9907 4.9907 5.2749 5.2749 5.2749 5.2749 8.3295 8.3295 8.3295 8.3295 9.4883 9.4883 9.4883 9.4883 k = 0.5076 0.1244-0.0292 ( 5294 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4082 -8.4082 -8.4023 -8.4023 -7.5871 -7.5871 -7.5765 -7.5765 -5.8229 -5.8229 -5.8217 -5.8217 -5.6346 -5.6346 -5.6301 -5.6301 -4.4982 -4.4982 -4.4981 -4.4981 1.1401 1.1401 1.1420 1.1420 2.8502 2.8502 2.8643 2.8643 3.3299 3.3299 3.3465 3.3465 4.9851 4.9851 4.9950 4.9950 5.2715 5.2715 5.2796 5.2796 8.3316 8.3316 8.3320 8.3320 9.4859 9.4859 9.4893 9.4893 k = 0.5153 0.0989-0.0292 ( 5296 PWs) bands (ev): -21.1659 -21.1659 -21.1659 -21.1659 -8.4107 -8.4107 -8.3990 -8.3990 -7.5926 -7.5926 -7.5714 -7.5714 -5.8248 -5.8248 -5.8223 -5.8223 -5.6369 -5.6369 -5.6279 -5.6279 -4.4988 -4.4988 -4.4986 -4.4986 1.1415 1.1415 1.1453 1.1453 2.8398 2.8398 2.8673 2.8673 3.3251 3.3251 3.3577 3.3577 4.9783 4.9783 4.9978 4.9978 5.2699 5.2699 5.2858 5.2858 8.3383 8.3383 8.3391 8.3391 9.4821 9.4821 9.4890 9.4890 k = 0.5229 0.0734-0.0292 ( 5298 PWs) bands (ev): -21.1658 -21.1658 -21.1658 -21.1658 -8.4129 -8.4129 -8.3954 -8.3954 -7.5982 -7.5982 -7.5665 -7.5665 -5.8275 -5.8275 -5.8237 -5.8237 -5.6391 -5.6391 -5.6258 -5.6258 -4.4996 -4.4996 -4.4994 -4.4994 1.1445 1.1445 1.1502 1.1502 2.8276 2.8276 2.8676 2.8676 3.3227 3.3227 3.3703 3.3703 4.9705 4.9705 4.9991 4.9991 5.2699 5.2699 5.2931 5.2931 8.3494 8.3494 8.3506 8.3506 9.4775 9.4775 9.4877 9.4877 k = 0.5306 0.0479-0.0292 ( 5310 PWs) bands (ev): -21.1657 -21.1657 -21.1657 -21.1657 -8.4149 -8.4149 -8.3915 -8.3915 -7.6038 -7.6038 -7.5619 -7.5619 -5.8310 -5.8310 -5.8258 -5.8258 -5.6413 -5.6413 -5.6240 -5.6240 -4.5008 -4.5008 -4.5007 -4.5007 1.1491 1.1491 1.1567 1.1567 2.8139 2.8139 2.8650 2.8650 3.3228 3.3228 3.3840 3.3840 4.9619 4.9619 4.9990 4.9990 5.2717 5.2717 5.3013 5.3013 8.3646 8.3646 8.3663 8.3663 9.4725 9.4725 9.4861 9.4861 k = 0.5382 0.0224-0.0292 ( 5304 PWs) bands (ev): -21.1656 -21.1656 -21.1656 -21.1656 -8.4165 -8.4165 -8.3875 -8.3875 -7.6095 -7.6095 -7.5574 -7.5574 -5.8350 -5.8350 -5.8285 -5.8285 -5.6436 -5.6436 -5.6225 -5.6225 -4.5023 -4.5023 -4.5022 -4.5022 1.1553 1.1553 1.1647 1.1647 2.7993 2.7993 2.8599 2.8599 3.3250 3.3250 3.3983 3.3983 4.9528 4.9528 4.9975 4.9975 5.2751 5.2751 5.3104 5.3104 8.3837 8.3837 8.3858 8.3858 9.4679 9.4679 9.4848 9.4848 k = 0.5459-0.0031-0.0292 ( 5308 PWs) bands (ev): -21.1655 -21.1655 -21.1655 -21.1655 -8.4179 -8.4179 -8.3832 -8.3832 -7.6152 -7.6152 -7.5531 -7.5531 -5.8395 -5.8395 -5.8316 -5.8316 -5.6461 -5.6461 -5.6216 -5.6216 -4.5044 -4.5044 -4.5037 -4.5037 1.1630 1.1630 1.1743 1.1743 2.7840 2.7840 2.8526 2.8526 3.3290 3.3290 3.4129 3.4129 4.9434 4.9434 4.9947 4.9947 5.2800 5.2800 5.3201 5.3201 8.4062 8.4062 8.4088 8.4088 9.4645 9.4645 9.4846 9.4846 k = 0.5535-0.0286-0.0292 ( 5308 PWs) bands (ev): -21.1653 -21.1653 -21.1653 -21.1653 -8.4190 -8.4190 -8.3788 -8.3788 -7.6208 -7.6208 -7.5490 -7.5490 -5.8444 -5.8444 -5.8352 -5.8352 -5.6490 -5.6490 -5.6213 -5.6213 -4.5067 -4.5067 -4.5054 -4.5054 1.1724 1.1724 1.1853 1.1853 2.7684 2.7684 2.8434 2.8434 3.3344 3.3344 3.4274 3.4274 4.9337 4.9337 4.9911 4.9911 5.2863 5.2863 5.3303 5.3303 8.4316 8.4316 8.4348 8.4348 9.4631 9.4631 9.4863 9.4863 k = 0.5612-0.0541-0.0292 ( 5306 PWs) bands (ev): -21.1651 -21.1651 -21.1651 -21.1651 -8.4198 -8.4198 -8.3742 -8.3742 -7.6263 -7.6263 -7.5452 -7.5452 -5.8496 -5.8496 -5.8391 -5.8391 -5.6521 -5.6521 -5.6218 -5.6218 -4.5094 -4.5094 -4.5071 -4.5071 1.1833 1.1833 1.1979 1.1979 2.7527 2.7527 2.8327 2.8327 3.3408 3.3408 3.4414 3.4414 4.9242 4.9242 4.9868 4.9868 5.2936 5.2936 5.3408 5.3408 8.4596 8.4596 8.4634 8.4634 9.4644 9.4644 9.4907 9.4907 k = 0.5688-0.0796-0.0292 ( 5300 PWs) bands (ev): -21.1649 -21.1649 -21.1649 -21.1649 -8.4204 -8.4204 -8.3695 -8.3695 -7.6317 -7.6317 -7.5415 -7.5415 -5.8550 -5.8550 -5.8432 -5.8432 -5.6558 -5.6558 -5.6233 -5.6233 -4.5124 -4.5124 -4.5089 -4.5089 1.1957 1.1957 1.2119 1.2119 2.7373 2.7373 2.8211 2.8211 3.3477 3.3477 3.4547 3.4547 4.9148 4.9148 4.9820 4.9820 5.3017 5.3017 5.3515 5.3515 8.4897 8.4897 8.4941 8.4941 9.4689 9.4689 9.4984 9.4984 k = 0.5765-0.1051-0.0292 ( 5300 PWs) bands (ev): -21.1647 -21.1647 -21.1647 -21.1647 -8.4207 -8.4207 -8.3648 -8.3648 -7.6368 -7.6368 -7.5380 -7.5380 -5.8603 -5.8603 -5.8473 -5.8473 -5.6600 -5.6600 -5.6258 -5.6258 -4.5157 -4.5157 -4.5107 -4.5107 1.2097 1.2097 1.2274 1.2274 2.7223 2.7223 2.8087 2.8087 3.3548 3.3548 3.4670 3.4670 4.9059 4.9059 4.9772 4.9772 5.3104 5.3104 5.3622 5.3622 8.5216 8.5216 8.5265 8.5265 9.4770 9.4770 9.5096 9.5096 k = 0.5841-0.1306-0.0292 ( 5300 PWs) bands (ev): -21.1644 -21.1644 -21.1644 -21.1644 -8.4207 -8.4207 -8.3599 -8.3599 -7.6418 -7.6418 -7.5348 -7.5348 -5.8656 -5.8656 -5.8515 -5.8515 -5.6649 -5.6649 -5.6294 -5.6294 -4.5193 -4.5193 -4.5124 -4.5124 1.2253 1.2253 1.2443 1.2443 2.7080 2.7080 2.7961 2.7961 3.3617 3.3617 3.4781 3.4781 4.8975 4.8975 4.9724 4.9724 5.3193 5.3193 5.3727 5.3727 8.5548 8.5548 8.5602 8.5602 9.4886 9.4886 9.5246 9.5246 k = 0.5918-0.1561-0.0292 ( 5304 PWs) bands (ev): -21.1642 -21.1642 -21.1642 -21.1642 -8.4206 -8.4206 -8.3551 -8.3551 -7.6464 -7.6464 -7.5317 -7.5317 -5.8707 -5.8707 -5.8555 -5.8555 -5.6704 -5.6704 -5.6343 -5.6343 -4.5232 -4.5232 -4.5140 -4.5140 1.2423 1.2423 1.2627 1.2627 2.6946 2.6946 2.7834 2.7834 3.3681 3.3681 3.4879 3.4879 4.8898 4.8898 4.9680 4.9680 5.3283 5.3283 5.3829 5.3829 8.5891 8.5891 8.5950 8.5950 9.5034 9.5034 9.5431 9.5431 k = 0.5994-0.1816-0.0292 ( 5300 PWs) bands (ev): -21.1639 -21.1639 -21.1639 -21.1639 -8.4202 -8.4202 -8.3502 -8.3502 -7.6507 -7.6507 -7.5289 -7.5289 -5.8755 -5.8755 -5.8594 -5.8594 -5.6767 -5.6767 -5.6404 -5.6404 -4.5272 -4.5272 -4.5155 -4.5155 1.2609 1.2609 1.2824 1.2824 2.6822 2.6822 2.7710 2.7710 3.3739 3.3739 3.4962 3.4962 4.8830 4.8830 4.9639 4.9639 5.3370 5.3370 5.3926 5.3926 8.6245 8.6245 8.6307 8.6307 9.5206 9.5206 9.5644 9.5644 k = 0.6071-0.2071-0.0292 ( 5300 PWs) bands (ev): -21.1636 -21.1636 -21.1636 -21.1636 -8.4195 -8.4195 -8.3454 -8.3454 -7.6546 -7.6546 -7.5262 -7.5262 -5.8800 -5.8800 -5.8631 -5.8631 -5.6837 -5.6837 -5.6478 -5.6478 -4.5316 -4.5316 -4.5168 -4.5168 1.2809 1.2809 1.3035 1.3035 2.6709 2.6709 2.7592 2.7592 3.3787 3.3787 3.5028 3.5028 4.8770 4.8770 4.9605 4.9605 5.3453 5.3453 5.4016 5.4016 8.6608 8.6608 8.6671 8.6671 9.5387 9.5387 9.5874 9.5874 k = 0.6147-0.2326-0.0292 ( 5298 PWs) bands (ev): -21.1633 -21.1633 -21.1633 -21.1633 -8.4187 -8.4187 -8.3407 -8.3407 -7.6581 -7.6581 -7.5237 -7.5237 -5.8841 -5.8841 -5.8665 -5.8665 -5.6914 -5.6914 -5.6565 -5.6565 -4.5361 -4.5361 -4.5180 -4.5180 1.3024 1.3024 1.3260 1.3260 2.6609 2.6609 2.7479 2.7479 3.3826 3.3826 3.5078 3.5078 4.8720 4.8720 4.9577 4.9577 5.3531 5.3531 5.4098 5.4098 8.6979 8.6979 8.7043 8.7043 9.5555 9.5555 9.6097 9.6097 k = 0.6224-0.2581-0.0292 ( 5310 PWs) bands (ev): -21.1630 -21.1630 -21.1630 -21.1630 -8.4176 -8.4176 -8.3360 -8.3360 -7.6611 -7.6611 -7.5213 -7.5213 -5.8877 -5.8877 -5.8696 -5.8696 -5.6999 -5.6999 -5.6665 -5.6665 -4.5409 -4.5409 -4.5190 -4.5190 1.3253 1.3253 1.3497 1.3497 2.6522 2.6522 2.7376 2.7376 3.3855 3.3855 3.5110 3.5110 4.8680 4.8680 4.9556 4.9556 5.3600 5.3600 5.4171 5.4171 8.7359 8.7359 8.7421 8.7421 9.5681 9.5681 9.6281 9.6281 k = 0.6300-0.2836-0.0292 ( 5298 PWs) bands (ev): -21.1627 -21.1627 -21.1627 -21.1627 -8.4164 -8.4164 -8.3315 -8.3315 -7.6636 -7.6636 -7.5192 -7.5192 -5.8908 -5.8908 -5.8722 -5.8722 -5.7090 -5.7090 -5.6778 -5.6778 -4.5458 -4.5458 -4.5200 -4.5200 1.3496 1.3496 1.3748 1.3748 2.6451 2.6451 2.7283 2.7283 3.3872 3.3872 3.5125 3.5125 4.8650 4.8650 4.9542 4.9542 5.3661 5.3661 5.4233 5.4233 8.7745 8.7745 8.7804 8.7804 9.5733 9.5733 9.6374 9.6374 k = 0.6377-0.3091-0.0292 ( 5294 PWs) bands (ev): -21.1624 -21.1624 -21.1624 -21.1624 -8.4149 -8.4149 -8.3272 -8.3272 -7.6656 -7.6656 -7.5173 -7.5173 -5.8934 -5.8934 -5.8745 -5.8745 -5.7188 -5.7188 -5.6903 -5.6903 -4.5510 -4.5510 -4.5208 -4.5208 1.3752 1.3752 1.4012 1.4012 2.6394 2.6394 2.7200 2.7200 3.3878 3.3878 3.5124 3.5124 4.8629 4.8629 4.9534 4.9534 5.3712 5.3712 5.4283 5.4283 8.8137 8.8137 8.8190 8.8190 9.5689 9.5689 9.6335 9.6335 k = 0.6453-0.3346-0.0292 ( 5292 PWs) bands (ev): -21.1621 -21.1621 -21.1621 -21.1621 -8.4133 -8.4133 -8.3230 -8.3230 -7.6670 -7.6670 -7.5156 -7.5156 -5.8955 -5.8955 -5.8763 -5.8763 -5.7292 -5.7292 -5.7039 -5.7039 -4.5565 -4.5565 -4.5215 -4.5215 1.4022 1.4022 1.4288 1.4288 2.6354 2.6354 2.7131 2.7131 3.3873 3.3873 3.5106 3.5106 4.8618 4.8618 4.9533 4.9533 5.3753 5.3753 5.4321 5.4321 8.8527 8.8527 8.8571 8.8571 9.5555 9.5555 9.6166 9.6166 k = 0.6530-0.3601-0.0292 ( 5292 PWs) bands (ev): -21.1618 -21.1618 -21.1618 -21.1618 -8.4114 -8.4114 -8.3191 -8.3191 -7.6680 -7.6680 -7.5141 -7.5141 -5.8970 -5.8970 -5.8777 -5.8777 -5.7400 -5.7400 -5.7185 -5.7185 -4.5622 -4.5622 -4.5223 -4.5223 1.4306 1.4306 1.4576 1.4576 2.6331 2.6331 2.7074 2.7074 3.3858 3.3858 3.5073 3.5073 4.8617 4.8617 4.9537 4.9537 5.3782 5.3782 5.4346 5.4346 8.8908 8.8908 8.8939 8.8939 9.5357 9.5357 9.5912 9.5912 k = 0.6606-0.3856-0.0292 ( 5294 PWs) bands (ev): -21.1615 -21.1615 -21.1615 -21.1615 -8.4094 -8.4094 -8.3153 -8.3153 -7.6683 -7.6683 -7.5128 -7.5128 -5.8979 -5.8979 -5.8787 -5.8787 -5.7513 -5.7513 -5.7341 -5.7341 -4.5681 -4.5681 -4.5230 -4.5230 1.4602 1.4602 1.4876 1.4876 2.6325 2.6325 2.7031 2.7031 3.3834 3.3834 3.5025 3.5025 4.8623 4.8623 4.9547 4.9547 5.3799 5.3799 5.4357 5.4357 8.9266 8.9266 8.9275 8.9275 9.5137 9.5137 9.5626 9.5626 k = 0.6683-0.4111-0.0292 ( 5298 PWs) bands (ev): -21.1612 -21.1612 -21.1612 -21.1612 -8.4071 -8.4071 -8.3118 -8.3118 -7.6681 -7.6681 -7.5118 -7.5118 -5.8982 -5.8982 -5.8794 -5.8794 -5.7629 -5.7629 -5.7503 -5.7503 -4.5743 -4.5743 -4.5239 -4.5239 1.4910 1.4910 1.5187 1.5187 2.6335 2.6335 2.7002 2.7002 3.3800 3.3800 3.4964 3.4964 4.8637 4.8637 4.9560 4.9560 5.3805 5.3805 5.4354 5.4354 8.9557 8.9557 8.9577 8.9577 9.4936 9.4936 9.5354 9.5354 k = 0.6759-0.4366-0.0292 ( 5298 PWs) bands (ev): -21.1610 -21.1610 -21.1610 -21.1610 -8.4047 -8.4047 -8.3084 -8.3084 -7.6674 -7.6674 -7.5110 -7.5110 -5.8980 -5.8980 -5.8798 -5.8798 -5.7746 -5.7746 -5.7669 -5.7669 -4.5808 -4.5808 -4.5248 -4.5248 1.5231 1.5231 1.5510 1.5510 2.6363 2.6363 2.6988 2.6988 3.3759 3.3759 3.4892 3.4892 4.8659 4.8659 4.9577 4.9577 5.3800 5.3800 5.4337 5.4337 8.9751 8.9751 8.9812 8.9812 9.4798 9.4798 9.5138 9.5138 k = 0.6836-0.4621-0.0292 ( 5302 PWs) bands (ev): -21.1607 -21.1607 -21.1607 -21.1607 -8.4020 -8.4020 -8.3053 -8.3053 -7.6662 -7.6662 -7.5106 -7.5106 -5.8973 -5.8973 -5.8802 -5.8802 -5.7865 -5.7865 -5.7836 -5.7836 -4.5876 -4.5876 -4.5259 -4.5259 1.5563 1.5563 1.5845 1.5845 2.6409 2.6409 2.6990 2.6990 3.3711 3.3711 3.4809 3.4809 4.8686 4.8686 4.9597 4.9597 5.3784 5.3784 5.4307 5.4307 8.9821 8.9821 8.9932 8.9932 9.4765 9.4765 9.5021 9.5021 k = 0.6912-0.4876-0.0292 ( 5304 PWs) bands (ev): -21.1605 -21.1605 -21.1605 -21.1605 -8.3992 -8.3992 -8.3024 -8.3024 -7.6645 -7.6645 -7.5104 -7.5104 -5.8962 -5.8962 -5.8811 -5.8811 -5.7998 -5.7998 -5.7981 -5.7981 -4.5947 -4.5947 -4.5273 -4.5273 1.5907 1.5907 1.6190 1.6190 2.6471 2.6471 2.7006 2.7006 3.3658 3.3658 3.4717 3.4717 4.8719 4.8719 4.9618 4.9618 5.3758 5.3758 5.4264 5.4264 8.9745 8.9745 8.9908 8.9908 9.4862 9.4862 9.5035 9.5035 k = 0.6989-0.5131-0.0292 ( 5314 PWs) bands (ev): -21.1602 -21.1602 -21.1602 -21.1602 -8.3962 -8.3962 -8.2997 -8.2997 -7.6623 -7.6623 -7.5106 -7.5106 -5.8948 -5.8948 -5.8834 -5.8834 -5.8144 -5.8144 -5.8094 -5.8094 -4.6021 -4.6021 -4.5289 -4.5289 1.6261 1.6261 1.6545 1.6545 2.6550 2.6550 2.7037 2.7037 3.3600 3.3600 3.4618 3.4618 4.8756 4.8756 4.9640 4.9640 5.3723 5.3723 5.4208 5.4208 8.9524 8.9524 8.9728 8.9728 9.5087 9.5087 9.5188 9.5188 k = 0.7065-0.5386-0.0292 ( 5308 PWs) bands (ev): -21.1600 -21.1600 -21.1600 -21.1600 -8.3929 -8.3929 -8.2972 -8.2972 -7.6597 -7.6597 -7.5110 -7.5110 -5.8935 -5.8935 -5.8888 -5.8888 -5.8256 -5.8256 -5.8200 -5.8200 -4.6098 -4.6098 -4.5309 -4.5309 1.6626 1.6626 1.6911 1.6911 2.6644 2.6644 2.7083 2.7083 3.3539 3.3539 3.4513 3.4513 4.8797 4.8797 4.9662 4.9662 5.3680 5.3680 5.4141 5.4141 8.9178 8.9178 8.9410 8.9410 9.5418 9.5418 9.5463 9.5463 k = 0.7141-0.5642-0.0292 ( 5310 PWs) bands (ev): -21.1599 -21.1599 -21.1598 -21.1598 -8.3895 -8.3895 -8.2949 -8.2949 -7.6568 -7.6568 -7.5119 -7.5119 -5.8985 -5.8985 -5.8926 -5.8926 -5.8320 -5.8320 -5.8293 -5.8293 -4.6178 -4.6178 -4.5333 -4.5333 1.7002 1.7002 1.7286 1.7286 2.6755 2.6755 2.7143 2.7143 3.3476 3.3476 3.4404 3.4404 4.8841 4.8841 4.9683 4.9683 5.3631 5.3631 5.4064 5.4064 8.8736 8.8736 8.8981 8.8981 9.5822 9.5822 9.5827 9.5827 k = 0.7218-0.5897-0.0292 ( 5306 PWs) bands (ev): -21.1597 -21.1597 -21.1597 -21.1597 -8.3859 -8.3859 -8.2927 -8.2927 -7.6535 -7.6535 -7.5131 -7.5131 -5.9124 -5.9124 -5.8930 -5.8930 -5.8366 -5.8366 -5.8338 -5.8338 -4.6261 -4.6261 -4.5360 -4.5360 1.7387 1.7387 1.7671 1.7671 2.6879 2.6879 2.7217 2.7217 3.3413 3.3413 3.4292 3.4292 4.8887 4.8887 4.9702 4.9702 5.3576 5.3576 5.3978 5.3978 8.8222 8.8222 8.8469 8.8469 9.6248 9.6248 9.6272 9.6272 k = 0.7294-0.6152-0.0292 ( 5302 PWs) bands (ev): -21.1595 -21.1595 -21.1595 -21.1595 -8.3820 -8.3820 -8.2907 -8.2907 -7.6498 -7.6498 -7.5147 -7.5147 -5.9291 -5.9291 -5.8953 -5.8953 -5.8411 -5.8411 -5.8321 -5.8321 -4.6347 -4.6347 -4.5392 -4.5392 1.7781 1.7781 1.8065 1.8065 2.7018 2.7018 2.7304 2.7304 3.3350 3.3350 3.4179 3.4179 4.8933 4.8933 4.9717 4.9717 5.3518 5.3518 5.3885 5.3885 8.7656 8.7656 8.7897 8.7897 9.6699 9.6699 9.6744 9.6744 k = 0.7371-0.6407-0.0292 ( 5306 PWs) bands (ev): -21.1594 -21.1594 -21.1594 -21.1594 -8.3780 -8.3780 -8.2888 -8.2888 -7.6460 -7.6460 -7.5166 -7.5166 -5.9473 -5.9473 -5.9001 -5.9001 -5.8422 -5.8422 -5.8282 -5.8282 -4.6436 -4.6436 -4.5429 -4.5429 1.8183 1.8183 1.8467 1.8467 2.7169 2.7169 2.7403 2.7403 3.3288 3.3288 3.4066 3.4066 4.8980 4.8980 4.9730 4.9730 5.3459 5.3459 5.3786 5.3786 8.7050 8.7050 8.7281 8.7281 9.7158 9.7158 9.7218 9.7218 k = 0.7447-0.6662-0.0292 ( 5300 PWs) bands (ev): -21.1593 -21.1593 -21.1593 -21.1593 -8.3738 -8.3738 -8.2870 -8.2870 -7.6419 -7.6419 -7.5189 -7.5189 -5.9662 -5.9662 -5.9069 -5.9069 -5.8404 -5.8404 -5.8228 -5.8228 -4.6528 -4.6528 -4.5470 -4.5470 1.8594 1.8594 1.8878 1.8878 2.7331 2.7331 2.7514 2.7514 3.3230 3.3230 3.3955 3.3955 4.9025 4.9025 4.9737 4.9737 5.3399 5.3399 5.3684 5.3684 8.6415 8.6415 8.6632 8.6632 9.7608 9.7608 9.7681 9.7681 k = 0.7524-0.6917-0.0292 ( 5302 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3694 -8.3694 -8.2853 -8.2853 -7.6376 -7.6376 -7.5216 -7.5216 -5.9854 -5.9854 -5.9149 -5.9149 -5.8365 -5.8365 -5.8163 -5.8163 -4.6621 -4.6621 -4.5517 -4.5517 1.9012 1.9012 1.9296 1.9296 2.7504 2.7504 2.7635 2.7635 3.3175 3.3175 3.3846 3.3846 4.9069 4.9069 4.9739 4.9739 5.3341 5.3341 5.3578 5.3578 8.5758 8.5758 8.5958 8.5958 9.8036 9.8036 9.8118 9.8118 k = 0.7600-0.7172-0.0292 ( 5310 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3649 -8.3649 -8.2837 -8.2837 -7.6332 -7.6332 -7.5246 -7.5246 -6.0045 -6.0045 -5.9234 -5.9234 -5.8312 -5.8312 -5.8088 -5.8088 -4.6717 -4.6717 -4.5568 -4.5568 1.9437 1.9437 1.9721 1.9721 2.7685 2.7685 2.7765 2.7765 3.3125 3.3125 3.3742 3.3742 4.9111 4.9111 4.9735 4.9735 5.3285 5.3285 5.3473 5.3473 8.5084 8.5084 8.5267 8.5267 9.8427 9.8427 9.8519 9.8519 k = 0.7677-0.7427-0.0292 ( 5302 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3602 -8.3602 -8.2823 -8.2823 -7.6287 -7.6287 -7.5279 -7.5279 -6.0234 -6.0234 -5.9321 -5.9321 -5.8248 -5.8248 -5.8007 -5.8007 -4.6814 -4.6814 -4.5625 -4.5625 1.9868 1.9868 2.0153 2.0153 2.7874 2.7874 2.7903 2.7903 3.3082 3.3082 3.3644 3.3644 4.9149 4.9149 4.9725 4.9725 5.3234 5.3234 5.3368 5.3368 8.4398 8.4398 8.4562 8.4562 9.8767 9.8767 9.8869 9.8869 k = 0.7753-0.7682-0.0292 ( 5306 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3555 -8.3555 -8.2809 -8.2809 -7.6242 -7.6242 -7.5314 -7.5314 -6.0418 -6.0418 -5.9406 -5.9406 -5.8177 -5.8177 -5.7919 -5.7919 -4.6911 -4.6911 -4.5686 -4.5686 2.0305 2.0305 2.0590 2.0590 2.8047 2.8047 2.8068 2.8068 3.3045 3.3045 3.3552 3.3552 4.9183 4.9183 4.9710 4.9710 5.3187 5.3187 5.3266 5.3266 8.3703 8.3703 8.3848 8.3848 9.9038 9.9038 9.9152 9.9152 k = 0.7830-0.7937-0.0292 ( 5304 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3506 -8.3506 -8.2796 -8.2796 -7.6195 -7.6195 -7.5352 -7.5352 -6.0597 -6.0597 -5.9489 -5.9489 -5.8101 -5.8101 -5.7826 -5.7826 -4.7009 -4.7009 -4.5752 -4.5752 2.0747 2.0747 2.1032 2.1032 2.8195 2.8195 2.8265 2.8265 3.3016 3.3016 3.3468 3.3468 4.9214 4.9214 4.9688 4.9688 5.3145 5.3145 5.3166 5.3166 8.3003 8.3003 8.3127 8.3127 9.9218 9.9218 9.9350 9.9350 k = 0.7906-0.8192-0.0292 ( 5304 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3456 -8.3456 -8.2784 -8.2784 -7.6149 -7.6149 -7.5391 -7.5391 -6.0770 -6.0770 -5.9569 -5.9569 -5.8022 -5.8022 -5.7728 -5.7728 -4.7107 -4.7107 -4.5823 -4.5823 2.1192 2.1192 2.1478 2.1478 2.8347 2.8347 2.8466 2.8466 3.2995 3.2995 3.3392 3.3392 4.9241 4.9241 4.9663 4.9663 5.3071 5.3071 5.3107 5.3107 8.2300 8.2300 8.2404 8.2404 9.9276 9.9276 9.9435 9.9435 k = 0.2094-0.6982 0.8751 ( 5304 PWs) bands (ev): -21.1592 -21.1592 -21.1592 -21.1592 -8.3456 -8.3456 -8.2784 -8.2784 -7.6149 -7.6149 -7.5391 -7.5391 -6.0770 -6.0770 -5.9569 -5.9569 -5.8022 -5.8022 -5.7728 -5.7728 -4.7107 -4.7107 -4.5823 -4.5823 2.1192 2.1192 2.1478 2.1478 2.8347 2.8347 2.8466 2.8466 3.2995 3.2995 3.3392 3.3392 4.9241 4.9241 4.9663 4.9663 5.3071 5.3071 5.3107 5.3107 8.2300 8.2300 8.2404 8.2404 9.9276 9.9276 9.9435 9.9435 k = 0.2016-0.6723 0.8751 ( 5310 PWs) bands (ev): -21.1593 -21.1593 -21.1593 -21.1593 -8.3406 -8.3406 -8.2773 -8.2773 -7.6102 -7.6102 -7.5432 -7.5432 -6.0938 -6.0938 -5.9645 -5.9645 -5.7940 -5.7940 -5.7626 -5.7626 -4.7205 -4.7205 -4.5899 -4.5899 2.1647 2.1647 2.1933 2.1933 2.8503 2.8503 2.8669 2.8669 3.2984 3.2984 3.3324 3.3324 4.9264 4.9264 4.9633 4.9633 5.2978 5.2978 5.3073 5.3073 8.1587 8.1587 8.1671 8.1671 9.9182 9.9182 9.9381 9.9381 k = 0.1939-0.6465 0.8751 ( 5312 PWs) bands (ev): -21.1594 -21.1594 -21.1594 -21.1594 -8.3355 -8.3355 -8.2762 -8.2762 -7.6055 -7.6055 -7.5474 -7.5474 -6.1097 -6.1097 -5.9716 -5.9716 -5.7857 -5.7857 -5.7522 -5.7522 -4.7301 -4.7301 -4.5980 -4.5980 2.2104 2.2104 2.2389 2.2389 2.8659 2.8659 2.8872 2.8872 3.2982 3.2982 3.3266 3.3266 4.9285 4.9285 4.9602 4.9602 5.2889 5.2889 5.3041 5.3041 8.0877 8.0877 8.0941 8.0941 9.8922 9.8922 9.9170 9.9170 k = 0.1861-0.6206 0.8751 ( 5310 PWs) bands (ev): -21.1595 -21.1595 -21.1595 -21.1595 -8.3305 -8.3305 -8.2753 -8.2753 -7.6009 -7.6009 -7.5516 -7.5516 -6.1247 -6.1247 -5.9784 -5.9784 -5.7773 -5.7773 -5.7416 -5.7416 -4.7395 -4.7395 -4.6064 -4.6064 2.2562 2.2562 2.2847 2.2847 2.8813 2.8813 2.9071 2.9071 3.2991 3.2991 3.3220 3.3220 4.9303 4.9303 4.9570 4.9570 5.2804 5.2804 5.3011 5.3011 8.0172 8.0172 8.0215 8.0215 9.8527 9.8527 9.8821 9.8821 k = 0.1784-0.5947 0.8751 ( 5302 PWs) bands (ev): -21.1597 -21.1597 -21.1596 -21.1596 -8.3255 -8.3255 -8.2745 -8.2745 -7.5964 -7.5964 -7.5557 -7.5557 -6.1387 -6.1387 -5.9846 -5.9846 -5.7691 -5.7691 -5.7310 -5.7310 -4.7486 -4.7486 -4.6151 -4.6151 2.3020 2.3020 2.3304 2.3304 2.8963 2.8963 2.9266 2.9266 3.3010 3.3010 3.3184 3.3184 4.9321 4.9321 4.9539 4.9539 5.2722 5.2722 5.2980 5.2980 7.9474 7.9474 7.9498 7.9498 9.8045 9.8045 9.8377 9.8377 k = 0.1706-0.5689 0.8751 ( 5306 PWs) bands (ev): -21.1598 -21.1598 -21.1598 -21.1598 -8.3207 -8.3207 -8.2737 -8.2737 -7.5919 -7.5919 -7.5597 -7.5597 -6.1517 -6.1517 -5.9905 -5.9905 -5.7611 -5.7611 -5.7204 -5.7204 -4.7572 -4.7572 -4.6241 -4.6241 2.3478 2.3478 2.3758 2.3758 2.9109 2.9109 2.9455 2.9455 3.3041 3.3041 3.3161 3.3161 4.9339 4.9339 4.9511 4.9511 5.2641 5.2641 5.2949 5.2949 7.8786 7.8786 7.8791 7.8791 9.7526 9.7526 9.7886 9.7886 k = 0.1628-0.5430 0.8751 ( 5306 PWs) bands (ev): -21.1600 -21.1600 -21.1600 -21.1600 -8.3159 -8.3159 -8.2731 -8.2731 -7.5875 -7.5875 -7.5635 -7.5635 -6.1635 -6.1635 -5.9960 -5.9960 -5.7534 -5.7534 -5.7100 -5.7100 -4.7654 -4.7654 -4.6332 -4.6332 2.3934 2.3934 2.4209 2.4209 2.9248 2.9248 2.9635 2.9635 3.3082 3.3082 3.3150 3.3150 4.9357 4.9357 4.9487 4.9487 5.2561 5.2561 5.2914 5.2914 7.8096 7.8096 7.8109 7.8109 9.7001 9.7001 9.7384 9.7384 k = 0.1551-0.5172 0.8751 ( 5308 PWs) bands (ev): -21.1601 -21.1601 -21.1601 -21.1601 -8.3114 -8.3114 -8.2726 -8.2726 -7.5833 -7.5833 -7.5671 -7.5671 -6.1741 -6.1741 -6.0012 -6.0012 -5.7460 -5.7460 -5.6998 -5.6998 -4.7730 -4.7730 -4.6426 -4.6426 2.4386 2.4386 2.4655 2.4655 2.9379 2.9379 2.9806 2.9806 3.3134 3.3134 3.3152 3.3152 4.9377 4.9377 4.9466 4.9466 5.2482 5.2482 5.2876 5.2876 7.7417 7.7417 7.7447 7.7447 9.6492 9.6492 9.6894 9.6894 k = 0.1473-0.4913 0.8751 ( 5314 PWs) bands (ev): -21.1603 -21.1603 -21.1603 -21.1603 -8.3070 -8.3070 -8.2722 -8.2722 -7.5793 -7.5793 -7.5704 -7.5704 -6.1836 -6.1836 -6.0062 -6.0062 -5.7390 -5.7390 -5.6900 -5.6900 -4.7801 -4.7801 -4.6520 -4.6520 2.4834 2.4834 2.5094 2.5094 2.9501 2.9501 2.9967 2.9967 3.3166 3.3166 3.3197 3.3197 4.9399 4.9399 4.9449 4.9449 5.2403 5.2403 5.2834 5.2834 7.6754 7.6754 7.6799 7.6799 9.6014 9.6014 9.6432 9.6432 k = 0.1396-0.4654 0.8751 ( 5314 PWs) bands (ev): -21.1605 -21.1605 -21.1605 -21.1605 -8.3029 -8.3029 -8.2719 -8.2719 -7.5754 -7.5754 -7.5732 -7.5732 -6.1918 -6.1918 -6.0110 -6.0110 -5.7324 -5.7324 -5.6807 -5.6807 -4.7864 -4.7864 -4.6615 -4.6615 2.5277 2.5277 2.5525 2.5525 2.9613 2.9613 3.0116 3.0116 3.3194 3.3194 3.3269 3.3269 4.9421 4.9421 4.9434 4.9434 5.2325 5.2325 5.2789 5.2789 7.6111 7.6111 7.6170 7.6170 9.5576 9.5576 9.6009 9.6009 k = 0.1318-0.4396 0.8751 ( 5314 PWs) bands (ev): -21.1607 -21.1607 -21.1607 -21.1607 -8.2991 -8.2991 -8.2717 -8.2717 -7.5757 -7.5757 -7.5718 -7.5718 -6.1987 -6.1987 -6.0156 -6.0156 -5.7262 -5.7262 -5.6720 -5.6720 -4.7921 -4.7921 -4.6709 -4.6709 2.5713 2.5713 2.5945 2.5945 2.9715 2.9715 3.0253 3.0253 3.3234 3.3234 3.3351 3.3351 4.9421 4.9421 4.9440 4.9440 5.2250 5.2250 5.2743 5.2743 7.5488 7.5488 7.5560 7.5560 9.5183 9.5183 9.5631 9.5631 k = 0.1241-0.4137 0.8751 ( 5312 PWs) bands (ev): -21.1609 -21.1609 -21.1609 -21.1609 -8.2956 -8.2956 -8.2716 -8.2716 -7.5778 -7.5778 -7.5683 -7.5683 -6.2043 -6.2043 -6.0202 -6.0202 -5.7205 -5.7205 -5.6639 -5.6639 -4.7970 -4.7970 -4.6802 -4.6802 2.6140 2.6140 2.6353 2.6353 2.9807 2.9807 3.0377 3.0377 3.3285 3.3285 3.3440 3.3440 4.9406 4.9406 4.9456 4.9456 5.2181 5.2181 5.2697 5.2697 7.4888 7.4888 7.4971 7.4971 9.4842 9.4842 9.5302 9.5302 k = 0.1163-0.3879 0.8751 ( 5304 PWs) bands (ev): -21.1611 -21.1611 -21.1611 -21.1611 -8.2923 -8.2923 -8.2716 -8.2716 -7.5794 -7.5794 -7.5652 -7.5652 -6.2086 -6.2086 -6.0249 -6.0249 -5.7152 -5.7152 -5.6565 -5.6565 -4.8011 -4.8011 -4.6893 -4.6893 2.6557 2.6557 2.6745 2.6745 2.9889 2.9889 3.0490 3.0490 3.3348 3.3348 3.3536 3.3536 4.9386 4.9386 4.9462 4.9462 5.2123 5.2123 5.2655 5.2655 7.4313 7.4313 7.4405 7.4405 9.4554 9.4554 9.5027 9.5027 k = 0.1086-0.3620 0.8751 ( 5300 PWs) bands (ev): -21.1613 -21.1613 -21.1613 -21.1613 -8.2894 -8.2894 -8.2716 -8.2716 -7.5805 -7.5805 -7.5623 -7.5623 -6.2116 -6.2116 -6.0298 -6.0298 -5.7103 -5.7103 -5.6500 -5.6500 -4.8044 -4.8044 -4.6983 -4.6983 2.6962 2.6962 2.7121 2.7121 2.9963 2.9963 3.0593 3.0593 3.3419 3.3419 3.3636 3.3636 4.9358 4.9358 4.9454 4.9454 5.2080 5.2080 5.2620 5.2620 7.3763 7.3763 7.3863 7.3863 9.4322 9.4322 9.4806 9.4806 k = 0.1008-0.3362 0.8751 ( 5304 PWs) bands (ev): -21.1616 -21.1616 -21.1615 -21.1615 -8.2868 -8.2868 -8.2718 -8.2718 -7.5812 -7.5812 -7.5598 -7.5598 -6.2133 -6.2133 -6.0348 -6.0348 -5.7057 -5.7057 -5.6443 -5.6443 -4.8070 -4.8070 -4.7070 -4.7070 2.7353 2.7353 2.7476 2.7476 3.0030 3.0030 3.0689 3.0689 3.3497 3.3497 3.3737 3.3737 4.9319 4.9319 4.9429 4.9429 5.2056 5.2056 5.2596 5.2596 7.3240 7.3240 7.3346 7.3346 9.4147 9.4147 9.4641 9.4641 k = 0.0931-0.3103 0.8751 ( 5302 PWs) bands (ev): -21.1618 -21.1618 -21.1617 -21.1617 -8.2845 -8.2845 -8.2720 -8.2720 -7.5814 -7.5814 -7.5576 -7.5576 -6.2137 -6.2137 -6.0402 -6.0402 -5.7013 -5.7013 -5.6395 -5.6395 -4.8088 -4.8088 -4.7154 -4.7154 2.7726 2.7726 2.7808 2.7808 3.0094 3.0094 3.0780 3.0780 3.3579 3.3579 3.3838 3.3838 4.9265 4.9265 4.9383 4.9383 5.2056 5.2056 5.2585 5.2585 7.2746 7.2746 7.2856 7.2856 9.4029 9.4029 9.4532 9.4532 k = 0.0853-0.2844 0.8751 ( 5298 PWs) bands (ev): -21.1619 -21.1619 -21.1619 -21.1619 -8.2825 -8.2825 -8.2722 -8.2722 -7.5811 -7.5811 -7.5558 -7.5558 -6.2129 -6.2129 -6.0460 -6.0460 -5.6972 -5.6972 -5.6357 -5.6357 -4.8100 -4.8100 -4.7234 -4.7234 2.8076 2.8076 2.8113 2.8113 3.0159 3.0159 3.0869 3.0869 3.3662 3.3662 3.3935 3.3935 4.9197 4.9197 4.9314 4.9314 5.2080 5.2080 5.2590 5.2590 7.2281 7.2281 7.2393 7.2393 9.3968 9.3968 9.4476 9.4476 k = 0.0775-0.2586 0.8751 ( 5294 PWs) bands (ev): -21.1621 -21.1621 -21.1621 -21.1621 -8.2808 -8.2808 -8.2724 -8.2724 -7.5804 -7.5804 -7.5543 -7.5543 -6.2108 -6.2108 -6.0522 -6.0522 -5.6931 -5.6931 -5.6329 -5.6329 -4.8104 -4.8104 -4.7311 -4.7311 2.8388 2.8388 2.8398 2.8398 3.0230 3.0230 3.0961 3.0961 3.3743 3.3743 3.4026 3.4026 4.9113 4.9113 4.9225 4.9225 5.2130 5.2130 5.2610 5.2610 7.1849 7.1849 7.1960 7.1960 9.3961 9.3961 9.4471 9.4471 k = 0.0698-0.2327 0.8751 ( 5294 PWs) bands (ev): -21.1623 -21.1623 -21.1623 -21.1623 -8.2794 -8.2794 -8.2727 -8.2727 -7.5793 -7.5793 -7.5532 -7.5532 -6.2075 -6.2075 -6.0590 -6.0590 -5.6890 -5.6890 -5.6310 -5.6310 -4.8102 -4.8102 -4.7384 -4.7384 2.8629 2.8629 2.8684 2.8684 3.0316 3.0316 3.1058 3.1058 3.3819 3.3819 3.4107 3.4107 4.9017 4.9017 4.9119 4.9119 5.2200 5.2200 5.2644 5.2644 7.1449 7.1449 7.1558 7.1558 9.4004 9.4004 9.4510 9.4510 k = 0.0620-0.2069 0.8751 ( 5298 PWs) bands (ev): -21.1625 -21.1625 -21.1625 -21.1625 -8.2782 -8.2782 -8.2730 -8.2730 -7.5778 -7.5778 -7.5526 -7.5526 -6.2032 -6.2032 -6.0662 -6.0662 -5.6850 -5.6850 -5.6301 -5.6301 -4.8094 -4.8094 -4.7454 -4.7454 2.8835 2.8835 2.8925 2.8925 3.0424 3.0424 3.1161 3.1161 3.3889 3.3889 3.4176 3.4176 4.8912 4.8912 4.9002 4.9002 5.2287 5.2287 5.2690 5.2690 7.1084 7.1084 7.1189 7.1189 9.4092 9.4092 9.4586 9.4586 k = 0.0543-0.1810 0.8751 ( 5298 PWs) bands (ev): -21.1626 -21.1626 -21.1626 -21.1626 -8.2773 -8.2773 -8.2732 -8.2732 -7.5761 -7.5761 -7.5523 -7.5523 -6.1978 -6.1978 -6.0740 -6.0740 -5.6808 -5.6808 -5.6301 -5.6301 -4.8081 -4.8081 -4.7519 -4.7519 2.9005 2.9005 2.9116 2.9116 3.0559 3.0559 3.1269 3.1269 3.3950 3.3950 3.4232 3.4232 4.8803 