Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:47:53 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CaSnxBO3x2.save/ file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 68 40 11 2029 915 140 Max 69 41 12 2035 932 144 Sum 2479 1475 419 73181 33207 5111 bravais-lattice index = 14 lattice parameter (alat) = 11.4319 a.u. unit-cell volume = 739.2766 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.431877 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.677561 celldm(5)= 0.677561 celldm(6)= 0.677561 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.677561 0.735467 0.000000 ) a(3) = ( 0.677561 0.297052 0.672808 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.921267 -0.600314 ) b(2) = ( 0.000000 1.359681 -0.600314 ) b(3) = ( 0.000000 0.000000 1.486307 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 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 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sn read from file: /users/gautes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ca read from file: /users/gautes/Pseudo/Ca.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 60bd286d514994a6a955285ae841e6ef 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 1169 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Sn 14.00 118.71000 Sn( 1.00) Ca 10.00 40.07800 Ca( 1.00) B 3.00 10.81100 B( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 276 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 2) = ( 0.0128205 -0.0118111 -0.0076963), wk = 0.0036232 k( 3) = ( 0.0256410 -0.0236222 -0.0153927), wk = 0.0036232 k( 4) = ( 0.0384615 -0.0354333 -0.0230890), wk = 0.0036232 k( 5) = ( 0.0512821 -0.0472445 -0.0307854), wk = 0.0036232 k( 6) = ( 0.0641026 -0.0590556 -0.0384817), wk = 0.0036232 k( 7) = ( 0.0769231 -0.0708667 -0.0461780), wk = 0.0036232 k( 8) = ( 0.0897436 -0.0826778 -0.0538744), wk = 0.0036232 k( 9) = ( 0.1025641 -0.0944889 -0.0615707), wk = 0.0036232 k( 10) = ( 0.1153846 -0.1063000 -0.0692670), wk = 0.0036232 k( 11) = ( 0.1282051 -0.1181111 -0.0769634), wk = 0.0036232 k( 12) = ( 0.1410256 -0.1299222 -0.0846597), wk = 0.0036232 k( 13) = ( 0.1538461 -0.1417334 -0.0923561), wk = 0.0036232 k( 14) = ( 0.1666667 -0.1535445 -0.1000524), wk = 0.0036232 k( 15) = ( 0.1794872 -0.1653556 -0.1077487), wk = 0.0036232 k( 16) = ( 0.1923077 -0.1771667 -0.1154451), wk = 0.0036232 k( 17) = ( 0.2051282 -0.1889778 -0.1231414), wk = 0.0036232 k( 18) = ( 0.2179487 -0.2007889 -0.1308377), wk = 0.0036232 k( 19) = ( 0.2307692 -0.2126000 -0.1385341), wk = 0.0036232 k( 20) = ( 0.2435897 -0.2244111 -0.1462304), wk = 0.0036232 k( 21) = ( 0.2564103 -0.2362223 -0.1539268), wk = 0.0036232 k( 22) = ( 0.2692308 -0.2480334 -0.1616231), wk = 0.0036232 k( 23) = ( 0.2820513 -0.2598445 -0.1693194), wk = 0.0036232 k( 24) = ( 0.2948718 -0.2716556 -0.1770158), wk = 0.0036232 k( 25) = ( 0.3076923 -0.2834667 -0.1847121), wk = 0.0036232 k( 26) = ( 0.3205128 -0.2952778 -0.1924084), wk = 0.0036232 k( 27) = ( 0.3333333 -0.3070889 -0.2001048), wk = 0.0036232 k( 28) = ( 0.3461538 -0.3189001 -0.2078011), wk = 0.0036232 k( 29) = ( 0.3589744 -0.3307112 -0.2154975), wk = 0.0036232 k( 30) = ( 0.3717949 -0.3425223 -0.2231938), wk = 0.0036232 k( 31) = ( 0.3846154 -0.3543334 -0.2308901), wk = 0.0036232 k( 32) = ( 0.3974359 -0.3661445 -0.2385865), wk = 0.0036232 k( 33) = ( 0.4102564 -0.3779556 -0.2462828), wk = 0.0036232 k( 34) = ( 0.4230769 -0.3897667 -0.2539792), wk = 0.0036232 k( 35) = ( 0.4358974 -0.4015779 -0.2616755), wk = 0.0036232 k( 36) = ( 0.4487179 -0.4133890 -0.2693718), wk = 0.0036232 k( 37) = ( 0.4615385 -0.4252001 -0.2770682), wk = 0.0036232 