4.8803 4.8879 4.8879 5.2384 5.2384 5.2742 5.2742 7.0756 7.0756 7.0855 7.0855 9.4218 9.4218 9.4681 9.4681 k = 0.0465-0.1551 0.8751 ( 5296 PWs) bands (ev): -21.1627 -21.1627 -21.1627 -21.1627 -8.2766 -8.2766 -8.2735 -8.2735 -7.5741 -7.5741 -7.5525 -7.5525 -6.1914 -6.1914 -6.0823 -6.0823 -5.6765 -5.6765 -5.6309 -5.6309 -4.8063 -4.8063 -4.7580 -4.7580 2.9141 2.9141 2.9256 2.9256 3.0720 3.0720 3.1378 3.1378 3.4003 3.4003 3.4272 3.4272 4.8695 4.8695 4.8758 4.8758 5.2487 5.2487 5.2797 5.2797 7.0467 7.0467 7.0557 7.0557 9.4367 9.4367 9.4775 9.4775 k = 0.0388-0.1293 0.8751 ( 5300 PWs) bands (ev): -21.1629 -21.1629 -21.1629 -21.1629 -8.2760 -8.2760 -8.2737 -8.2737 -7.5719 -7.5719 -7.5530 -7.5530 -6.1842 -6.1842 -6.0911 -6.0911 -5.6721 -5.6721 -5.6325 -5.6325 -4.8041 -4.8041 -4.7638 -4.7638 2.9247 2.9247 2.9352 2.9352 3.0898 3.0898 3.1481 3.1481 3.4049 3.4049 3.4296 3.4296 4.8593 4.8593 4.8644 4.8644 5.2588 5.2588 5.2850 5.2850 7.0219 7.0219 7.0298 7.0298 9.4518 9.4518 9.4838 9.4838 k = 0.0310-0.1034 0.8751 ( 5304 PWs) bands (ev): -21.1630 -21.1630 -21.1630 -21.1630 -8.2755 -8.2755 -8.2739 -8.2739 -7.5696 -7.5696 -7.5539 -7.5539 -6.1762 -6.1762 -6.1003 -6.1003 -5.6676 -5.6676 -5.6349 -5.6349 -4.8015 -4.8015 -4.7692 -4.7692 2.9326 2.9326 2.9414 2.9414 3.1080 3.1080 3.1569 3.1569 3.4087 3.4087 3.4304 3.4304 4.8503 4.8503 4.8543 4.8543 5.2684 5.2684 5.2896 5.2896 7.0014 7.0014 7.0080 7.0080 9.4645 9.4645 9.4859 9.4859 k = 0.0233-0.0776 0.8751 ( 5288 PWs) bands (ev): -21.1630 -21.1630 -21.1630 -21.1630 -8.2752 -8.2752 -8.2741 -8.2741 -7.5673 -7.5673 -7.5551 -7.5551 -6.1677 -6.1677 -6.1098 -6.1098 -5.6630 -5.6630 -5.6378 -5.6378 -4.7985 -4.7985 -4.7743 -4.7743 2.9385 2.9385 2.9451 2.9451 3.1252 3.1252 3.1634 3.1634 3.4123 3.4123 3.4298 3.4298 4.8429 4.8429 4.8458 4.8458 5.2770 5.2770 5.2930 5.2930 6.9855 6.9855 6.9906 6.9906 9.4724 9.4724 9.4848 9.4848 k = 0.0155-0.0517 0.8751 ( 5292 PWs) bands (ev): -21.1631 -21.1631 -21.1631 -21.1631 -8.2750 -8.2750 -8.2743 -8.2743 -7.5649 -7.5649 -7.5566 -7.5566 -6.1586 -6.1586 -6.1196 -6.1196 -5.6584 -5.6584 -5.6413 -5.6413 -4.7952 -4.7952 -4.7791 -4.7791 2.9426 2.9426 2.9470 2.9470 3.1404 3.1404 3.1666 3.1666 3.4156 3.4156 3.4280 3.4280 4.8375 4.8375 4.8394 4.8394 5.2842 5.2842 5.2949 5.2949 6.9743 6.9743 6.9778 6.9778 9.4761 9.4761 9.4823 9.4823 k = 0.0078-0.0259 0.8751 ( 5302 PWs) bands (ev): -21.1631 -21.1631 -21.1631 -21.1631 -8.2748 -8.2748 -8.2744 -8.2744 -7.5626 -7.5626 -7.5584 -7.5584 -6.1491 -6.1491 -6.1295 -6.1295 -5.6539 -5.6539 -5.6452 -5.6452 -4.7916 -4.7916 -4.7836 -4.7836 2.9454 2.9454 2.9476 2.9476 3.1527 3.1527 3.1660 3.1660 3.4189 3.4189 3.4254 3.4254 4.8343 4.8343 4.8353 4.8353 5.2897 5.2897 5.2951 5.2951 6.9678 6.9678 6.9696 6.9696 9.4775 9.4775 9.4800 9.4800 k = 0.0000 0.0000 0.8751 ( 5312 PWs) bands (ev): -21.1631 -21.1631 -21.1631 -21.1631 -8.2746 -8.2746 -8.2746 -8.2746 -7.5604 -7.5604 -7.5604 -7.5604 -6.1393 -6.1393 -6.1393 -6.1393 -5.6494 -5.6494 -5.6494 -5.6494 -4.7878 -4.7878 -4.7878 -4.7878 2.9470 2.9470 2.9470 2.9470 3.1613 3.1613 3.1613 3.1613 3.4223 3.4223 3.4223 3.4223 4.8336 4.8336 4.8336 4.8336 5.2934 5.2934 5.2934 5.2934 6.9663 6.9663 6.9663 6.9663 9.4785 9.4785 9.4785 9.4785 k = 0.0000 0.0000 0.8751 ( 5312 PWs) bands (ev): -21.1631 -21.1631 -21.1631 -21.1631 -8.2746 -8.2746 -8.2746 -8.2746 -7.5604 -7.5604 -7.5604 -7.5604 -6.1393 -6.1393 -6.1393 -6.1393 -5.6494 -5.6494 -5.6494 -5.6494 -4.7878 -4.7878 -4.7878 -4.7878 2.9470 2.9470 2.9470 2.9470 3.1613 3.1613 3.1613 3.1613 3.4223 3.4223 3.4223 3.4223 4.8336 4.8336 4.8336 4.8336 5.2934 5.2934 5.2934 5.2934 6.9663 6.9663 6.9663 6.9663 9.4785 9.4785 9.4785 9.4785 k = 0.0261 0.0078 0.8751 ( 5306 PWs) bands (ev): -21.1632 -21.1632 -21.1631 -21.1631 -8.2911 -8.2911 -8.2576 -8.2576 -7.5777 -7.5777 -7.5434 -7.5434 -6.1570 -6.1570 -6.1214 -6.1214 -5.6656 -5.6656 -5.6331 -5.6331 -4.8075 -4.8075 -4.7687 -4.7687 2.9404 2.9404 2.9542 2.9542 3.1503 3.1503 3.1737 3.1737 3.4189 3.4189 3.4259 3.4259 4.8210 4.8210 4.8441 4.8441 5.2813 5.2813 5.3028 5.3028 6.9534 6.9534 6.9791 6.9791 9.4740 9.4740 9.4848 9.4848 k = 0.0522 0.0157 0.8751 ( 5297 PWs) bands (ev): -21.1632 -21.1632 -21.1630 -21.1630 -8.3069 -8.3069 -8.2401 -8.2401 -7.5951 -7.5951 -7.5268 -7.5268 -6.1743 -6.1743 -6.1033 -6.1033 -5.6816 -5.6816 -5.6168 -5.6168 -4.8278 -4.8278 -4.7503 -4.7503 2.9343 2.9343 2.9618 2.9618 3.1406 3.1406 3.1871 3.1871 3.4156 3.4156 3.4298 3.4298 4.8066 4.8066 4.8526 4.8526 5.2666 5.2666 5.3095 5.3095 6.9405 6.9405 6.9917 6.9917 9.4685 9.4685 9.4947 9.4947 k = 0.0783 0.0235 0.8751 ( 5301 PWs) bands (ev): -21.1633 -21.1633 -21.1630 -21.1630 -8.3222 -8.3222 -8.2221 -8.2221 -7.6128 -7.6128 -7.5105 -7.5105 -6.1912 -6.1912 -6.0853 -6.0853 -5.6971 -5.6971 -5.6007 -5.6007 -4.8486 -4.8486 -4.7327 -4.7327 2.9287 2.9287 2.9698 2.9698 3.1322 3.1322 3.2014 3.2014 3.4124 3.4124 3.4341 3.4341 4.7905 4.7905 4.8590 4.8590 5.2493 5.2493 5.3136 5.3136 6.9278 6.9278 7.0038 7.0038 9.4589 9.4589 9.5094 9.5094 k = 0.1045 0.0313 0.8751 ( 5300 PWs) bands (ev): -21.1633 -21.1633 -21.1629 -21.1629 -8.3367 -8.3367 -8.2038 -8.2038 -7.6307 -7.6307 -7.4946 -7.4946 -6.2077 -6.2077 -6.0673 -6.0673 -5.7120 -5.7120 -5.5848 -5.5848 -4.8699 -4.8699 -4.7159 -4.7159 2.9238 2.9238 2.9782 2.9782 3.1252 3.1252 3.2162 3.2162 3.4093 3.4093 3.4391 3.4391 4.7730 4.7730 4.8633 4.8633 5.2297 5.2297 5.3154 5.3154 6.9155 6.9155 7.0154 7.0154 9.4436 9.4436 9.5289 9.5289 k = 0.1306 0.0392 0.8751 ( 5298 PWs) bands (ev): -21.1634 -21.1634 -21.1629 -21.1629 -8.3505 -8.3505 -8.1851 -8.1851 -7.6488 -7.6488 -7.4792 -7.4792 -6.2235 -6.2235 -6.0497 -6.0497 -5.7262 -5.7262 -5.5693 -5.5693 -4.8914 -4.8914 -4.6999 -4.6999 2.9194 2.9194 2.9870 2.9870 3.1194 3.1194 3.2313 3.2313 3.4062 3.4062 3.4448 3.4448 4.7541 4.7541 4.8657 4.8657 5.2080 5.2080 5.3149 5.3149 6.9036 6.9036 7.0264 7.0264 9.4235 9.4235 9.5526 9.5526 k = 0.1567 0.0470 0.8751 ( 5302 PWs) bands (ev): -21.1634 -21.1634 -21.1628 -21.1628 -8.3635 -8.3635 -8.1661 -8.1661 -7.6669 -7.6669 -7.4644 -7.4644 -6.2387 -6.2387 -6.0325 -6.0325 -5.7393 -5.7393 -5.5542 -5.5542 -4.9131 -4.9131 -4.6849 -4.6849 2.9157 2.9157 2.9962 2.9962 3.1148 3.1148 3.2462 3.2462 3.4031 3.4031 3.4515 3.4515 4.7344 4.7344 4.8662 4.8662 5.1845 5.1845 5.3125 5.3125 6.8923 6.8923 7.0366 7.0366 9.4006 9.4006 9.5773 9.5773 k = 0.1828 0.0548 0.8751 ( 5296 PWs) bands (ev): -21.1634 -21.1634 -21.1628 -21.1628 -8.3757 -8.3757 -8.1470 -8.1470 -7.6852 -7.6852 -7.4501 -7.4501 -6.2532 -6.2532 -6.0162 -6.0162 -5.7512 -5.7512 -5.5396 -5.5396 -4.9349 -4.9349 -4.6708 -4.6708 2.9127 2.9127 3.0055 3.0055 3.1112 3.1112 3.2604 3.2604 3.4001 3.4001 3.4594 3.4594 4.7140 4.7140 4.8651 4.8651 5.1597 5.1597 5.3084 5.3084 6.8818 6.8818 7.0461 7.0461 9.3764 9.3764 9.5952 9.5952 k = 0.2089 0.0627 0.8751 ( 5299 PWs) bands (ev): -21.1635 -21.1635 -21.1628 -21.1628 -8.3870 -8.3870 -8.1276 -8.1276 -7.7036 -7.7036 -7.4365 -7.4365 -6.2669 -6.2669 -6.0009 -6.0009 -5.7616 -5.7616 -5.5257 -5.5257 -4.9566 -4.9566 -4.6577 -4.6577 2.9103 2.9103 3.0149 3.0149 3.1084 3.1084 3.2735 3.2735 3.3972 3.3972 3.4687 3.4687 4.6933 4.6933 4.8625 4.8625 5.1340 5.1340 5.3030 5.3030 6.8720 6.8720 7.0547 7.0547 9.3521 9.3521 9.6001 9.6001 k = 0.2350 0.0705 0.8751 ( 5300 PWs) bands (ev): -21.1635 -21.1635 -21.1627 -21.1627 -8.3974 -8.3974 -8.1082 -8.1082 -7.7220 -7.7220 -7.4237 -7.4237 -6.2798 -6.2798 -5.9869 -5.9869 -5.7701 -5.7701 -5.5124 -5.5124 -4.9780 -4.9780 -4.6455 -4.6455 2.9087 2.9087 3.0243 3.0243 3.1063 3.1063 3.2851 3.2851 3.3946 3.3946 3.4793 3.4793 4.6727 4.6727 4.8586 4.8586 5.1079 5.1079 5.2965 5.2965 6.8631 6.8631 7.0626 7.0626 9.3285 9.3285 9.5971 9.5971 k = 0.2611 0.0783 0.8751 ( 5294 PWs) bands (ev): -21.1636 -21.1636 -21.1627 -21.1627 -8.4069 -8.4069 -8.0887 -8.0887 -7.7405 -7.7405 -7.4118 -7.4118 -6.2919 -6.2919 -5.9747 -5.9747 -5.7766 -5.7766 -5.4999 -5.4999 -4.9990 -4.9990 -4.6344 -4.6344 2.9078 2.9078 3.0336 3.0336 3.1046 3.1046 3.2950 3.2950 3.3922 3.3922 3.4912 3.4912 4.6525 4.6525 4.8536 4.8536 5.0820 5.0820 5.2893 5.2893 6.8550 6.8550 7.0696 7.0696 9.3061 9.3061 9.5919 9.5919 k = 0.2873 0.0861 0.8751 ( 5282 PWs) bands (ev): -21.1636 -21.1636 -21.1626 -21.1626 -8.4155 -8.4155 -8.0692 -8.0692 -7.7590 -7.7590 -7.4007 -7.4007 -6.3029 -6.3029 -5.9646 -5.9646 -5.7808 -5.7808 -5.4882 -5.4882 -5.0193 -5.0193 -4.6243 -4.6243 2.9076 2.9076 3.0424 3.0424 3.1032 3.1032 3.3030 3.3030 3.3902 3.3902 3.5040 3.5040 4.6332 4.6332 4.8479 4.8479 5.0569 5.0569 5.2818 5.2818 6.8479 6.8479 7.0758 7.0758 9.2853 9.2853 9.5867 9.5867 k = 0.3134 0.0940 0.8751 ( 5284 PWs) bands (ev): -21.1637 -21.1637 -21.1626 -21.1626 -8.4231 -8.4231 -8.0498 -8.0498 -7.7776 -7.7776 -7.3907 -7.3907 -6.3130 -6.3130 -5.9565 -5.9565 -5.7826 -5.7826 -5.4775 -5.4775 -5.0387 -5.0387 -4.6153 -4.6153 2.9081 2.9081 3.0507 3.0507 3.1019 3.1019 3.3092 3.3092 3.3886 3.3886 3.5172 3.5172 4.6150 4.6150 4.8416 4.8416 5.0332 5.0332 5.2742 5.2742 6.8417 6.8417 7.0812 7.0812 9.2662 9.2662 9.5821 9.5821 k = 0.3395 0.1018 0.8751 ( 5292 PWs) bands (ev): -21.1637 -21.1637 -21.1625 -21.1625 -8.4296 -8.4296 -8.0306 -8.0306 -7.7960 -7.7960 -7.3818 -7.3818 -6.3219 -6.3219 -5.9507 -5.9507 -5.7823 -5.7823 -5.4677 -5.4677 -5.0569 -5.0569 -4.6073 -4.6073 2.9092 2.9092 3.0582 3.0582 3.1005 3.1005 3.3138 3.3138 3.3876 3.3876 3.5303 3.5303 4.5983 4.5983 4.8351 4.8351 5.0116 5.0116 5.2668 5.2668 6.8364 6.8364 7.0859 7.0859 9.2492 9.2492 9.5783 9.5783 k = 0.3656 0.1096 0.8751 ( 5291 PWs) bands (ev): -21.1637 -21.1637 -21.1625 -21.1625 -8.4352 -8.4352 -8.0117 -8.0117 -7.8144 -7.8144 -7.3740 -7.3740 -6.3297 -6.3297 -5.9467 -5.9467 -5.7803 -5.7803 -5.4590 -5.4590 -5.0735 -5.0735 -4.6004 -4.6004 2.9109 2.9109 3.0646 3.0646 3.0988 3.0988 3.3170 3.3170 3.3873 3.3873 3.5426 3.5426 4.5835 4.5835 4.8286 4.8286 4.9926 4.9926 5.2599 5.2599 6.8322 6.8322 7.0899 7.0899 9.2344 9.2344 9.5756 9.5756 k = 0.3917 0.1175 0.8751 ( 5295 PWs) bands (ev): -21.1638 -21.1638 -21.1625 -21.1625 -8.4397 -8.4397 -7.9933 -7.9933 -7.8323 -7.8323 -7.3675 -7.3675 -6.3364 -6.3364 -5.9441 -5.9441 -5.7771 -5.7771 -5.4516 -5.4516 -5.0884 -5.0884 -4.5946 -4.5946 2.9132 2.9132 3.0697 3.0697 3.0968 3.0968 3.3191 3.3191 3.3875 3.3875 3.5534 3.5534 4.5708 4.5708 4.8226 4.8226 4.9767 4.9767 5.2538 5.2538 6.8289 6.8289 7.0933 7.0933 9.2219 9.2219 9.5738 9.5738 k = 0.4178 0.1253 0.8751 ( 5310 PWs) bands (ev): -21.1638 -21.1638 -21.1624 -21.1624 -8.4431 -8.4431 -7.9759 -7.9759 -7.8496 -7.8496 -7.3623 -7.3623 -6.3417 -6.3417 -5.9426 -5.9426 -5.7735 -5.7735 -5.4456 -5.4456 -5.1009 -5.1009 -4.5899 -4.5899 2.9161 2.9161 3.0733 3.0733 3.0943 3.0943 3.3204 3.3204 3.3883 3.3883 3.5621 3.5621 4.5606 4.5606 4.8174 4.8174 4.9641 4.9641 5.2487 5.2487 6.8266 6.8266 7.0962 7.0962 9.2117 9.2117 9.5729 9.5729 k = 0.4439 0.1331 0.8751 ( 5306 PWs) bands (ev): -21.1638 -21.1638 -21.1624 -21.1624 -8.4455 -8.4455 -7.9603 -7.9603 -7.8652 -7.8652 -7.3585 -7.3585 -6.3458 -6.3458 -5.9417 -5.9417 -5.7699 -5.7699 -5.4411 -5.4411 -5.1108 -5.1108 -4.5863 -4.5863 2.9194 2.9194 3.0753 3.0753 3.0913 3.0913 3.3213 3.3213 3.3895 3.3895 3.5682 3.5682 4.5531 4.5531 4.8134 4.8134 4.9553 4.9553 5.2446 5.2446 6.8252 6.8252 7.0984 7.0984 9.2041 9.2041 9.5728 9.5728 k = 0.4701 0.1410 0.8751 ( 5296 PWs) bands (ev): -21.1639 -21.1639 -21.1624 -21.1624 -8.4468 -8.4468 -7.9490 -7.9490 -7.8767 -7.8767 -7.3561 -7.3561 -6.3485 -6.3485 -5.9409 -5.9409 -5.7670 -5.7670 -5.4383 -5.4383 -5.1178 -5.1178 -4.5837 -4.5837 2.9231 2.9231 3.0754 3.0754 3.0877 3.0877 3.3218 3.3218 3.3913 3.3913 3.5713 3.5713 4.5484 4.5484 4.8110 4.8110 4.9501 4.9501 5.2418 5.2418 6.8248 6.8248 7.1002 7.1002 9.1989 9.1989 9.5734 9.5734 k = 0.4962 0.1488 0.8751 ( 5292 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4470 -8.4470 -7.9465 -7.9465 -7.8797 -7.8797 -7.3551 -7.3551 -6.3499 -6.3499 -5.9402 -5.9402 -5.7650 -5.7650 -5.4374 -5.4374 -5.1215 -5.1215 -4.5823 -4.5823 2.9271 2.9271 3.0737 3.0737 3.0836 3.0836 3.3220 3.3220 3.3933 3.3933 3.5714 3.5714 4.5467 4.5467 4.8102 4.8102 4.9488 4.9488 5.2404 5.2404 6.8254 6.8254 7.1015 7.1015 9.1963 9.1963 9.5746 9.5746 k = 0.5223 0.1566 0.8751 ( 5296 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4461 -8.4461 -7.9546 -7.9546 -7.8723 -7.8723 -7.3556 -7.3556 -6.3499 -6.3499 -5.9395 -5.9395 -5.7642 -5.7642 -5.4385 -5.4385 -5.1219 -5.1219 -4.5820 -4.5820 2.9315 2.9315 3.0700 3.0700 3.0790 3.0790 3.3219 3.3219 3.3957 3.3957 3.5683 3.5683 4.5479 4.5479 4.8113 4.8113 4.9513 4.9513 5.2403 5.2403 6.8270 6.8270 7.1022 7.1022 9.1962 9.1962 9.5764 9.5764 k = 0.5484 0.1645 0.8751 ( 5298 PWs) bands (ev): -21.1640 -21.1640 -21.1623 -21.1623 -8.4442 -8.4442 -7.9689 -7.9689 -7.8589 -7.8589 -7.3575 -7.3575 -6.3485 -6.3485 -5.9386 -5.9386 -5.7644 -5.7644 -5.4414 -5.4414 -5.1188 -5.1188 -4.5828 -4.5828 2.9361 2.9361 3.0645 3.0645 3.0743 3.0743 3.3215 3.3215 3.3983 3.3983 3.5622 3.5622 4.5522 4.5522 4.8140 4.8140 4.9576 4.9576 5.2415 5.2415 6.8296 6.8296 7.1025 7.1025 9.1988 9.1988 9.5787 9.5787 k = 0.5000 0.1499-0.9042 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4470 -8.4470 -7.9406 -7.9406 -7.8851 -7.8851 -7.3544 -7.3544 -6.3520 -6.3520 -5.9405 -5.9405 -5.7645 -5.7645 -5.4362 -5.4362 -5.1247 -5.1247 -4.5821 -4.5821 2.9494 2.9494 3.0649 3.0649 3.0863 3.0863 3.3199 3.3199 3.3940 3.3940 3.5701 3.5701 4.5471 4.5471 4.8111 4.8111 4.9501 4.9501 5.2432 5.2432 6.8131 6.8131 7.0898 7.0898 9.1985 9.1985 9.5789 9.5789 k = 0.5076 0.1245-0.9042 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4466 -8.4466 -7.9437 -7.9437 -7.8825 -7.8825 -7.3546 -7.3546 -6.3513 -6.3513 -5.9400 -5.9400 -5.7652 -5.7652 -5.4379 -5.4379 -5.1233 -5.1233 -4.5818 -4.5818 2.9435 2.9435 3.0637 3.0637 3.0902 3.0902 3.3172 3.3172 3.3943 3.3943 3.5680 3.5680 4.5494 4.5494 4.8130 4.8130 4.9521 4.9521 5.2420 5.2420 6.8172 6.8172 7.0912 7.0912 9.1928 9.1928 9.5857 9.5857 k = 0.5152 0.0991-0.9042 ( 5294 PWs) bands (ev): -21.1639 -21.1639 -21.1623 -21.1623 -8.4455 -8.4455 -7.9518 -7.9518 -7.8759 -7.8759 -7.3552 -7.3552 -6.3495 -6.3495 -5.9385 -5.9385 -5.7673 -5.7673 -5.4428 -5.4428 -5.1191 -5.1191 -4.5810 -4.5810 2.9277 2.9277 3.0585 3.0585 3.1017 3.1017 3.3090 3.3090 3.3952 3.3952 3.5620 3.5620 4.5560 4.5560 4.8186 4.8186 4.9578 4.9578 5.2385 5.2385 6.8293 6.8293 7.0956 7.0956 9.1772 9.1772 9.6048 9.6048 k = 0.5229 0.0737-0.9042 ( 5298 PWs) bands (ev): -21.1638 -21.1638 -21.1622 -21.1622 -8.4438 -8.4438 -7.9628 -7.9628 -7.8675 -7.8675 -7.3562 -7.3562 -6.3465 -6.3465 -5.9360 -5.9360 -5.7707 -5.7707 -5.4506 -5.4506 -5.1125 -5.1125 -4.5797 -4.5797 2.9055 2.9055 3.0489 3.0489 3.1177 3.1177 3.2955 3.2955 3.3965 3.3965 3.5527 3.5527 4.5663 4.5663 4.8277 4.8277 4.9672 4.9672 5.2331 5.2331 6.8492 6.8492 7.1029 7.1029 9.1548 9.1548 9.6324 9.6324 k = 0.5305 0.0483-0.9042 ( 5300 PWs) bands (ev): -21.1638 -21.1638 -21.1621 -21.1621 -8.4413 -8.4413 -7.9752 -7.9752 -7.8585 -7.8585 -7.3576 -7.3576 -6.3424 -6.3424 -5.9325 -5.9325 -5.7755 -5.7755 -5.4609 -5.4609 -5.1038 -5.1038 -4.5779 -4.5779 2.8793 2.8793 3.0357 3.0357 3.1353 3.1353 3.2772 3.2772 3.3977 3.3977 3.5410 3.5410 4.5796 4.5796 4.8399 4.8399 4.9802 4.9802 5.2262 5.2262 6.8765 6.8765 7.1132 7.1132 9.1289 9.1289 9.6646 9.6646 k = 0.5381 0.0229-0.9042 ( 5304 PWs) bands (ev): -21.1637 -21.1637 -21.1620 -21.1620 -8.4383 -8.4383 -7.9885 -7.9885 -7.8496 -7.8496 -7.3593 -7.3593 -6.3371 -6.3371 -5.9281 -5.9281 -5.7815 -5.7815 -5.4734 -5.4734 -5.0934 -5.0934 -4.5757 -4.5757 2.8502 2.8502 3.0193 3.0193 3.1519 3.1519 3.2558 3.2558 3.3984 3.3984 3.5280 3.5280 4.5951 4.5951 4.8547 4.8547 4.9965 4.9965 5.2185 5.2185 6.9105 6.9105 7.1265 7.1265 9.1020 9.1020 9.6976 9.6976 k = 0.5457-0.0025-0.9042 ( 5308 PWs) bands (ev): -21.1636 -21.1636 -21.1619 -21.1619 -8.4346 -8.4346 -8.0022 -8.0022 -7.8412 -7.8412 -7.3613 -7.3613 -6.3308 -6.3308 -5.9229 -5.9229 -5.7887 -5.7887 -5.4874 -5.4874 -5.0816 -5.0816 -4.5732 -4.5732 2.8189 2.8189 3.0003 3.0003 3.1623 3.1623 3.2359 3.2359 3.3979 3.3979 3.5145 3.5145 4.6119 4.6119 4.8714 4.8714 5.0156 5.0156 5.2109 5.2109 6.9507 6.9507 7.1430 7.1430 9.0760 9.0760 9.7288 9.7288 k = 0.5534-0.0280-0.9042 ( 5308 PWs) bands (ev): -21.1635 -21.1635 -21.1618 -21.1618 -8.4304 -8.4304 -8.0161 -8.0161 -7.8334 -7.8334 -7.3636 -7.3636 -6.3236 -6.3236 -5.9168 -5.9168 -5.7970 -5.7970 -5.5027 -5.5027 -5.0687 -5.0687 -4.5704 -4.5704 2.7859 2.7859 2.9790 2.9790 3.1550 3.1550 3.2293 3.2293 3.3955 3.3955 3.5016 3.5016 4.6295 4.6295 4.8891 4.8891 5.0371 5.0371 5.2042 5.2042 6.9963 6.9963 7.1627 7.1627 9.0520 9.0520 9.7559 9.7559 k = 0.5610-0.0534-0.9042 ( 5312 PWs) bands (ev): -21.1634 -21.1634 -21.1616 -21.1616 -8.4258 -8.4258 -8.0301 -8.0301 -7.8263 -7.8263 -7.3660 -7.3660 -6.3154 -6.3154 -5.9100 -5.9100 -5.8063 -5.8063 -5.5187 -5.5187 -5.0551 -5.0551 -4.5675 -4.5675 2.7515 2.7515 2.9558 2.9558 3.1280 3.1280 3.2384 3.2384 3.3908 3.3908 3.4900 3.4900 4.6476 4.6476 4.9069 4.9069 5.0601 5.0601 5.1995 5.1995 7.0468 7.0468 7.1857 7.1857 9.0311 9.0311 9.7776 9.7776 k = 0.5686-0.0788-0.9042 ( 5310 PWs) bands (ev): -21.1633 -21.1633 -21.1614 -21.1614 -8.4208 -8.4208 -8.0438 -8.0438 -7.8201 -7.8201 -7.3687 -7.3687 -6.3065 -6.3065 -5.9027 -5.9027 -5.8165 -5.8165 -5.5351 -5.5351 -5.0410 -5.0410 -4.5644 -4.5644 2.7158 2.7158 2.9309 2.9309 3.0916 3.0916 3.2530 3.2530 3.3838 3.3838 3.4802 3.4802 4.6658 4.6658 4.9235 4.9235 5.0841 5.0841 5.1979 5.1979 7.1015 7.1015 7.2120 7.2120 9.0137 9.0137 9.7936 9.7936 k = 0.5762-0.1042-0.9042 ( 5313 PWs) bands (ev): -21.1631 -21.1631 -21.1612 -21.1612 -8.4157 -8.4157 -8.0571 -8.0571 -7.8148 -7.8148 -7.3713 -7.3713 -6.2968 -6.2968 -5.8950 -5.8950 -5.8272 -5.8272 -5.5515 -5.5515 -5.0265 -5.0265 -4.5614 -4.5614 2.6792 2.6792 2.9045 2.9045 3.0510 3.0510 3.2678 3.2678 3.3750 3.3750 3.4724 3.4724 4.6840 4.6840 4.9379 4.9379 5.1084 5.1084 5.2003 5.2003 7.1596 7.1596 7.2419 7.2419 9.0004 9.0004 9.8040 9.8040 k = 0.5838-0.1296-0.9042 ( 5311 PWs) bands (ev): -21.1630 -21.1630 -21.1610 -21.1610 -8.4104 -8.4104 -8.0698 -8.0698 -7.8104 -7.8104 -7.3740 -7.3740 -6.2865 -6.2865 -5.8875 -5.8875 -5.8381 -5.8381 -5.5675 -5.5675 -5.0118 -5.0118 -4.5585 -4.5585 2.6418 2.6418 2.8768 2.8768 3.0079 3.0079 3.2801 3.2801 3.3660 3.3660 3.4664 3.4664 4.7022 4.7022 4.9491 4.9491 5.1328 5.1328 5.2069 5.2069 7.2205 7.2205 7.2753 7.2753 8.9915 8.9915 9.8095 9.8095 k = 0.5915-0.1550-0.9042 ( 5309 PWs) bands (ev): -21.1629 -21.1629 -21.1607 -21.1607 -8.4051 -8.4051 -8.0818 -8.0818 -7.8071 -7.8071 -7.3767 -7.3767 -6.2757 -6.2757 -5.8818 -5.8818 -5.8477 -5.8477 -5.5829 -5.5829 -4.9971 -4.9971 -4.5556 -4.5556 2.6040 2.6040 2.8477 2.8477 2.9634 2.9634 3.2867 3.2867 3.3598 3.3598 3.4621 3.4621 4.7203 4.7203 4.9568 4.9568 5.1575 5.1575 5.2172 5.2172 7.2831 7.2831 7.3129 7.3129 8.9874 8.9874 9.8108 9.8108 k = 0.5991-0.1804-0.9042 ( 5319 PWs) bands (ev): -21.1627 -21.1627 -21.1605 -21.1605 -8.4002 -8.4002 -8.0927 -8.0927 -7.8049 -7.8049 -7.3792 -7.3792 -6.2645 -6.2645 -5.8819 -5.8819 -5.8519 -5.8519 -5.5973 -5.5973 -4.9825 -4.9825 -4.5530 -4.5530 2.5658 2.5658 2.8174 2.8174 2.9181 2.9181 3.2848 3.2848 3.3590 3.3590 3.4594 3.4594 4.7381 4.7381 4.9610 4.9610 5.1826 5.1826 5.2301 5.2301 7.3429 7.3429 7.3586 7.3586 8.9881 8.9881 9.8088 9.8088 k = 0.6067-0.2059-0.9042 ( 5315 PWs) bands (ev): -21.1626 -21.1626 -21.1602 -21.1602 -8.3956 -8.3956 -8.1025 -8.1025 -7.8038 -7.8038 -7.3816 -7.3816 -6.2530 -6.2530 -5.8902 -5.8902 -5.8484 -5.8484 -5.6104 -5.6104 -4.9680 -4.9680 -4.5507 -4.5507 2.5277 2.5277 2.7858 2.7858 2.8724 2.8724 3.2753 3.2753 3.3628 3.3628 3.4585 3.4585 4.7556 4.7556 4.9625 4.9625 5.2079 5.2079 5.2445 5.2445 7.3913 7.3913 7.4205 7.4205 8.9938 8.9938 9.8041 9.8041 k = 0.6143-0.2313-0.9042 ( 5313 PWs) bands (ev): -21.1624 -21.1624 -21.1600 -21.1600 -8.3917 -8.3917 -8.1108 -8.1108 -7.8038 -7.8038 -7.3838 -7.3838 -6.2414 -6.2414 -5.9025 -5.9025 -5.8416 -5.8416 -5.6218 -5.6218 -4.9536 -4.9536 -4.5486 -4.5486 2.4898 2.4898 2.7529 2.7529 2.8268 2.8268 3.2613 3.2613 3.3678 3.3678 3.4596 3.4596 4.7726 4.7726 4.9621 4.9621 5.2319 5.2319 5.2607 5.2607 7.4384 7.4384 7.4878 7.4878 9.0045 9.0045 9.7973 9.7973 k = 0.6219-0.2567-0.9042 ( 5313 PWs) bands (ev): -21.1623 -21.1623 -21.1597 -21.1597 -8.3887 -8.3887 -8.1175 -8.1175 -7.8048 -7.8048 -7.3858 -7.3858 -6.2297 -6.2297 -5.9161 -5.9161 -5.8341 -5.8341 -5.6312 -5.6312 -4.9395 -4.9395 -4.5468 -4.5468 2.4522 2.4522 2.7187 2.7187 2.7816 2.7816 3.2452 3.2452 3.3715 3.3715 3.4628 3.4628 4.7890 4.7890 4.9606 4.9606 5.2508 5.2508 5.2811 5.2811 7.4877 7.4877 7.5564 7.5564 9.0203 9.0203 9.7890 9.7890 k = 0.6296-0.2821-0.9042 ( 5323 PWs) bands (ev): -21.1621 -21.1621 -21.1594 -21.1594 -8.3867 -8.3867 -8.1225 -8.1225 -7.8070 -7.8070 -7.3875 -7.3875 -6.2182 -6.2182 -5.9300 -5.9300 -5.8272 -5.8272 -5.6383 -5.6383 -4.9257 -4.9257 -4.5454 -4.5454 2.4151 2.4151 2.6832 2.6832 2.7370 2.7370 3.2286 3.2286 3.3729 3.3729 3.4679 3.4679 4.8045 4.8045 4.9586 4.9586 5.2632 5.2632 5.3063 5.3063 7.5395 7.5395 7.6256 7.6256 9.0412 9.0412 9.7798 9.7798 k = 0.6372-0.3075-0.9042 ( 5313 PWs) bands (ev): -21.1620 -21.1620 -21.1591 -21.1591 -8.3858 -8.3858 -8.1255 -8.1255 -7.8101 -7.8101 -7.3889 -7.3889 -6.2071 -6.2071 -5.9436 -5.9436 -5.8212 -5.8212 -5.6430 -5.6430 -4.9122 -4.9122 -4.5443 -4.5443 2.3785 2.3785 2.6466 2.6466 2.6933 2.6933 3.2120 3.2120 3.3723 3.3723 3.4740 3.4740 4.8188 4.8188 4.9565 4.9565 5.2709 5.2709 5.3338 5.3338 7.5936 7.5936 7.6951 7.6951 9.0670 9.0670 9.7700 9.7700 k = 0.6448-0.3329-0.9042 ( 5307 PWs) bands (ev): -21.1619 -21.1619 -21.1589 -21.1589 -8.3860 -8.3860 -8.1268 -8.1268 -7.8142 -7.8142 -7.3901 -7.3901 -6.1965 -6.1965 -5.9566 -5.9566 -5.8165 -5.8165 -5.6450 -5.6450 -4.8990 -4.8990 -4.5436 -4.5436 2.3425 2.3425 2.6091 2.6091 2.6508 2.6508 3.1960 3.1960 3.3701 3.3701 3.4803 3.4803 4.8317 4.8317 4.9549 4.9549 5.2754 5.2754 5.3618 5.3618 7.6498 7.6498 7.7646 7.7646 9.0976 9.0976 9.7601 9.7601 k = 0.6524-0.3584-0.9042 ( 5303 PWs) bands (ev): -21.1618 -21.1618 -21.1586 -21.1586 -8.3874 -8.3874 -8.1263 -8.1263 -7.8192 -7.8192 -7.3911 -7.3911 -6.1866 -6.1866 -5.9685 -5.9685 -5.8133 -5.8133 -5.6443 -5.6443 -4.8861 -4.8861 -4.5432 -4.5432 2.3069 2.3069 2.5708 2.5708 2.6095 2.6095 3.1810 3.1810 3.3669 3.3669 3.4859 3.4859 4.8429 4.8429 4.9540 4.9540 5.2772 5.2772 5.3895 5.3895 7.7076 7.7076 7.8338 7.8338 9.1328 9.1328 9.7504 9.7504 k = 0.6601-0.3838-0.9042 ( 5309 PWs) bands (ev): -21.1617 -21.1617 -21.1583 -21.1583 -8.3899 -8.3899 -8.1243 -8.1243 -7.8248 -7.8248 -7.3919 -7.3919 -6.1779 -6.1779 -5.9788 -5.9788 -5.8115 -5.8115 -5.6414 -5.6414 -4.8736 -4.8736 -4.5431 -4.5431 2.2715 2.2715 2.5320 2.5320 2.5699 2.5699 3.1671 3.1671 3.3630 3.3630 3.4901 3.4901 4.8522 4.8522 4.9539 4.9539 5.2767 5.2767 5.4163 5.4163 7.7670 7.7670 7.9027 7.9027 9.1725 9.1725 9.7414 9.7414 k = 0.3399-1.1336-0.0000 ( 5309 PWs) bands (ev): -21.1617 -21.1617 -21.1583 -21.1583 -8.3899 -8.3899 -8.1243 -8.1243 -7.8248 -7.8248 -7.3919 -7.3919 -6.1779 -6.1779 -5.9788 -5.9788 -5.8115 -5.8115 -5.6414 -5.6414 -4.8736 -4.8736 -4.5431 -4.5431 2.2715 2.2715 2.5320 2.5320 2.5699 2.5699 3.1671 3.1671 3.3630 3.3630 3.4901 3.4901 4.8522 4.8522 4.9539 4.9539 5.2767 5.2767 5.4163 5.4163 7.7670 7.7670 7.9027 7.9027 9.1725 9.1725 9.7414 9.7414 k = 0.3322-1.1078-0.0000 ( 5305 PWs) bands (ev): -21.1616 -21.1616 -21.1581 -21.1581 -8.3932 -8.3932 -8.1211 -8.1211 -7.8310 -7.8310 -7.3926 -7.3926 -6.1704 -6.1704 -5.9871 -5.9871 -5.8108 -5.8108 -5.6363 -5.6363 -4.8611 -4.8611 -4.5432 -4.5432 2.2358 2.2358 2.4920 2.4920 2.5319 2.5319 3.1544 3.1544 3.3588 3.3588 3.4926 3.4926 4.8594 4.8594 4.9549 4.9549 5.2742 5.2742 5.4424 5.4424 7.8284 7.8284 7.9721 7.9721 9.2169 9.2169 9.7332 9.7332 k = 0.3245-1.0821-0.0000 ( 5295 PWs) bands (ev): -21.1616 -21.1616 -21.1578 -21.1578 -8.3972 -8.3972 -8.1170 -8.1170 -7.8374 -7.8374 -7.3933 -7.3933 -6.1646 -6.1646 -5.9929 -5.9929 -5.8109 -5.8109 -5.6298 -5.6298 -4.8489 -4.8489 -4.5436 -4.5436 2.1998 2.1998 2.4513 2.4513 2.4972 2.4972 3.1432 3.1432 3.3544 3.3544 3.4927 3.4927 4.8642 4.8642 4.9569 4.9569 5.2701 5.2701 5.4670 5.4670 7.8909 7.8909 8.0409 8.0409 9.2653 9.2653 9.7261 9.7261 k = 0.3168-1.0563-0.0000 ( 5291 PWs) bands (ev): -21.1616 -21.1616 -21.1576 -21.1576 -8.4016 -8.4016 -8.1127 -8.1127 -7.8438 -7.8438 -7.3939 -7.3939 -6.1605 -6.1605 -5.9960 -5.9960 -5.8116 -5.8116 -5.6222 -5.6222 -4.8370 -4.8370 -4.5442 -4.5442 2.1634 2.1634 2.4093 2.4093 2.4664 2.4664 3.1336 3.1336 3.3500 3.3500 3.4903 3.4903 4.8670 4.8670 4.9597 4.9597 5.2646 5.2646 5.4900 5.4900 7.9540 7.9540 8.1092 8.1092 9.3173 9.3173 9.7205 9.7205 k = 0.3090-1.0305-0.0000 ( 5291 PWs) bands (ev): -21.1615 -21.1615 -21.1573 -21.1573 -8.4062 -8.4062 -8.1085 -8.1085 -7.8498 -7.8498 -7.3945 -7.3945 -6.1581 -6.1581 -5.9963 -5.9963 -5.8124 -5.8124 -5.6141 -5.6141 -4.8253 -4.8253 -4.5449 -4.5449 2.1263 2.1263 2.3662 2.3662 2.4402 2.4402 3.1258 3.1258 3.3457 3.3457 3.4851 3.4851 4.8678 4.8678 4.9631 4.9631 5.2582 5.2582 5.5113 5.5113 8.0178 8.0178 8.1769 8.1769 9.3725 9.3725 9.7165 9.7165 k = 0.3013-1.0048-0.0000 ( 5295 PWs) bands (ev): -21.1616 -21.1616 -21.1571 -21.1571 -8.4108 -8.4108 -8.1051 -8.1051 -7.8550 -7.8550 -7.3953 -7.3953 -6.1570 -6.1570 -5.9941 -5.9941 -5.8133 -5.8133 -5.6058 -5.6058 -4.8137 -4.8137 -4.5458 -4.5458 2.0885 2.0885 2.3220 2.3220 2.4187 2.4187 3.1196 3.1196 3.3415 3.3415 3.4770 3.4770 4.8669 4.8669 4.9668 4.9668 5.2510 5.2510 5.5308 5.5308 8.0818 8.0818 8.2441 8.2441 9.4302 9.4302 9.7143 9.7143 k = 0.2936-0.9790-0.0000 ( 5297 PWs) bands (ev): -21.1616 -21.1616 -21.1569 -21.1569 -8.4152 -8.4152 -8.1030 -8.1030 -7.8590 -7.8590 -7.3963 -7.3963 -6.1568 -6.1568 -5.9897 -5.9897 -5.8139 -5.8139 -5.5977 -5.5977 -4.8023 -4.8023 -4.5466 -4.5466 2.0501 2.0501 2.2771 2.2771 2.4020 2.4020 3.1153 3.1153 3.3374 3.3374 3.4658 3.4658 4.8646 4.8646 4.9708 4.9708 5.2434 5.2434 5.5484 5.5484 8.1461 8.1461 8.3108 8.3108 9.4901 9.4901 9.7141 9.7141 k = 0.2859-0.9532-0.0000 ( 5301 PWs) bands (ev): -21.1617 -21.1617 -21.1567 -21.1567 -8.4193 -8.4193 -8.1027 -8.1027 -7.8614 -7.8614 -7.3976 -7.3976 -6.1569 -6.1569 -5.9837 -5.9837 -5.8140 -5.8140 -5.5900 -5.5900 -4.7910 -4.7910 -4.5474 -4.5474 2.0111 2.0111 2.2317 2.2317 2.3900 2.3900 3.1127 3.1127 3.3333 3.3333 3.4516 3.4516 4.8609 4.8609 4.9749 4.9749 5.2354 5.2354 5.5641 5.5641 8.2104 8.2104 8.3771 8.3771 9.5511 9.5511 9.7161 9.7161 k = 0.2781-0.9275-0.0000 ( 5299 PWs) bands (ev): -21.1618 -21.1618 -21.1566 -21.1566 -8.4230 -8.4230 -8.1045 -8.1045 -7.8619 -7.8619 -7.3991 -7.3991 -6.1568 -6.1568 -5.9765 -5.9765 -5.8137 -5.8137 -5.5830 -5.5830 -4.7797 -4.7797 -4.5480 -4.5480 1.9717 1.9717 2.1858 2.1858 2.3826 2.3826 3.1119 3.1119 3.3292 3.3292 3.4345 3.4345 4.8561 4.8561 4.9792 4.9792 5.2271 5.2271 5.5780 5.5780 8.2747 8.2747 8.4430 8.4430 9.6123 9.6123 9.7207 9.7207 k = 0.2704-0.9017-0.0000 ( 5319 PWs) bands (ev): -21.1619 -21.1619 -21.1564 -21.1564 -8.4261 -8.4261 -8.1088 -8.1088 -7.8603 -7.8603 -7.4010 -7.4010 -6.1560 -6.1560 -5.9686 -5.9686 -5.8129 -5.8129 -5.5769 -5.5769 -4.7685 -4.7685 -4.5485 -4.5485 1.9321 1.9321 2.1398 2.1398 2.3796 2.3796 3.1127 3.1127 3.3248 3.3248 3.4147 3.4147 4.8503 4.8503 4.9840 4.9840 5.2187 5.2187 5.5900 5.5900 8.3386 8.3386 8.5084 8.5084 9.6708 9.6708 9.7295 9.7295 k = 0.2627-0.8760-0.0000 ( 5321 PWs) bands (ev): -21.1620 -21.1620 -21.1563 -21.1563 -8.4286 -8.4286 -8.1154 -8.1154 -7.8566 -7.8566 -7.4033 -7.4033 -6.1543 -6.1543 -5.9603 -5.9603 -5.8113 -5.8113 -5.5718 -5.5718 -4.7573 -4.7573 -4.5488 -4.5488 1.8925 1.8925 2.0936 2.0936 2.3807 2.3807 3.1152 3.1152 3.3196 3.3196 3.3928 3.3928 4.8436 4.8436 4.9894 4.9894 5.2101 5.2101 5.6002 5.6002 8.4021 8.4021 8.5736 8.5736 9.7138 9.7138 9.7540 9.7540 k = 0.2550-0.8502-0.0000 ( 5315 PWs) bands (ev): -21.1622 -21.1622 -21.1562 -21.1562 -8.4305 -8.4305 -8.1244 -8.1244 -7.8509 -7.8509 -7.4060 -7.4060 -6.1514 -6.1514 -5.9518 -5.9518 -5.8092 -5.8092 -5.5677 -5.5677 -4.7461 -4.7461 -4.5488 -4.5488 1.8532 1.8532 2.0476 2.0476 2.3860 2.3860 3.1192 3.1192 3.3122 3.3122 3.3703 3.3703 4.8362 4.8362 4.9955 4.9955 5.2014 5.2014 5.6087 5.6087 8.4650 8.4650 8.6385 8.6385 9.7311 9.7311 9.8022 9.8022 k = 0.2472-0.8244-0.0000 ( 5309 PWs) bands (ev): -21.1624 -21.1624 -21.1562 -21.1562 -8.4316 -8.4316 -8.1353 -8.1353 -7.8436 -7.8436 -7.4092 -7.4092 -6.1471 -6.1471 -5.9434 -5.9434 -5.8063 -5.8063 -5.5648 -5.5648 -4.7350 -4.7350 -4.5484 -4.5484 1.8143 1.8143 2.0017 2.0017 2.3950 2.3950 3.1245 3.1245 3.2997 3.2997 3.3505 3.3505 4.8283 4.8283 5.0024 5.0024 5.1927 5.1927 5.6154 5.6154 8.5271 8.5271 8.7030 8.7030 9.7421 9.7421 9.8500 9.8500 k = 0.2395-0.7987-0.0000 ( 5311 PWs) bands (ev): -21.1626 -21.1626 -21.1561 -21.1561 -8.4321 -8.4321 -8.1479 -8.1479 -7.8350 -7.8350 -7.4128 -7.4128 -6.1414 -6.1414 -5.9350 -5.9350 -5.8028 -5.8028 -5.5631 -5.5631 -4.7239 -4.7239 -4.5476 -4.5476 1.7760 1.7760 1.9562 1.9562 2.4078 2.4078 3.1307 3.1307 3.2784 3.2784 3.3374 3.3374 4.8201 4.8201 5.0100 5.0100 5.1839 5.1839 5.6206 5.6206 8.5882 8.5882 8.7671 8.7671 9.7516 9.7516 9.8747 9.8747 k = 0.2318-0.7729-0.0000 ( 5313 PWs) bands (ev): -21.1629 -21.1629 -21.1561 -21.1561 -8.4319 -8.4319 -8.1618 -8.1618 -7.8253 -7.8253 -7.4169 -7.4169 -6.1343 -6.1343 -5.9269 -5.9269 -5.7988 -5.7988 -5.5626 -5.5626 -4.7128 -4.7128 -4.5464 -4.5464 1.7384 1.7384 1.9111 1.9111 2.4240 2.4240 3.1371 3.1371 3.2502 3.2502 3.3301 3.3301 4.8120 4.8120 5.0181 5.0181 5.1754 5.1754 5.6242 5.6242 8.6479 8.6479 8.8308 8.8308 9.7592 9.7592 9.8806 9.8806 k = 0.2241-0.7471-0.0000 ( 5311 PWs) bands (ev): -21.1632 -21.1632 -21.1561 -21.1561 -8.4311 -8.4311 -8.1766 -8.1766 -7.8149 -7.8149 -7.4214 -7.4214 -6.1257 -6.1257 -5.9190 -5.9190 -5.7941 -5.7941 -5.5632 -5.5632 -4.7018 -4.7018 -4.5448 -4.5448 1.7017 1.7017 1.8666 1.8666 2.4436 2.4436 3.1414 3.1414 3.2201 3.2201 3.3260 3.3260 4.8041 4.8041 5.0264 5.0264 5.1676 5.1676 5.6264 5.6264 8.7062 8.7062 8.8940 8.8940 9.7634 9.7634 9.8834 9.8834 k = 0.2163-0.7214-0.0000 ( 5309 PWs) bands (ev): -21.1635 -21.1635 -21.1561 -21.1561 -8.4297 -8.4297 -8.1919 -8.1919 -7.8041 -7.8041 -7.4264 -7.4264 -6.1159 -6.1159 -5.9114 -5.9114 -5.7890 -5.7890 -5.5648 -5.5648 -4.6909 -4.6909 -4.5427 -4.5427 1.6659 1.6659 1.8227 1.8227 2.4663 2.4663 3.1358 3.1358 3.1974 3.1974 3.3238 3.3238 4.7966 4.7966 5.0342 5.0342 5.1613 5.1613 5.6271 5.6271 8.7625 8.7625 8.9564 8.9564 9.7614 9.7614 9.8843 9.8843 k = 0.2086-0.6956-0.0000 ( 5303 PWs) bands (ev): -21.1638 -21.1638 -21.1561 -21.1561 -8.4279 -8.4279 -8.2075 -8.2075 -7.7931 -7.7931 -7.4317 -7.4317 -6.1047 -6.1047 -5.9040 -5.9040 -5.7836 -5.7836 -5.5675 -5.5675 -4.6801 -4.6801 -4.5402 -4.5402 1.6311 1.6311 1.7796 1.7796 2.4920 2.4920 3.1103 3.1103 3.1926 3.1926 3.3230 3.3230 4.7898 4.7898 5.0402 5.0402 5.1575 5.1575 5.6264 5.6264 8.8164 8.8164 9.0179 9.0179 9.7488 9.7488 9.8831 9.8831 k = 0.2009-0.6698-0.0000 ( 5301 PWs) bands (ev): -21.1642 -21.1642 -21.1562 -21.1562 -8.4259 -8.4259 -8.2228 -8.2228 -7.7820 -7.7820 -7.4374 -7.4374 -6.0925 -6.0925 -5.8968 -5.8968 -5.7778 -5.7778 -5.5710 -5.5710 -4.6695 -4.6695 -4.5373 -4.5373 1.5974 1.5974 1.7373 1.7373 2.5205 2.5205 3.0724 3.0724 3.1983 3.1983 3.3239 3.3239 4.7837 4.7837 5.0432 5.0432 5.1578 5.1578 5.6245 5.6245 8.8675 8.8675 9.0783 9.0783 9.7208 9.7208 9.8794 9.8794 k = 0.1932-0.6441-0.0000 ( 5297 PWs) bands (ev): -21.1645 -21.1645 -21.1563 -21.1563 -8.4238 -8.4238 -8.2375 -8.2375 -7.7712 -7.7712 -7.4434 -7.4434 -6.0793 -6.0793 -5.8898 -5.8898 -5.7718 -5.7718 -5.5752 -5.5752 -4.6591 -4.6591 -4.5340 -4.5340 1.5648 1.5648 1.6959 1.6959 2.5515 2.5515 3.0298 3.0298 3.2067 3.2067 3.3270 3.3270 4.7784 4.7784 5.0421 5.0421 5.1631 5.1631 5.6214 5.6214 8.9152 8.9152 9.1371 9.1371 9.6747 9.6747 9.8734 9.8734 k = 0.1854-0.6183-0.0000 ( 5287 PWs) bands (ev): -21.1649 -21.1649 -21.1563 -21.1563 -8.4222 -8.4222 -8.2511 -8.2511 -7.7607 -7.7607 -7.4496 -7.4496 -6.0652 -6.0652 -5.8829 -5.8829 -5.7657 -5.7657 -5.5799 -5.5799 -4.6490 -4.6490 -4.5303 -4.5303 1.5334 1.5334 1.6556 1.6556 2.5849 2.5849 2.9850 2.9850 3.2150 3.2150 3.3327 3.3327 4.7739 4.7739 5.0370 5.0370 5.1734 5.1734 5.6171 5.6171 8.9589 8.9589 9.1939 9.1939 9.6127 9.6127 9.8656 9.8656 k = 0.1777-0.5926-0.0000 ( 5283 PWs) bands (ev): -21.1653 -21.1653 -21.1565 -21.1565 -8.4214 -8.4214 -8.2629 -8.2629 -7.7507 -7.7507 -7.4559 -7.4559 -6.0506 -6.0506 -5.8763 -5.8763 -5.7597 -5.7597 -5.5849 -5.5849 -4.6392 -4.6392 -4.5263 -4.5263 1.5031 1.5031 1.6164 1.6164 2.6202 2.6202 2.9392 2.9392 3.2218 3.2218 3.3417 3.3417 4.7701 4.7701 5.0289 5.0289 5.1880 5.1880 5.6116 5.6116 8.9975 8.9975 9.2483 9.2483 9.5396 9.5396 9.8557 9.8557 k = 0.1700-0.5668-0.0000 ( 5285 PWs) bands (ev): -21.1657 -21.1657 -21.1566 -21.1566 -8.4221 -8.4221 -8.2723 -8.2723 -7.7414 -7.7414 -7.4623 -7.4623 -6.0355 -6.0355 -5.8697 -5.8697 -5.7539 -5.7539 -5.5898 -5.5898 -4.6297 -4.6297 -4.5220 -4.5220 1.4741 1.4741 1.5784 1.5784 2.6567 2.6567 2.8935 2.8935 3.2265 3.2265 3.3542 3.3542 4.7669 4.7669 5.0189 5.0189 5.2057 5.2057 5.6051 5.6051 9.0303 9.0303 9.2995 9.2995 9.4599 9.4599 9.8437 9.8437 k = 0.1622-0.5410-0.0000 ( 5291 PWs) bands (ev): -21.1662 -21.1662 -21.1567 -21.1567 -8.4249 -8.4249 -8.2785 -8.2785 -7.7331 -7.7331 -7.4686 -7.4686 -6.0202 -6.0202 -5.8634 -5.8634 -5.7486 -5.7486 -5.5943 -5.5943 -4.6205 -4.6205 -4.5176 -4.5176 1.4463 1.4463 1.5416 1.5416 2.6927 2.6927 2.8500 2.8500 3.2292 3.2292 3.3700 3.3700 4.7641 4.7641 5.0079 5.0079 5.2257 5.2257 5.5977 5.5977 9.0560 9.0560 9.3464 9.3464 9.3774 9.3774 9.8295 9.8295 k = 0.1545-0.5153-0.0000 ( 5293 PWs) bands (ev): -21.1666 -21.1666 -21.1569 -21.1569 -8.4299 -8.4299 -8.2813 -8.2813 -7.7257 -7.7257 -7.4746 -7.4746 -6.0049 -6.0049 -5.8572 -5.8572 -5.7439 -5.7439 -5.5980 -5.5980 -4.6118 -4.6118 -4.5130 -4.5130 1.4196 1.4196 1.5063 1.5063 2.7207 2.7207 2.8162 2.8162 3.2300 3.2300 3.3887 3.3887 4.7613 4.7613 4.9969 4.9969 5.2473 5.2473 5.5895 5.5895 9.0733 9.0733 9.2931 9.2931 9.3897 9.3897 9.8135 9.8135 k = 0.1468-0.4895-0.0000 ( 5293 PWs) bands (ev): -21.1670 -21.1670 -21.1570 -21.1570 -8.4374 -8.4374 -8.2806 -8.2806 -7.7196 -7.7196 -7.4803 -7.4803 -5.9897 -5.9897 -5.8513 -5.8513 -5.7402 -5.7402 -5.6004 -5.6004 -4.6036 -4.6036 -4.5082 -4.5082 1.3942 1.3942 1.4724 1.4724 2.7159 2.7159 2.8170 2.8170 3.2296 3.2296 3.4098 3.4098 4.7583 4.7583 4.9863 4.9863 5.2699 5.2699 5.5806 5.5806 9.0808 9.0808 9.2109 9.2109 9.4265 9.4265 9.7963 9.7963 k = 0.1391-0.4637-0.0000 ( 5295 PWs) bands (ev): -21.1675 -21.1675 -21.1572 -21.1572 -8.4468 -8.4468 -8.2766 -8.2766 -7.7150 -7.7150 -7.4854 -7.4854 -5.9748 -5.9748 -5.8457 -5.8457 -5.7378 -5.7378 -5.6010 -5.6010 -4.5959 -4.5959 -4.5035 -4.5035 1.3699 1.3699 1.4400 1.4400 2.6810 2.6810 2.8498 2.8498 3.2282 3.2282 3.4328 3.4328 4.7545 4.7545 4.9769 4.9769 5.2929 5.2929 5.5712 5.5712 9.0753 9.0753 9.1335 9.1335 9.4568 9.4568 9.7791 9.7791 k = 0.1313-0.4380-0.0000 ( 5291 PWs) bands (ev): -21.1679 -21.1679 -21.1574 -21.1574 -8.4577 -8.4577 -8.2700 -8.2700 -7.7119 -7.7119 -7.4898 -7.4898 -5.9604 -5.9604 -5.8405 -5.8405 -5.7371 -5.7371 -5.5994 -5.5994 -4.5887 -4.5887 -4.4987 -4.4987 1.3467 1.3467 1.4093 1.4093 2.6387 2.6387 2.8920 2.8920 3.2262 3.2262 3.4571 3.4571 4.7497 4.7497 4.9689 4.9689 5.3158 5.3158 5.5617 5.5617 9.0361 9.0361 9.0824 9.0824 9.4798 9.4798 9.7629 9.7629 k = 0.1236-0.4122-0.0000 ( 5297 PWs) bands (ev): -21.1683 -21.1683 -21.1576 -21.1576 -8.4694 -8.4694 -8.2612 -8.2612 -7.7106 -7.7106 -7.4934 -7.4934 -5.9466 -5.9466 -5.8357 -5.8357 -5.7380 -5.7380 -5.5954 -5.5954 -4.5822 -4.5822 -4.4939 -4.4939 1.3245 1.3245 1.3804 1.3804 2.5952 2.5952 2.9371 2.9371 3.2238 3.2238 3.4825 3.4825 4.7437 4.7437 4.9627 4.9627 5.3378 5.3378 5.5527 5.5527 8.9661 8.9661 9.0562 9.0562 9.4955 9.4955 9.7486 9.7486 k = 0.1159-0.3865-0.0000 ( 5299 PWs) bands (ev): -21.1687 -21.1687 -21.1578 -21.1578 -8.4816 -8.4816 -8.2507 -8.2507 -7.7111 -7.7111 -7.4960 -7.4960 -5.9335 -5.9335 -5.8313 -5.8313 -5.7406 -5.7406 -5.5892 -5.5892 -4.5762 -4.5762 -4.4892 -4.4892 1.3033 1.3033 1.3534 1.3534 2.5523 2.5523 2.9834 2.9834 3.2215 3.2215 3.5087 3.5087 4.7362 4.7362 4.9582 4.9582 5.3579 5.3579 5.5449 5.5449 8.8948 8.8948 9.0272 9.0272 9.5043 9.5043 9.7360 9.7360 k = 0.1082-0.3607-0.0000 ( 5291 PWs) bands (ev): -21.1692 -21.1692 -21.1579 -21.1579 -8.4939 -8.4939 -8.2389 -8.2389 -7.7135 -7.7135 -7.4976 -7.4976 -5.9210 -5.9210 -5.8275 -5.8275 -5.7444 -5.7444 -5.5808 -5.5808 -4.5709 -4.5709 -4.4845 -4.4845 1.2830 1.2830 1.3284 1.3284 2.5106 2.5106 3.0300 3.0300 3.2194 3.2194 3.5354 3.5354 4.7274 4.7274 4.9555 4.9555 5.3748 5.3748 5.5394 5.5394 8.8266 8.8266 8.9937 8.9937 9.5074 9.5074 9.7247 9.7247 k = 0.1004-0.3349-0.0000 ( 5287 PWs) bands (ev): -21.1695 -21.1695 -21.1581 -21.1581 -8.5060 -8.5060 -8.2261 -8.2261 -7.7176 -7.7176 -7.4983 -7.4983 -5.9094 -5.9094 -5.8243 -5.8243 -5.7492 -5.7492 -5.5709 -5.5709 -4.5663 -4.5663 -4.4799 -4.4799 1.2635 1.2635 1.3056 1.3056 2.4705 2.4705 3.0758 3.0758 3.2181 3.2181 3.5624 3.5624 4.7173 4.7173 4.9541 4.9541 5.3869 5.3869 5.5378 5.5378 8.7623 8.7623 8.9576 8.9576 9.5066 9.5066 9.7138 9.7138 k = 0.0927-0.3092-0.0000 ( 5283 PWs) bands (ev): -21.1699 -21.1699 -21.1583 -21.1583 -8.5177 -8.5177 -8.2125 -8.2125 -7.7234 -7.7234 -7.4982 -7.4982 -5.8986 -5.8986 -5.8216 -5.8216 -5.7545 -5.7545 -5.5598 -5.5598 -4.5624 -4.5624 -4.4755 -4.4755 1.2447 1.2447 1.2850 1.2850 2.4325 2.4325 3.1192 3.1192 3.2189 3.2189 3.5893 3.5893 4.7064 4.7064 4.9537 4.9537 5.3930 5.3930 5.5413 5.5413 8.7022 8.7022 8.9208 8.9208 9.5036 9.5036 9.7035 9.7035 k = 0.0850-0.2834-0.0000 ( 5295 PWs) bands (ev): -21.1703 -21.1703 -21.1585 -21.1585 -8.5288 -8.5288 -8.1984 -8.1984 -7.7307 -7.7307 -7.4974 -7.4974 -5.8885 -5.8885 -5.8195 -5.8195 -5.7601 -5.7601 -5.5479 -5.5479 -4.5591 -4.5591 -4.4713 -4.4713 1.2268 1.2268 1.2667 1.2667 2.3966 2.3966 3.1560 3.1560 3.2255 3.2255 3.6160 3.6160 4.6949 4.6949 4.9540 4.9540 5.3928 5.3928 5.5498 5.5498 8.6467 8.6467 8.8854 8.8854 9.4999 9.4999 9.6934 9.6934 k = 0.0773-0.2576-0.0000 ( 5295 PWs) bands (ev): -21.1706 -21.1706 -21.1586 -21.1586 -8.5393 -8.5393 -8.1839 -8.1839 -7.7391 -7.7391 -7.4960 -7.4960 -5.8793 -5.8793 -5.8180 -5.8180 -5.7655 -5.7655 -5.5356 -5.5356 -4.5564 -4.5564 -4.4672 -4.4672 1.2097 1.2097 1.2504 1.2504 2.3632 2.3632 3.1779 3.1779 3.2458 3.2458 3.6422 3.6422 4.6831 4.6831 4.9544 4.9544 5.3878 5.3878 5.5622 5.5622 8.5958 8.5958 8.8529 8.8529 9.4968 9.4968 9.6693 9.6693 k = 0.0695-0.2319-0.0000 ( 5301 PWs) bands (ev): -21.1709 -21.1709 -21.1588 -21.1588 -8.5490 -8.5490 -8.1693 -8.1693 -7.7485 -7.7485 -7.4942 -7.4942 -5.8709 -5.8709 -5.8173 -5.8173 -5.7705 -5.7705 -5.5234 -5.5234 -4.5543 -4.5543 -4.4634 -4.4634 1.1937 1.1937 1.2362 1.2362 2.3324 2.3324 3.1852 3.1852 3.2788 3.2788 3.6676 3.6676 4.6714 4.6714 4.9547 4.9547 5.3794 5.3794 5.5767 5.5767 8.5498 8.5498 8.8248 8.8248 9.4949 9.4949 9.6212 9.6212 k = 0.0618-0.2061-0.0000 ( 5295 PWs) bands (ev): -21.1712 -21.1712 -21.1589 -21.1589 -8.5578 -8.5578 -8.1548 -8.1548 -7.7585 -7.7585 -7.4922 -7.4922 -5.8633 -5.8633 -5.8172 -5.8172 -5.7749 -5.7749 -5.5116 -5.5116 -4.5527 -4.5527 -4.4598 -4.4598 1.1790 1.1790 1.2239 1.2239 2.3044 2.3044 3.1867 3.1867 3.3155 3.3155 3.6919 3.6919 4.6601 4.6601 4.9548 4.9548 5.3693 5.3693 5.5919 5.5919 8.5086 8.5086 8.8021 8.8021 9.4920 9.4920 9.5579 9.5579 k = 0.0541-0.1803-0.0000 ( 5295 PWs) bands (ev): -21.1715 -21.1715 -21.1591 -21.1591 -8.5657 -8.5657 -8.1407 -8.1407 -7.7689 -7.7689 -7.4902 -7.4902 -5.8565 -5.8565 -5.8177 -5.8177 -5.7786 -5.7786 -5.5004 -5.5004 -4.5515 -4.5515 -4.4566 -4.4566 1.1658 1.1658 1.2132 1.2132 2.2793 2.2793 3.1864 3.1864 3.3512 3.3512 3.7148 3.7148 4.6494 4.6494 4.9543 4.9543 5.3585 5.3585 5.6068 5.6068 8.4724 8.4724 8.7857 8.7857 9.4613 9.4613 9.5162 9.5162 k = 0.0464-0.1546-0.0000 ( 5297 PWs) bands (ev): -21.1717 -21.1717 -21.1592 -21.1592 -8.5727 -8.5727 -8.1272 -8.1272 -7.7792 -7.7792 -7.4882 -7.4882 -5.8505 -5.8505 -5.8188 -5.8188 -5.7815 -5.7815 -5.4902 -5.4902 -4.5507 -4.5507 -4.4537 -4.4537 1.1541 1.1541 1.2041 1.2041 2.2574 2.2574 3.1855 3.1855 3.3841 3.3841 3.7358 3.7358 4.6395 4.6395 4.9534 4.9534 5.3478 5.3478 5.6207 5.6207 8.4411 8.4411 8.7759 8.7759 9.3897 9.3897 9.5170 9.5170 k = 0.0386-0.1288-0.0000 ( 5305 PWs) bands (ev): -21.1719 -21.1719 -21.1593 -21.1593 -8.5787 -8.5787 -8.1147 -8.1147 -7.7891 -7.7891 -7.4863 -7.4863 -5.8453 -5.8453 -5.8203 -5.8203 -5.7837 -5.7837 -5.4811 -5.4811 -4.5502 -4.5502 -4.4512 -4.4512 1.1441 1.1441 1.1964 1.1964 2.2386 2.2386 3.1844 3.1844 3.4134 3.4134 3.7547 3.7547 4.6308 4.6308 4.9522 4.9522 5.3379 5.3379 5.6330 5.6330 8.4147 8.4147 8.7729 8.7729 9.3154 9.3154 9.5264 9.5264 k = 0.0309-0.1031-0.0000 ( 5307 PWs) bands (ev): -21.1721 -21.1721 -21.1594 -21.1594 -8.5836 -8.5836 -8.1035 -8.1035 -7.7982 -7.7982 -7.4847 -7.4847 -5.8409 -5.8409 -5.8220 -5.8220 -5.7853 -5.7853 -5.4734 -5.4734 -4.5499 -4.5499 -4.4492 -4.4492 1.1358 1.1358 1.1903 1.1903 2.2231 2.2231 3.1834 3.1834 3.4382 3.4382 3.7709 3.7709 4.6233 4.6233 4.9507 4.9507 5.3291 5.3291 5.6435 5.6435 8.3931 8.3931 8.7763 8.7763 9.2457 9.2457 9.5397 9.5397 k = 0.0232-0.0773-0.0000 ( 5317 PWs) bands (ev): -21.1722 -21.1722 -21.1594 -21.1594 -8.5874 -8.5874 -8.0941 -8.0941 -7.8060 -7.8060 -7.4834 -7.4834 -5.8373 -5.8373 -5.8238 -5.8238 -5.7863 -5.7863 -5.4673 -5.4673 -4.5497 -4.5497 -4.4475 -4.4475 1.1294 1.1294 1.1855 1.1855 2.2110 2.2110 3.1826 3.1826 3.4580 3.4580 3.7841 3.7841 4.6172 4.6172 4.9493 4.9493 5.3219 5.3219 5.6519 5.6519 8.3764 8.3764 8.7850 8.7850 9.1842 9.1842 9.5557 9.5557 k = 0.0155-0.0515-0.0000 ( 5319 PWs) bands (ev): -21.1723 -21.1723 -21.1595 -21.1595 -8.5902 -8.5902 -8.0870 -8.0870 -7.8120 -7.8120 -7.4824 -7.4824 -5.8344 -5.8344 -5.8255 -5.8255 -5.7870 -5.7870 -5.4628 -5.4628 -4.5496 -4.5496 -4.4463 -4.4463 1.1247 1.1247 1.1821 1.1821 2.2022 2.2022 3.1819 3.1819 3.4725 3.4725 3.7939 3.7939 4.6127 4.6127 4.9480 4.9480 5.3166 5.3166 5.6580 5.6580 8.3645 8.3645 8.7965 8.7965 9.1341 9.1341 9.5731 9.5731 k = 0.0077-0.0258-0.0000 ( 5321 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5918 -8.5918 -8.0825 -8.0825 -7.8158 -7.8158 -7.4818 -7.4818 -5.8322 -5.8322 -5.8270 -5.8270 -5.7874 -5.7874 -5.4600 -5.4600 -4.5496 -4.5496 -4.4456 -4.4456 1.1219 1.1219 1.1801 1.1801 2.1970 2.1970 3.1815 3.1815 3.4813 3.4813 3.7999 3.7999 4.6100 4.6100 4.9472 4.9472 5.3133 5.3133 5.6617 5.6617 8.3573 8.3573 8.8070 8.8070 9.1003 9.1003 9.5902 9.5902 k = 0.0000 0.0000 0.0000 ( 5333 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5924 -8.5924 -8.0810 -8.0810 -7.8171 -7.8171 -7.4816 -7.4816 -5.8312 -5.8312 -5.8278 -5.8278 -5.7875 -5.7875 -5.4591 -5.4591 -4.5495 -4.5495 -4.4454 -4.4454 1.1210 1.1210 1.1794 1.1794 2.1952 2.1952 3.1814 3.1814 3.4843 3.4843 3.8019 3.8019 4.6091 4.6091 4.9469 4.9469 5.3121 5.3121 5.6630 5.6630 8.3549 8.3549 8.8114 8.8114 9.0881 9.0881 9.6000 9.6000 k = 0.0000 0.0000 0.0000 ( 5333 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5924 -8.5924 -8.0810 -8.0810 -7.8171 -7.8171 -7.4816 -7.4816 -5.8312 -5.8312 -5.8278 -5.8278 -5.7875 -5.7875 -5.4591 -5.4591 -4.5495 -4.5495 -4.4454 -4.4454 1.1210 1.1210 1.1794 1.1794 2.1952 2.1952 3.1814 3.1814 3.4843 3.4843 3.8019 3.8019 4.6091 4.6091 4.9469 4.9469 5.3121 5.3121 5.6630 5.6630 8.3549 8.3549 8.8114 8.8114 9.0881 9.0881 9.6000 9.6000 k = 0.0132-0.0200-0.0119 ( 5323 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5919 -8.5919 -8.0822 -8.0822 -7.8160 -7.8160 -7.4818 -7.4818 -5.8321 -5.8321 -5.8272 -5.8272 -5.7874 -5.7874 -5.4599 -5.4599 -4.5495 -4.5495 -4.4459 -4.4459 1.1221 1.1221 1.1806 1.1806 2.1971 2.1971 3.1814 3.1814 3.4822 3.4822 3.8002 3.8002 4.6098 4.6098 4.9475 4.9475 5.3124 5.3124 5.6618 5.6618 8.3566 8.3566 8.8082 8.8082 9.0969 9.0969 9.5875 9.5875 k = 0.0263-0.0399-0.0238 ( 5319 PWs) bands (ev): -21.1723 -21.1723 -21.1595 -21.1595 -8.5904 -8.5904 -8.0859 -8.0859 -7.8128 -7.8128 -7.4822 -7.4822 -5.8342 -5.8342 -5.8262 -5.8262 -5.7871 -5.7871 -5.4621 -5.4621 -4.5496 -4.5496 -4.4473 -4.4473 1.1252 1.1252 1.1845 1.1845 2.2025 2.2025 3.1815 3.1815 3.4759 3.4759 3.7950 3.7950 4.6119 4.6119 4.9491 4.9491 5.3132 5.3132 5.6584 5.6584 8.3615 8.3615 8.8001 8.8001 9.1214 9.1214 9.5633 9.5633 k = 0.0395-0.0599-0.0357 ( 5315 PWs) bands (ev): -21.1722 -21.1722 -21.1595 -21.1595 -8.5878 -8.5878 -8.0917 -8.0917 -7.8076 -7.8076 -7.4830 -7.4830 -5.8371 -5.8371 -5.8251 -5.8251 -5.7865 -5.7865 -5.4659 -5.4659 -4.5498 -4.5498 -4.4496 -4.4496 1.1293 1.1293 1.1921 1.1921 2.2116 2.2116 3.1816 3.1816 3.4657 3.4657 3.7866 3.7866 4.6153 4.6153 4.9518 4.9518 5.3145 5.3145 5.6527 5.6527 8.3696 8.3696 8.7905 8.7905 9.1574 9.1574 9.5361 9.5361 k = 0.0526-0.0799-0.0476 ( 5309 PWs) bands (ev): -21.1721 -21.1721 -21.1594 -21.1594 -8.5843 -8.5843 -8.0994 -8.0994 -7.8009 -7.8009 -7.4841 -7.4841 -5.8408 -5.8408 -5.8240 -5.8240 -5.7855 -5.7855 -5.4711 -5.4711 -4.5504 -4.5504 -4.4523 -4.4523 1.1333 1.1333 1.2043 1.2043 2.2242 2.2242 3.1817 3.1817 3.4515 3.4515 3.7751 3.7751 4.6198 4.6198 4.9554 4.9554 5.3163 5.3163 5.6451 5.6451 8.3809 8.3809 8.7824 8.7824 9.2002 9.2002 9.5103 9.5103 k = 0.0658-0.0998-0.0595 ( 5307 PWs) bands (ev): -21.1719 -21.1719 -21.1594 -21.1594 -8.5799 -8.5799 -8.1087 -8.1087 -7.7930 -7.7930 -7.4854 -7.4854 -5.8453 -5.8453 -5.8230 -5.8230 -5.7842 -5.7842 -5.4776 -5.4776 -4.5518 -4.5518 -4.4552 -4.4552 1.1363 1.1363 1.2219 1.2219 2.2402 2.2402 3.1817 3.1817 3.4337 3.4337 3.7609 3.7609 4.6252 4.6252 4.9598 4.9598 5.3187 5.3187 5.6355 5.6355 8.3954 8.3954 8.7778 8.7778 9.2438 9.2438 9.4909 9.4909 k = 0.0789-0.1198-0.0714 ( 5302 PWs) bands (ev): -21.1717 -21.1717 -21.1593 -21.1593 -8.5745 -8.5745 -8.1192 -8.1192 -7.7842 -7.7842 -7.4868 -7.4868 -5.8507 -5.8507 -5.8222 -5.8222 -5.7824 -5.7824 -5.4855 -5.4855 -4.5545 -4.5545 -4.4577 -4.4577 1.1381 1.1381 1.2451 1.2451 2.2596 2.2596 3.1816 3.1816 3.4126 3.4126 3.7444 3.7444 4.6313 4.6313 4.9647 4.9647 5.3217 5.3217 5.6243 5.6243 8.4128 8.4128 8.7776 8.7776 9.2792 9.2792 9.4859 9.4859 k = 0.0921-0.1398-0.0833 ( 5301 PWs) bands (ev): -21.1715 -21.1715 -21.1593 -21.1593 -8.5681 -8.5681 -8.1306 -8.1306 -7.7749 -7.7749 -7.4884 -7.4884 -5.8568 -5.8568 -5.8218 -5.8218 -5.7801 -5.7801 -5.4944 -5.4944 -4.5588 -4.5588 -4.4594 -4.4594 1.1391 1.1391 1.2735 1.2735 2.2822 2.2822 3.1812 3.1812 3.3886 3.3886 3.7259 3.7259 4.6376 4.6376 4.9701 4.9701 5.3253 5.3253 5.6119 5.6119 8.4332 8.4332 8.7822 8.7822 9.2959 9.2959 9.5053 9.5053 k = 0.1053-0.1597-0.0952 ( 5304 PWs) bands (ev): -21.1713 -21.1713 -21.1592 -21.1592 -8.5610 -8.5610 -8.1425 -8.1425 -7.7654 -7.7654 -7.4900 -7.4900 -5.8637 -5.8637 -5.8218 -5.8218 -5.7771 -5.7771 -5.5044 -5.5044 -4.5651 -4.5651 -4.4599 -4.4599 1.1393 1.1393 1.3068 1.3068 2.3078 2.3078 3.1801 3.1801 3.3625 3.3625 3.7058 3.7058 4.6440 4.6440 4.9758 4.9758 5.3294 5.3294 5.5985 5.5985 8.4564 8.4564 8.7913 8.7913 9.2928 9.2928 9.5484 9.5484 k = 0.1184-0.1797-0.1071 ( 5303 PWs) bands (ev): -21.1710 -21.1710 -21.1591 -21.1591 -8.5530 -8.5530 -8.1548 -8.1548 -7.7560 -7.7560 -7.4915 -7.4915 -5.8714 -5.8714 -5.8223 -5.8223 -5.7736 -5.7736 -5.5152 -5.5152 -4.5736 -4.5736 -4.4589 -4.4589 1.1390 1.1390 1.3444 1.3444 2.3362 2.3362 3.1779 3.1779 3.3350 3.3350 3.6843 3.6843 4.6499 4.6499 4.9817 4.9817 5.3341 5.3341 5.5846 5.5846 8.4822 8.4822 8.8041 8.8041 9.2790 9.2790 9.6023 9.6023 k = 0.1316-0.1997-0.1190 ( 5292 PWs) bands (ev): -21.1707 -21.1707 -21.1590 -21.1590 -8.5443 -8.5443 -8.1672 -8.1672 -7.7470 -7.7470 -7.4929 -7.4929 -5.8799 -5.8799 -5.8234 -5.8234 -5.7695 -5.7695 -5.5267 -5.5267 -4.5841 -4.5841 -4.4564 -4.4564 1.1384 1.1384 1.3863 1.3863 2.3673 2.3673 3.1736 3.1736 3.3076 3.3076 3.6619 3.6619 4.6552 4.6552 4.9879 4.9879 5.3393 5.3393 5.5706 5.5706 8.5104 8.5104 8.8188 8.8188 9.2620 9.2620 9.6377 9.6377 k = 0.1447-0.2196-0.1309 ( 5289 PWs) bands (ev): -21.1704 -21.1704 -21.1590 -21.1590 -8.5350 -8.5350 -8.1796 -8.1796 -7.7386 -7.7386 -7.4939 -7.4939 -5.8891 -5.8891 -5.8251 -5.8251 -5.7649 -5.7649 -5.5385 -5.5385 -4.5965 -4.5965 -4.4527 -4.4527 1.1375 1.1375 1.4319 1.4319 2.4008 2.4008 3.1655 3.1655 3.2824 3.2824 3.6389 3.6389 4.6593 4.6593 4.9942 4.9942 5.3448 5.3448 5.5571 5.5571 8.5407 8.5407 8.8328 8.8328 9.2461 9.2461 9.6309 9.6309 k = 0.1579-0.2396-0.1428 ( 5289 PWs) bands (ev): -21.1700 -21.1700 -21.1589 -21.1589 -8.5251 -8.5251 -8.1916 -8.1916 -7.7312 -7.7312 -7.4944 -7.4944 -5.8991 -5.8991 -5.8275 -5.8275 -5.7600 -5.7600 -5.5505 -5.5505 -4.6104 -4.6104 -4.4480 -4.4480 1.1364 1.1364 1.4811 1.4811 2.4363 2.4363 3.1512 3.1512 3.2622 3.2622 3.6155 3.6155 4.6620 4.6620 5.0007 5.0007 5.3505 5.3505 5.5448 5.5448 8.5727 8.5727 8.8425 8.8425 9.2348 9.2348 9.6099 9.6099 k = 0.1711-0.2595-0.1547 ( 5284 PWs) bands (ev): -21.1696 -21.1696 -21.1588 -21.1588 -8.5148 -8.5148 -8.2031 -8.2031 -7.7249 -7.7249 -7.4943 -7.4943 -5.9097 -5.9097 -5.8306 -5.8306 -5.7549 -5.7549 -5.5624 -5.5624 -4.6256 -4.6256 -4.4424 -4.4424 1.1352 1.1352 1.5337 1.5337 2.4735 2.4735 3.1295 3.1295 3.2488 3.2488 3.5920 3.5920 4.6629 4.6629 5.0074 5.0074 5.3559 5.3559 5.5343 5.5343 8.6054 8.6054 8.8432 8.8432 9.2313 9.2313 9.5861 9.5861 k = 0.1842-0.2795-0.1666 ( 5287 PWs) bands (ev): -21.1692 -21.1692 -21.1587 -21.1587 -8.5043 -8.5043 -8.2138 -8.2138 -7.7199 -7.7199 -7.4935 -7.4935 -5.9211 -5.9211 -5.8345 -5.8345 -5.7499 -5.7499 -5.5737 -5.5737 -4.6418 -4.6418 -4.4362 -4.4362 1.1339 1.1339 1.5892 1.5892 2.5120 2.5120 3.1014 3.1014 3.2414 3.2414 3.5688 3.5688 4.6621 4.6621 5.0144 5.0144 5.3607 5.3607 5.5264 5.5264 8.6372 8.6372 8.8315 8.8315 9.2380 9.2380 9.5647 9.5647 k = 0.1974-0.2995-0.1785 ( 5285 PWs) bands (ev): -21.1688 -21.1688 -21.1586 -21.1586 -8.4937 -8.4937 -8.2236 -8.2236 -7.7164 -7.7164 -7.4917 -7.4917 -5.9331 -5.9331 -5.8391 -5.8391 -5.7451 -5.7451 -5.5841 -5.5841 -4.6587 -4.6587 -4.4296 -4.4296 1.1324 1.1324 1.6475 1.6475 2.5512 2.5512 3.0694 3.0694 3.2382 3.2382 3.5460 3.5460 4.6593 4.6593 5.0215 5.0215 5.3643 5.3643 5.5218 5.5218 8.6627 8.6627 8.8098 8.8098 9.2546 9.2546 9.5499 9.5499 k = 0.2105-0.3194-0.1904 ( 5280 PWs) bands (ev): -21.1684 -21.1684 -21.1585 -21.1585 -8.4834 -8.4834 -8.2322 -8.2322 -7.7146 -7.7146 -7.4891 -7.4891 -5.9458 -5.9458 -5.8445 -5.8445 -5.7409 -5.7409 -5.5932 -5.5932 -4.6762 -4.6762 -4.4226 -4.4226 1.1309 1.1309 1.7083 1.7083 2.5904 2.5904 3.0360 3.0360 3.2374 3.2374 3.5240 3.5240 4.6546 4.6546 5.0286 5.0286 5.3664 5.3664 5.5213 5.5213 8.6650 8.6650 8.7948 8.7948 9.2782 9.2782 9.5459 9.5459 k = 0.2237-0.3394-0.2023 ( 5288 PWs) bands (ev): -21.1679 -21.1679 -21.1584 -21.1584 -8.4735 -8.4735 -8.2391 -8.2391 -7.7144 -7.7144 -7.4854 -7.4854 -5.9593 -5.9593 -5.8507 -5.8507 -5.7374 -5.7374 -5.6005 -5.6005 -4.6940 -4.6940 -4.4154 -4.4154 1.1293 1.1293 1.7713 1.7713 2.6285 2.6285 3.0029 3.0029 3.2380 3.2380 3.5032 3.5032 4.6484 4.6484 5.0355 5.0355 5.3671 5.3671 5.5248 5.5248 8.6247 8.6247 8.8075 8.8075 9.3041 9.3041 9.5560 9.5560 k = 0.2368-0.3594-0.2142 ( 5286 PWs) bands (ev): -21.1675 -21.1675 -21.1583 -21.1583 -8.4646 -8.4646 -8.2441 -8.2441 -7.7158 -7.7158 -7.4808 -7.4808 -5.9734 -5.9734 -5.8577 -5.8577 -5.7349 -5.7349 -5.6057 -5.6057 -4.7120 -4.7120 -4.4082 -4.4082 1.1277 1.1277 1.8362 1.8362 2.6638 2.6638 2.9722 2.9722 3.2393 3.2393 3.4839 3.4839 4.6408 4.6408 5.0417 5.0417 5.3669 5.3669 5.5323 5.5323 8.5540 8.5540 8.8379 8.8379 9.3289 9.3289 9.5815 9.5815 k = 0.2500-0.3793-0.2261 ( 5286 PWs) bands (ev): -21.1670 -21.1670 -21.1582 -21.1582 -8.4569 -8.4569 -8.2468 -8.2468 -7.7189 -7.7189 -7.4754 -7.4754 -5.9881 -5.9881 -5.8654 -5.8654 -5.7335 -5.7335 -5.6086 -5.6086 -4.7300 -4.7300 -4.4009 -4.4009 1.1260 1.1260 1.9028 1.9028 2.6938 2.6938 2.9465 2.9465 3.2407 3.2407 3.4667 3.4667 4.6323 4.6323 5.0469 5.0469 5.3664 5.3664 5.5432 5.5432 8.4672 8.4672 8.8742 8.8742 9.3516 9.3516 9.6212 9.6212 k = 0.2632-0.3993-0.2380 ( 5289 PWs) bands (ev): -21.1666 -21.1666 -21.1581 -21.1581 -8.4508 -8.4508 -8.2469 -8.2469 -7.7235 -7.7235 -7.4692 -7.4692 -6.0036 -6.0036 -5.8738 -5.8738 -5.7332 -5.7332 -5.6092 -5.6092 -4.7479 -4.7479 -4.3936 -4.3936 1.1242 1.1242 1.9707 1.9707 2.7143 2.7143 2.9298 2.9298 3.2418 3.2418 3.4521 3.4521 4.6233 4.6233 5.0508 5.0508 5.3664 5.3664 5.5568 5.5568 8.3704 8.3704 8.9119 8.9119 9.3736 9.3736 9.6718 9.6718 k = 0.2763-0.4193-0.2499 ( 5289 PWs) bands (ev): -21.1661 -21.1661 -21.1580 -21.1580 -8.4465 -8.4465 -8.2441 -8.2441 -7.7294 -7.7294 -7.4625 -7.4625 -6.0196 -6.0196 -5.8826 -5.8826 -5.7338 -5.7338 -5.6076 -5.6076 -4.7656 -4.7656 -4.3865 -4.3865 1.1224 1.1224 2.0396 2.0396 2.7210 2.7210 2.9262 2.9262 3.2419 3.2419 3.4406 3.4406 4.6142 4.6142 5.0530 5.0530 5.3677 5.3677 5.5725 5.5725 8.2669 8.2669 8.9492 8.9492 9.3963 9.3963 9.7295 9.7295 k = 0.2895-0.4392-0.2618 ( 5291 PWs) bands (ev): -21.1657 -21.1657 -21.1579 -21.1579 -8.4441 -8.4441 -8.2384 -8.2384 -7.7367 -7.7367 -7.4553 -7.4553 -6.0361 -6.0361 -5.8918 -5.8918 -5.7351 -5.7351 -5.6043 -5.6043 -4.7829 -4.7829 -4.3796 -4.3796 1.1205 1.1205 2.1093 2.1093 2.7133 2.7133 2.9359 2.9359 3.2407 3.2407 3.4329 3.4329 4.6057 4.6057 5.0535 5.0535 5.3705 5.3705 5.5896 5.5896 8.1589 8.1589 8.9848 8.9848 9.4209 9.4209 9.7913 9.7913 k = 0.3026-0.4592-0.2736 ( 5296 PWs) bands (ev): -21.1652 -21.1652 -21.1578 -21.1578 -8.4434 -8.4434 -8.2300 -8.2300 -7.7451 -7.7451 -7.4477 -7.4477 -6.0530 -6.0530 -5.9011 -5.9011 -5.7368 -5.7368 -5.5996 -5.5996 -4.7998 -4.7998 -4.3729 -4.3729 1.1187 1.1187 2.1794 2.1794 2.6954 2.6954 2.9544 2.9544 3.2378 3.2378 3.4291 3.4291 4.5981 4.5981 5.0524 5.0524 5.3751 5.3751 5.6079 5.6079 8.0483 8.0483 9.0179 9.0179 9.4479 9.4479 9.8545 9.8545 k = 0.3158-0.4792-0.2855 ( 5298 PWs) bands (ev): -21.1648 -21.1648 -21.1578 -21.1578 -8.4443 -8.4443 -8.2191 -8.2191 -7.7546 -7.7546 -7.4400 -7.4400 -6.0703 -6.0703 -5.9103 -5.9103 -5.7388 -5.7388 -5.5939 -5.5939 -4.8162 -4.8162 -4.3665 -4.3665 1.1168 1.1168 2.2495 2.2495 2.6722 2.6722 2.9765 2.9765 3.2331 3.2331 3.4293 3.4293 4.5918 4.5918 5.0498 5.0498 5.3814 5.3814 5.6268 5.6268 7.9364 7.9364 9.0479 9.0479 9.4771 9.4771 9.9167 9.9167 k = 0.3289-0.4991-0.2974 ( 5301 PWs) bands (ev): -21.1643 -21.1643 -21.1577 -21.1577 -8.4464 -8.4464 -8.2061 -8.2061 -7.7650 -7.7650 -7.4323 -7.4323 -6.0876 -6.0876 -5.9193 -5.9193 -5.7408 -5.7408 -5.5876 -5.5876 -4.8319 -4.8319 -4.3604 -4.3604 1.1149 1.1149 2.3193 2.3193 2.6470 2.6470 2.9988 2.9988 3.2271 3.2271 3.4328 3.4328 4.5873 4.5873 5.0461 5.0461 5.3893 5.3893 5.6460 5.6460 7.8244 7.8244 9.0743 9.0743 9.5078 9.5078 9.9751 9.9751 k = 0.3421-0.5191-0.3093 ( 5300 PWs) bands (ev): -21.1639 -21.1639 -21.1577 -21.1577 -8.4493 -8.4493 -8.1914 -8.1914 -7.7762 -7.7762 -7.4246 -7.4246 -6.1048 -6.1048 -5.9280 -5.9280 -5.7427 -5.7427 -5.5808 -5.5808 -4.8469 -4.8469 -4.3547 -4.3547 1.1130 1.1130 2.3882 2.3882 2.6217 2.6217 3.0195 3.0195 3.2200 3.2200 3.4387 3.4387 4.5848 4.5848 5.0419 5.0419 5.3983 5.3983 5.6652 5.6652 7.7136 7.7136 9.0968 9.0968 9.5392 9.5392 10.0252 10.0252 k = 0.3553-0.5391-0.3212 ( 5300 PWs) bands (ev): -21.1635 -21.1635 -21.1576 -21.1576 -8.4527 -8.4527 -8.1755 -8.1755 -7.7883 -7.7883 -7.4171 -7.4171 -6.1218 -6.1218 -5.9362 -5.9362 -5.7445 -5.7445 -5.5738 -5.5738 -4.8611 -4.8611 -4.3493 -4.3493 1.1112 1.1112 2.4555 2.4555 2.5977 2.5977 3.0375 3.0375 3.2127 3.2127 3.4458 3.4458 4.5844 4.5844 5.0378 5.0378 5.4080 5.4080 5.6840 5.6840 7.6049 7.6049 9.1152 9.1152 9.5702 9.5702 10.0581 10.0581 k = 0.3684-0.5590-0.3331 ( 5302 PWs) bands (ev): -21.1631 -21.1631 -21.1576 -21.1576 -8.4564 -8.4564 -8.1585 -8.1585 -7.8010 -7.8010 -7.4098 -7.4098 -6.1383 -6.1383 -5.9438 -5.9438 -5.7461 -5.7461 -5.5669 -5.5669 -4.8744 -4.8744 -4.3443 -4.3443 1.1094 1.1094 2.5174 2.5174 2.5789 2.5789 3.0523 3.0523 3.2055 3.2055 3.4530 3.4530 4.5862 4.5862 5.0341 5.0341 5.4182 5.4182 5.7023 5.7023 7.4994 7.4994 9.1298 9.1298 9.6000 9.6000 10.0689 10.0689 k = 0.3816-0.5790-0.3450 ( 5305 PWs) bands (ev): -21.1627 -21.1627 -21.1576 -21.1576 -8.4602 -8.4602 -8.1407 -8.1407 -7.8145 -7.8145 -7.4029 -7.4029 -6.1540 -6.1540 -5.9509 -5.9509 -5.7476 -5.7476 -5.5602 -5.5602 -4.8867 -4.8867 -4.3398 -4.3398 1.1077 1.1077 2.5393 2.5393 2.6000 2.6000 3.0639 3.0639 3.1991 3.1991 3.4592 3.4592 4.5900 4.5900 5.0315 5.0315 5.4285 5.4285 5.7197 5.7197 7.3982 7.3982 9.1406 9.1406 9.6277 9.6277 10.0644 10.0644 k = 0.3947-0.5990-0.3569 ( 5301 PWs) bands (ev): -21.1624 -21.1624 -21.1576 -21.1576 -8.4639 -8.4639 -8.1224 -8.1224 -7.8285 -7.8285 -7.3965 -7.3965 -6.1688 -6.1688 -5.9573 -5.9573 -5.7489 -5.7489 -5.5537 -5.5537 -4.8980 -4.8980 -4.3357 -4.3357 1.1061 1.1061 2.5239 2.5239 2.6579 2.6579 3.0720 3.0720 3.1937 3.1937 3.4635 3.4635 4.5954 4.5954 5.0304 5.0304 5.4386 5.4386 5.7360 5.7360 7.3023 7.3023 9.1480 9.1480 9.6529 9.6529 10.0509 10.0509 k = 0.4079-0.6189-0.3688 ( 5310 PWs) bands (ev): -21.1621 -21.1621 -21.1576 -21.1576 -8.4674 -8.4674 -8.1039 -8.1039 -7.8430 -7.8430 -7.3906 -7.3906 -6.1824 -6.1824 -5.9630 -5.9630 -5.7500 -5.7500 -5.5478 -5.5478 -4.9082 -4.9082 -4.3320 -4.3320 1.1047 1.1047 2.5067 2.5067 2.7170 2.7170 3.0770 3.0770 3.1896 3.1896 3.4655 3.4655 4.6020 4.6020 5.0311 5.0311 5.4481 5.4481 5.7509 5.7509 7.2130 7.2130 9.1525 9.1525 9.6754 9.6754 10.0326 10.0326 k = 0.4211-0.6389-0.3807 ( 5314 PWs) bands (ev): -21.1618 -21.1618 -21.1576 -21.1576 -8.4705 -8.4705 -8.0852 -8.0852 -7.8580 -7.8580 -7.3853 -7.3853 -6.1946 -6.1946 -5.9680 -5.9680 -5.7510 -5.7510 -5.5423 -5.5423 -4.9172 -4.9172 -4.3288 -4.3288 1.1033 1.1033 2.4910 2.4910 2.7734 2.7734 3.0789 3.0789 3.1867 3.1867 3.4648 3.4648 4.6091 4.6091 5.0335 5.0335 5.4569 5.4569 5.7644 5.7644 7.1314 7.1314 9.1547 9.1547 9.6951 9.6951 10.0125 10.0125 k = 0.4342-0.6589-0.3926 ( 5313 PWs) bands (ev): -21.1615 -21.1615 -21.1576 -21.1576 -8.4733 -8.4733 -8.0666 -8.0666 -7.8733 -7.8733 -7.3807 -7.3807 -6.2053 -6.2053 -5.9723 -5.9723 -5.7517 -5.7517 -5.5376 -5.5376 -4.9249 -4.9249 -4.3261 -4.3261 1.1022 1.1022 2.4774 2.4774 2.8261 2.8261 3.0779 3.0779 3.1849 3.1849 3.4618 3.4618 4.6162 4.6162 5.0374 5.0374 5.4646 5.4646 5.7761 5.7761 7.0590 7.0590 9.1552 9.1552 9.7121 9.7121 9.9928 9.9928 k = 0.4474-0.6788-0.4045 ( 5310 PWs) bands (ev): -21.1613 -21.1613 -21.1576 -21.1576 -8.4757 -8.4757 -8.0483 -8.0483 -7.8888 -7.8888 -7.3768 -7.3768 -6.2143 -6.2143 -5.9758 -5.9758 -5.7524 -5.7524 -5.5336 -5.5336 -4.9313 -4.9313 -4.3238 -4.3238 1.1012 1.1012 2.4661 2.4661 2.8741 2.8741 3.0745 3.0745 3.1838 3.1838 3.4569 3.4569 4.6225 4.6225 5.0424 5.0424 5.4712 5.4712 5.7860 5.7860 6.9971 6.9971 9.1546 9.1546 9.7264 9.7264 9.9747 9.9747 k = 0.4605-0.6988-0.4164 ( 5311 PWs) bands (ev): -21.1611 -21.1611 -21.1576 -21.1576 -8.4775 -8.4775 -8.0307 -8.0307 -7.9042 -7.9042 -7.3738 -7.3738 -6.2215 -6.2215 -5.9785 -5.9785 -5.7529 -5.7529 -5.5304 -5.5304 -4.9364 -4.9364 -4.3221 -4.3221 1.1004 1.1004 2.4573 2.4573 2.9165 2.9165 3.0686 3.0686 3.1831 3.1831 3.4513 3.4513 4.6278 4.6278 5.0477 5.0477 5.4766 5.4766 5.7938 5.7938 6.9471 6.9471 9.1535 9.1535 9.7379 9.7379 9.9595 9.9595 k = 0.4737-0.7187-0.4283 ( 5309 PWs) bands (ev): -21.1610 -21.1610 -21.1577 -21.1577 -8.4789 -8.4789 -8.0146 -8.0146 -7.9186 -7.9186 -7.3715 -7.3715 -6.2267 -6.2267 -5.9804 -5.9804 -5.7532 -5.7532 -5.5280 -5.5280 -4.9400 -4.9400 -4.3208 -4.3208 1.0998 1.0998 2.4509 2.4509 2.9520 2.9520 3.0605 3.0605 3.1827 3.1827 3.4459 3.4459 4.6317 4.6317 5.0524 5.0524 5.4804 5.4804 5.7995 5.7995 6.9103 6.9103 9.1523 9.1523 9.7465 9.7465 9.9479 9.9479 k = 0.4868-0.7387-0.4402 ( 5303 PWs) bands (ev): -21.1609 -21.1609 -21.1577 -21.1577 -8.4797 -8.4797 -8.0018 -8.0018 -7.9304 -7.9304 -7.3702 -7.3702 -6.2298 -6.2298 -5.9816 -5.9816 -5.7534 -5.7534 -5.5266 -5.5266 -4.9422 -4.9422 -4.3201 -4.3201 1.0995 1.0995 2.4470 2.4470 2.9784 2.9784 3.0512 3.0512 3.1824 3.1824 3.4421 3.4421 4.6341 4.6341 5.0556 5.0556 5.4828 5.4828 5.8029 5.8029 6.8877 6.8877 9.1514 9.1514 9.7519 9.7519 9.9406 9.9406 k = 0.5000-0.7587-0.4521 ( 5302 PWs) bands (ev): -21.1609 -21.1609 -21.1577 -21.1577 -8.4800 -8.4800 -7.9965 -7.9965 -7.9354 -7.9354 -7.3697 -7.3697 -6.2309 -6.2309 -5.9820 -5.9820 -5.7535 -5.7535 -5.5261 -5.5261 -4.9429 -4.9429 -4.3198 -4.3198 1.0994 1.0994 2.4458 2.4458 2.9893 2.9893 3.0461 3.0461 3.1823 3.1823 3.4407 3.4407 4.6349 4.6349 5.0567 5.0567 5.4836 5.4836 5.8041 5.8041 6.8801 6.8801 9.1511 9.1511 9.7537 9.7537 9.9382 9.9382 k = 0.5000-0.7587 0.4229 ( 5298 PWs) bands (ev): -21.1619 -21.1619 -21.1566 -21.1566 -8.4371 -8.4371 -8.2080 -8.2080 -7.5864 -7.5864 -7.5693 -7.5693 -6.0513 -6.0513 -5.9941 -5.9941 -5.7889 -5.7889 -5.7342 -5.7342 -4.8492 -4.8492 -4.3154 -4.3154 1.0946 1.0946 2.5514 2.5514 2.9507 2.9507 3.0342 3.0342 3.2093 3.2093 3.3023 3.3023 4.6343 4.6343 5.2144 5.2144 5.4457 5.4457 5.7493 5.7493 6.9201 6.9201 8.7626 8.7626 9.8638 9.8638 10.0085 10.0085 k = 0.4865-0.7382 0.4115 ( 5295 PWs) bands (ev): -21.1619 -21.1619 -21.1566 -21.1566 -8.4370 -8.4370 -8.2083 -8.2083 -7.5892 -7.5892 -7.5667 -7.5667 -6.0533 -6.0533 -5.9913 -5.9913 -5.7890 -5.7890 -5.7332 -5.7332 -4.8493 -4.8493 -4.3157 -4.3157 1.0948 1.0948 2.5514 2.5514 2.9424 2.9424 3.0378 3.0378 3.2121 3.2121 3.3015 3.3015 4.6337 4.6337 5.2113 5.2113 5.4456 5.4456 5.7487 5.7487 6.9279 6.9279 8.7638 8.7638 9.8557 9.8557 10.0120 10.0120 k = 0.4730-0.7177 0.4001 ( 5291 PWs) bands (ev): -21.1620 -21.1620 -21.1566 -21.1566 -8.4368 -8.4368 -8.2093 -8.2093 -7.5952 -7.5952 -7.5614 -7.5614 -6.0582 -6.0582 -5.9840 -5.9840 -5.7892 -5.7892 -5.7300 -5.7300 -4.8493 -4.8493 -4.3165 -4.3165 1.0951 1.0951 2.5514 2.5514 2.9213 2.9213 3.0453 3.0453 3.2198 3.2198 3.2992 3.2992 4.6319 4.6319 5.2023 5.2023 5.4450 5.4450 5.7470 5.7470 6.9511 6.9511 8.7675 8.7675 9.8342 9.8342 10.0198 10.0198 k = 0.4595-0.6972 0.3887 ( 5296 PWs) bands (ev): -21.1621 -21.1621 -21.1567 -21.1567 -8.4363 -8.4363 -8.2108 -8.2108 -7.6020 -7.6020 -7.5556 -7.5556 -6.0642 -6.0642 -5.9741 -5.9741 -5.7894 -5.7894 -5.7249 -5.7249 -4.8493 -4.8493 -4.3180 -4.3180 1.0957 1.0957 2.5510 2.5510 2.8929 2.8929 3.0528 3.0528 3.2303 3.2303 3.2964 3.2964 4.6292 4.6292 5.1884 5.1884 5.4436 5.4436 5.7440 5.7440 6.9889 6.9889 8.7737 8.7737 9.8035 9.8035 10.0271 10.0271 k = 0.4459-0.6767 0.3772 ( 5303 PWs) bands (ev): -21.1622 -21.1622 -21.1567 -21.1567 -8.4356 -8.4356 -8.2130 -8.2130 -7.6090 -7.6090 -7.5500 -7.5500 -6.0700 -6.0700 -5.9629 -5.9629 -5.7894 -5.7894 -5.7181 -5.7181 -4.8493 -4.8493 -4.3199 -4.3199 1.0966 1.0966 2.5496 2.5496 2.8606 2.8606 3.0590 3.0590 3.2393 3.2393 3.2958 3.2958 4.6260 4.6260 5.1708 5.1708 5.4411 5.4411 5.7397 5.7397 7.0404 7.0404 8.7823 8.7823 9.7671 9.7671 10.0300 10.0300 k = 0.4324-0.6562 0.3658 ( 5299 PWs) bands (ev): -21.1624 -21.1624 -21.1567 -21.1567 -8.4348 -8.4348 -8.2159 -8.2159 -7.6159 -7.6159 -7.5449 -7.5449 -6.0749 -6.0749 -5.9512 -5.9512 -5.7892 -5.7892 -5.7098 -5.7098 -4.8489 -4.8489 -4.3225 -4.3225 1.0977 1.0977 2.5463 2.5463 2.8268 2.8268 3.0635 3.0635 3.2416 3.2416 3.3016 3.3016 4.6225 4.6225 5.1510 5.1510 5.4372 5.4372 5.7340 5.7340 7.1042 7.1042 8.7932 8.7932 9.7268 9.7268 10.0255 10.0255 k = 0.4189-0.6356 0.3544 ( 5296 PWs) bands (ev): -21.1626 -21.1626 -21.1567 -21.1567 -8.4337 -8.4337 -8.2196 -8.2196 -7.6224 -7.6224 -7.5403 -7.5403 -6.0786 -6.0786 -5.9395 -5.9395 -5.7887 -5.7887 -5.7003 -5.7003 -4.8482 -4.8482 -4.3256 -4.3256 1.0990 1.0990 2.5390 2.5390 2.7944 2.7944 3.0660 3.0660 3.2358 3.2358 3.3146 3.3146 4.6194 4.6194 5.1301 5.1301 5.4319 5.4319 5.7269 5.7269 7.1791 7.1791 8.8064 8.8064 9.6838 9.6838 10.0112 10.0112 k = 0.4054-0.6151 0.3429 ( 5296 PWs) bands (ev): -21.1629 -21.1629 -21.1568 -21.1568 -8.4325 -8.4325 -8.2240 -8.2240 -7.6285 -7.6285 -7.5362 -7.5362 -6.0808 -6.0808 -5.9280 -5.9280 -5.7877 -5.7877 -5.6900 -5.6900 -4.8469 -4.8469 -4.3292 -4.3292 1.1005 1.1005 2.5254 2.5254 2.7664 2.7664 3.0658 3.0658 3.2254 3.2254 3.3316 3.3316 4.6170 4.6170 5.1091 5.1091 5.4250 5.4250 5.7185 5.7185 7.2636 7.2636 8.8218 8.8218 9.6392 9.6392 9.9853 9.9853 k = 0.3919-0.5946 0.3315 ( 5297 PWs) bands (ev): -21.1632 -21.1632 -21.1569 -21.1569 -8.4311 -8.4311 -8.2290 -8.2290 -7.6339 -7.6339 -7.5328 -7.5328 -6.0813 -6.0813 -5.9170 -5.9170 -5.7863 -5.7863 -5.6791 -5.6791 -4.8449 -4.8449 -4.3333 -4.3333 1.1022 1.1022 2.5027 2.5027 2.7459 2.7459 3.0618 3.0618 3.2139 3.2139 3.3500 3.3500 4.6157 4.6157 5.0887 5.0887 5.4170 5.4170 5.7087 5.7087 7.3563 7.3563 8.8392 8.8392 9.5934 9.5934 9.9475 9.9475 k = 0.3784-0.5741 0.3201 ( 5300 PWs) bands (ev): -21.1635 -21.1635 -21.1569 -21.1569 -8.4296 -8.4296 -8.2348 -8.2348 -7.6387 -7.6387 -7.5300 -7.5300 -6.0802 -6.0802 -5.9066 -5.9066 -5.7843 -5.7843 -5.6680 -5.6680 -4.8418 -4.8418 -4.3379 -4.3379 1.1041 1.1041 2.4695 2.4695 2.7347 2.7347 3.0523 3.0523 3.2039 3.2039 3.3687 3.3687 4.6158 4.6158 5.0697 5.0697 5.4078 5.4078 5.6978 5.6978 7.4559 7.4559 8.8585 8.8585 9.5468 9.5468 9.8995 9.8995 k = 0.3649-0.5536 0.3086 ( 5301 PWs) bands (ev): -21.1638 -21.1638 -21.1570 -21.1570 -8.4281 -8.4281 -8.2411 -8.2411 -7.6429 -7.6429 -7.5278 -7.5278 -6.0774 -6.0774 -5.8968 -5.8968 -5.7819 -5.7819 -5.6570 -5.6570 -4.8376 -4.8376 -4.3429 -4.3429 1.1062 1.1062 2.4267 2.4267 2.7323 2.7323 3.0361 3.0361 3.1974 3.1974 3.3872 3.3872 4.6174 4.6174 5.0524 5.0524 5.3980 5.3980 5.6858 5.6858 7.5612 7.5612 8.8794 8.8794 9.4997 9.4997 9.8436 9.8436 k = 0.3514-0.5331 0.2972 ( 5308 PWs) bands (ev): -21.1642 -21.1642 -21.1571 -21.1571 -8.4266 -8.4266 -8.2477 -8.2477 -7.6463 -7.6463 -7.5262 -7.5262 -6.0729 -6.0729 -5.8877 -5.8877 -5.7790 -5.7790 -5.6465 -5.6465 -4.8320 -4.8320 -4.3484 -4.3484 1.1084 1.1084 2.3763 2.3763 2.7369 2.7369 3.0131 3.0131 3.1950 3.1950 3.4052 3.4052 4.6206 4.6206 5.0370 5.0370 5.3879 5.3879 5.6729 5.6729 7.6709 7.6709 8.9018 8.9018 9.4521 9.4521 9.7828 9.7828 k = 0.3378-0.5126 0.2858 ( 5306 PWs) bands (ev): -21.1645 -21.1645 -21.1572 -21.1572 -8.4255 -8.4255 -8.2544 -8.2544 -7.6492 -7.6492 -7.5251 -7.5251 -6.0669 -6.0669 -5.8793 -5.8793 -5.7756 -5.7756 -5.6367 -5.6367 -4.8249 -4.8249 -4.3543 -4.3543 1.1107 1.1107 2.3203 2.3203 2.7468 2.7468 2.9843 2.9843 3.1961 3.1961 3.4225 3.4225 4.6253 4.6253 5.0236 5.0236 5.3778 5.3778 5.6593 5.6593 7.7838 7.7838 8.9255 8.9255 9.4039 9.4039 9.7195 9.7195 k = 0.3243-0.4921 0.2743 ( 5308 PWs) bands (ev): -21.1649 -21.1649 -21.1573 -21.1573 -8.4248 -8.4248 -8.2608 -8.2608 -7.6516 -7.6516 -7.5243 -7.5243 -6.0593 -6.0593 -5.8716 -5.8716 -5.7718 -5.7718 -5.6279 -5.6279 -4.8161 -4.8161 -4.3606 -4.3606 1.1132 1.1132 2.2603 2.2603 2.7603 2.7603 2.9515 2.9515 3.1997 3.1997 3.4393 3.4393 4.6313 4.6313 5.0121 5.0121 5.3681 5.3681 5.6452 5.6452 7.8988 7.8988 8.9503 8.9503 9.3548 9.3548 9.6561 9.6561 k = 0.3108-0.4716 0.2629 ( 5305 PWs) bands (ev): -21.1654 -21.1654 -21.1574 -21.1574 -8.4250 -8.4250 -8.2665 -8.2665 -7.6536 -7.6536 -7.5239 -7.5239 -6.0504 -6.0504 -5.8645 -5.8645 -5.7677 -5.7677 -5.6202 -5.6202 -4.8057 -4.8057 -4.3672 -4.3672 1.1157 1.1157 2.1974 2.1974 2.7755 2.7755 2.9170 2.9170 3.2048 3.2048 3.4555 3.4555 4.6384 4.6384 5.0024 5.0024 5.3595 5.3595 5.6307 5.6307 8.0144 8.0144 8.9764 8.9764 9.3043 9.3043 9.5944 9.5944 k = 0.2973-0.4511 0.2515 ( 5301 PWs) bands (ev): -21.1658 -21.1658 -21.1575 -21.1575 -8.4264 -8.4264 -8.2710 -8.2710 -7.6555 -7.6555 -7.5237 -7.5237 -6.0403 -6.0403 -5.8580 -5.8580 -5.7633 -5.7633 -5.6136 -5.6136 -4.7935 -4.7935 -4.3741 -4.3741 1.1182 1.1182 2.1326 2.1326 2.7883 2.7883 2.8855 2.8855 3.2107 3.2107 3.4713 3.4713 4.6463 4.6463 4.9943 4.9943 5.3521 5.3521 5.6162 5.6162 8.1292 8.1292 9.0038 9.0038 9.2519 9.2519 9.5362 9.5362 k = 0.2838-0.4306 0.2400 ( 5302 PWs) bands (ev): -21.1662 -21.1662 -21.1576 -21.1576 -8.4293 -8.4293 -8.2739 -8.2739 -7.6574 -7.6574 -7.5235 -7.5235 -6.0292 -6.0292 -5.8521 -5.8521 -5.7588 -5.7588 -5.6080 -5.6080 -4.7798 -4.7798 -4.3813 -4.3813 1.1208 1.1208 2.0665 2.0665 2.7863 2.7863 2.8699 2.8699 3.2168 3.2168 3.4868 3.4868 4.6547 4.6547 4.9875 4.9875 5.3465 5.3465 5.6020 5.6020 8.2414 8.2414 9.0330 9.0330 9.1973 9.1973 9.4831 9.4831 k = 0.2703-0.4101 0.2286 ( 5297 PWs) bands (ev): -21.1666 -21.1666 -21.1577 -21.1577 -8.4340 -8.4340 -8.2747 -8.2747 -7.6597 -7.6597 -7.5233 -7.5233 -6.0171 -6.0171 -5.8468 -5.8468 -5.7545 -5.7545 -5.6033 -5.6033 -4.7646 -4.7646 -4.3886 -4.3886 1.1233 1.1233 1.9998 1.9998 2.7599 2.7599 2.8798 2.8798 3.2228 3.2228 3.5022 3.5022 4.6631 4.6631 4.9816 4.9816 5.3428 5.3428 5.5882 5.5882 8.3488 8.3488 9.0639 9.0639 9.1411 9.1411 9.4360 9.4360 k = 0.2568-0.3896 0.2172 ( 5293 PWs) bands (ev): -21.1671 -21.1671 -21.1578 -21.1578 -8.4404 -8.4404 -8.2732 -8.2732 -7.6624 -7.6624 -7.5228 -7.5228 -6.0044 -6.0044 -5.8419 -5.8419 -5.7506 -5.7506 -5.5989 -5.5989 -4.7481 -4.7481 -4.3961 -4.3961 1.1258 1.1258 1.9329 1.9329 2.7218 2.7218 2.9033 2.9033 3.2283 3.2283 3.5177 3.5177 4.6712 4.6712 4.9765 4.9765 5.3412 5.3412 5.5753 5.5753 8.4489 8.4489 9.0740 9.0740 9.1069 9.1069 9.3960 9.3960 k = 0.2432-0.3691 0.2058 ( 5283 PWs) bands (ev): -21.1675 -21.1675 -21.1580 -21.1580 -8.4485 -8.4485 -8.2696 -8.2696 -7.6658 -7.6658 -7.5221 -7.5221 -5.9912 -5.9912 -5.8375 -5.8375 -5.7475 -5.7475 -5.5947 -5.5947 -4.7306 -4.7306 -4.4036 -4.4036 1.1282 1.1282 1.8664 1.8664 2.6800 2.6800 2.9321 2.9321 3.2332 3.2332 3.5333 3.5333 4.6784 4.6784 4.9720 4.9720 5.3415 5.3415 5.5636 5.5636 8.5389 8.5389 9.0177 9.0177 9.1415 9.1415 9.3643 9.3643 k = 0.2297-0.3486 0.1943 ( 5285 PWs) bands (ev): -21.1680 -21.1680 -21.1581 -21.1581 -8.4580 -8.4580 -8.2638 -8.2638 -7.6702 -7.6702 -7.5209 -7.5209 -5.9777 -5.9777 -5.8336 -5.8336 -5.7453 -5.7453 -5.5901 -5.5901 -4.7123 -4.7123 -4.4111 -4.4111 1.1306 1.1306 1.8007 1.8007 2.6372 2.6372 2.9638 2.9638 3.2375 3.2375 3.5493 3.5493 4.6844 4.6844 4.9682 4.9682 5.3434 5.3434 5.5538 5.5538 8.6157 8.6157 8.9573 8.9573 9.1815 9.1815 9.3442 9.3442 k = 0.2162-0.3281 0.1829 ( 5290 PWs) bands (ev): -21.1684 -21.1684 -21.1582 -21.1582 -8.4685 -8.4685 -8.2561 -8.2561 -7.6755 -7.6755 -7.5193 -7.5193 -5.9640 -5.9640 -5.8300 -5.8300 -5.7444 -5.7444 -5.5847 -5.5847 -4.6937 -4.6937 -4.4185 -4.4185 1.1328 1.1328 1.7363 1.7363 2.5945 2.5945 2.9974 2.9974 3.2414 3.2414 3.5656 3.5656 4.6887 4.6887 4.9650 4.9650 5.3461 5.3461 5.5463 5.5463 8.6771 8.6771 8.8977 8.8977 9.2141 9.2141 9.3450 9.3450 k = 0.2027-0.3076 0.1715 ( 5295 PWs) bands (ev): -21.1688 -21.1688 -21.1584 -21.1584 -8.4797 -8.4797 -8.2469 -8.2469 -7.6818 -7.6818 -7.5172 -7.5172 -5.9505 -5.9505 -5.8268 -5.8268 -5.7448 -5.7448 -5.5784 -5.5784 -4.6749 -4.6749 -4.4257 -4.4257 1.1348 1.1348 1.6736 1.6736 2.5524 2.5524 3.0318 3.0318 3.2451 3.2451 3.5824 3.5824 4.6909 4.6909 4.9626 4.9626 5.3491 5.3491 5.5417 5.5417 8.7209 8.7209 8.8418 8.8418 9.2269 9.2269 9.3777 9.3777 k = 0.1892-0.2871 0.1600 ( 5287 PWs) bands (ev): -21.1692 -21.1692 -21.1585 -21.1585 -8.4913 -8.4913 -8.2362 -8.2362 -7.6893 -7.6893 -7.5146 -7.5146 -5.9372 -5.9372 -5.8240 -5.8240 -5.7467 -5.7467 -5.5708 -5.5708 -4.6564 -4.6564 -4.4327 -4.4327 1.1367 1.1367 1.6130 1.6130 2.5114 2.5114 3.0660 3.0660 3.2493 3.2493 3.5997 3.5997 4.6909 4.6909 4.9610 4.9610 5.3515 5.3515 5.5406 5.5406 8.7376 8.7376 8.8009 8.8009 9.2258 9.2258 9.4333 9.4333 k = 0.1757-0.2666 0.1486 ( 5286 PWs) bands (ev): -21.1696 -21.1696 -21.1586 -21.1586 -8.5030 -8.5030 -8.2245 -8.2245 -7.6978 -7.6978 -7.5118 -7.5118 -5.9244 -5.9244 -5.8215 -5.8215 -5.7498 -5.7498 -5.5621 -5.5621 -4.6385 -4.6385 -4.4391 -4.4391 1.1385 1.1385 1.5549 1.5549 2.4719 2.4719 3.0988 3.0988 3.2549 3.2549 3.6174 3.6174 4.6887 4.6887 4.9601 4.9601 5.3526 5.3526 5.5431 5.5431 8.7070 8.7070 8.7976 8.7976 9.2223 9.2223 9.4967 9.4967 k = 0.1622-0.2461 0.1372 ( 5283 PWs) bands (ev): -21.1700 -21.1700 -21.1587 -21.1587 -8.5145 -8.5145 -8.2118 -8.2118 -7.7072 -7.7072 -7.5087 -7.5087 -5.9120 -5.9120 -5.8194 -5.8194 -5.7539 -5.7539 -5.5524 -5.5524 -4.6214 -4.6214 -4.4450 -4.4450 1.1400 1.1400 1.4997 1.4997 2.4342 2.4342 3.1281 3.1281 3.2637 3.2637 3.6355 3.6355 4.6844 4.6844 4.9598 4.9598 5.3522 5.3522 5.5492 5.5492 8.6599 8.6599 8.8040 8.8040 9.2209 9.2209 9.5587 9.5587 k = 0.1486-0.2256 0.1257 ( 5284 PWs) bands (ev): -21.1703 -21.1703 -21.1588 -21.1588 -8.5256 -8.5256 -8.1985 -8.1985 -7.7174 -7.7174 -7.5054 -7.5054 -5.9004 -5.9004 -5.8177 -5.8177 -5.7586 -5.7586 -5.5420 -5.5420 -4.6057 -4.6057 -4.4501 -4.4501 1.1413 1.1413 1.4476 1.4476 2.3985 2.3985 3.1516 3.1516 3.2775 3.2775 3.6539 3.6539 4.6783 4.6783 4.9597 4.9597 5.3503 5.3503 5.5583 5.5583 8.6129 8.6129 8.8062 8.8062 9.2228 9.2228 9.6124 9.6124 k = 0.1351-0.2050 0.1143 ( 5290 PWs) bands (ev): -21.1707 -21.1707 -21.1589 -21.1589 -8.5363 -8.5363 -8.1846 -8.1846 -7.7284 -7.7284 -7.5020 -7.5020 -5.8895 -5.8895 -5.8164 -5.8164 -5.7638 -5.7638 -5.5311 -5.5311 -4.5915 -4.5915 -4.4541 -4.4541 1.1423 1.1423 1.3992 1.3992 2.3651 2.3651 3.1677 3.1677 3.2975 3.2975 3.6724 3.6724 4.6709 4.6709 4.9595 4.9595 5.3472 5.3472 5.5696 5.5696 8.5687 8.5687 8.8038 8.8038 9.2279 9.2279 9.6440 9.6440 k = 0.1216-0.1845 0.1029 ( 5288 PWs) bands (ev): -21.1710 -21.1710 -21.1590 -21.1590 -8.5463 -8.5463 -8.1704 -8.1704 -7.7398 -7.7398 -7.4987 -7.4987 -5.8794 -5.8794 -5.8156 -5.8156 -5.7689 -5.7689 -5.5201 -5.5201 -4.5794 -4.5794 -4.4570 -4.4570 1.1429 1.1429 1.3547 1.3547 2.3343 2.3343 3.1771 3.1771 3.3225 3.3225 3.6909 3.6909 4.6626 4.6626 4.9592 4.9592 5.3432 5.3432 5.5825 5.5825 8.5282 8.5282 8.7987 8.7987 9.2349 9.2349 9.6301 9.6301 k = 0.1081-0.1640 0.0914 ( 5290 PWs) bands (ev): -21.1713 -21.1713 -21.1591 -21.1591 -8.5555 -8.5555 -8.1561 -8.1561 -7.7516 -7.7516 -7.4955 -7.4955 -5.8703 -5.8703 -5.8155 -5.8155 -5.7736 -5.7736 -5.5092 -5.5092 -4.5694 -4.5694 -4.4584 -4.4584 1.1431 1.1431 1.3144 1.3144 2.3061 2.3061 3.1819 3.1819 3.3500 3.3500 3.7093 3.7093 4.6539 4.6539 4.9584 4.9584 5.3386 5.3386 5.5960 5.5960 8.4918 8.4918 8.7926 8.7926 9.2415 9.2415 9.5942 9.5942 k = 0.0946-0.1435 0.0800 ( 5292 PWs) bands (ev): -21.1715 -21.1715 -21.1592 -21.1592 -8.5638 -8.5638 -8.1421 -8.1421 -7.7634 -7.7634 -7.4925 -7.4925 -5.8620 -5.8620 -5.8159 -5.8159 -5.7778 -5.7778 -5.4988 -5.4988 -4.5618 -4.5618 -4.4584 -4.4584 1.1428 1.1428 1.2789 1.2789 2.2808 2.2808 3.1839 3.1839 3.3777 3.3777 3.7271 3.7271 4.6451 4.6451 4.9572 4.9572 5.3339 5.3339 5.6094 5.6094 8.4597 8.4597 8.7873 8.7873 9.2439 9.2439 9.5547 9.5547 k = 0.0811-0.1230 0.0686 ( 5293 PWs) bands (ev): -21.1717 -21.1717 -21.1593 -21.1593 -8.5712 -8.5712 -8.1285 -8.1285 -7.7750 -7.7750 -7.4898 -7.4898 -5.8548 -5.8548 -5.8170 -5.8170 -5.7811 -5.7811 -5.4891 -5.4891 -4.5565 -4.5565 -4.4570 -4.4570 1.1417 1.1417 1.2485 1.2485 2.2585 2.2585 3.1844 3.1844 3.4038 3.4038 3.7442 3.7442 4.6366 4.6366 4.9556 4.9556 5.3291 5.3291 5.6222 5.6222 8.4318 8.4318 8.7842 8.7842 9.2369 9.2369 9.5237 9.5237 k = 0.0676-0.1025 0.0572 ( 5307 PWs) bands (ev): -21.1719 -21.1719 -21.1594 -21.1594 -8.5776 -8.5776 -8.1158 -8.1158 -7.7861 -7.7861 -7.4874 -7.4874 -5.8485 -5.8485 -5.8186 -5.8186 -5.7836 -5.7836 -5.4805 -5.4805 -4.5531 -4.5531 -4.4548 -4.4548 1.1394 1.1394 1.2236 1.2236 2.2394 2.2394 3.1840 3.1840 3.4273 3.4273 3.7600 3.7600 4.6289 4.6289 4.9537 4.9537 5.3246 5.3246 5.6338 5.6338 8.4082 8.4082 8.7842 8.7842 9.2168 9.2168 9.5099 9.5099 k = 0.0541-0.0820 0.0457 ( 5304 PWs) bands (ev): -21.1721 -21.1721 -21.1594 -21.1594 -8.5829 -8.5829 -8.1044 -8.1044 -7.7962 -7.7962 -7.4853 -7.4853 -5.8432 -5.8432 -5.8206 -5.8206 -5.7853 -5.7853 -5.4731 -5.4731 -4.5511 -4.5511 -4.4521 -4.4521 1.1358 1.1358 1.2049 1.2049 2.2237 2.2237 3.1834 3.1834 3.4473 3.4473 3.7740 3.7740 4.6221 4.6221 4.9517 4.9517 5.3204 5.3204 5.6439 5.6439 8.3890 8.3890 8.7876 8.7876 9.1857 9.1857 9.5143 9.5143 k = 0.0405-0.0615 0.0343 ( 5308 PWs) bands (ev): -21.1722 -21.1722 -21.1595 -21.1595 -8.5870 -8.5870 -8.0947 -8.0947 -7.8048 -7.8048 -7.4837 -7.4837 -5.8388 -5.8388 -5.8227 -5.8227 -5.7864 -5.7864 -5.4671 -5.4671 -4.5501 -4.5501 -4.4495 -4.4495 1.1310 1.1310 1.1921 1.1921 2.2113 2.2113 3.1826 3.1826 3.4633 3.4633 3.7857 3.7857 4.6166 4.6166 4.9498 4.9498 5.3170 5.3170 5.6521 5.6521 8.3741 8.3741 8.7940 8.7940 9.1506 9.1506 9.5321 9.5321 k = 0.0270-0.0410 0.0229 ( 5314 PWs) bands (ev): -21.1723 -21.1723 -21.1595 -21.1595 -8.5900 -8.5900 -8.0873 -8.0873 -7.8114 -7.8114 -7.4825 -7.4825 -5.8353 -5.8353 -5.8248 -5.8248 -5.7871 -5.7871 -5.4627 -5.4627 -4.5497 -4.5497 -4.4473 -4.4473 1.1261 1.1261 1.1845 1.1845 2.2024 2.2024 3.1820 3.1820 3.4749 3.4749 3.7946 3.7946 4.6125 4.6125 4.9483 4.9483 5.3144 5.3144 5.6581 5.6581 8.3634 8.3634 8.8019 8.8019 9.1186 9.1186 9.5575 9.5575 k = 0.0135-0.0205 0.0114 ( 5321 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5918 -8.5918 -8.0826 -8.0826 -7.8157 -7.8157 -7.4818 -7.4818 -5.8325 -5.8325 -5.8267 -5.8267 -5.7874 -5.7874 -5.4600 -5.4600 -4.5496 -4.5496 -4.4459 -4.4459 1.1223 1.1223 1.1806 1.1806 2.1970 2.1970 3.1815 3.1815 3.4819 3.4819 3.8001 3.8001 4.6099 4.6099 4.9473 4.9473 5.3127 5.3127 5.6617 5.6617 8.3571 8.3571 8.8087 8.8087 9.0962 9.0962 9.5843 9.5843 k = 0.0000 0.0000 0.0000 ( 5333 PWs) bands (ev): -21.1724 -21.1724 -21.1595 -21.1595 -8.5924 -8.5924 -8.0810 -8.0810 -7.8171 -7.8171 -7.4816 -7.4816 -5.8312 -5.8312 -5.8278 -5.8278 -5.7875 -5.7875 -5.4591 -5.4591 -4.5495 -4.5495 -4.4454 -4.4454 1.1210 1.1210 1.1794 1.1794 2.1952 2.1952 3.1814 3.1814 3.4843 3.4843 3.8019 3.8019 4.6091 4.6091 4.9469 4.9469 5.3121 5.3121 5.6630 5.6630 8.3549 8.3549 8.8114 8.8114 9.0881 9.0881 9.6000 9.6000 Writing output data file BaSe2.save init_run : 2.74s CPU 14.00s WALL ( 1 calls) electrons : 961.19s CPU 968.64s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.30s CPU 1.72s WALL ( 1 calls) Called by electrons: c_bands : 961.09s CPU 968.39s WALL ( 1 calls) v_of_rho : 0.04s CPU 1.04s WALL ( 1 calls) v_h : 0.00s CPU 0.02s WALL ( 1 calls) v_xc : 0.04s CPU 0.65s WALL ( 1 calls) newd : 0.22s CPU 0.52s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.08s WALL ( 312 calls) cegterg : 915.04s CPU 919.57s WALL ( 758 calls) Called by sum_band: Called by *egterg: h_psi : 553.24s CPU 561.48s WALL ( 13348 calls) s_psi : 25.53s CPU 26.09s WALL ( 13348 calls) g_psi : 0.80s CPU 0.80s WALL ( 12278 calls) cdiaghg : 250.56s CPU 247.75s WALL ( 12590 calls) cegterg:over : 57.81s CPU 54.52s WALL ( 12278 calls) cegterg:upda : 14.28s CPU 17.97s WALL ( 12278 calls) cegterg:last : 10.62s CPU 11.33s WALL ( 1824 calls) Called by h_psi: h_psi:vloc : 498.89s CPU 505.68s WALL ( 13348 calls) h_psi:vnl : 53.99s CPU 54.89s WALL ( 13348 calls) add_vuspsi : 16.93s CPU 20.57s WALL ( 13348 calls) General routines calbec : 37.01s CPU 34.22s WALL ( 13348 calls) fft : 0.41s CPU 1.28s WALL ( 19 calls) ffts : 0.03s CPU 0.12s WALL ( 4 calls) fftw : 473.92s CPU 474.95s WALL ( 1152224 calls) interpolate : 0.08s CPU 0.18s WALL ( 4 calls) davcio : 0.03s CPU 0.98s WALL ( 624 calls) Parallel routines fft_scatter : 245.28s CPU 237.37s WALL ( 1152247 calls) PWSCF : 16m57.03s CPU 19m20.71s WALL This run was terminated on: 8:24:12 5Jun2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=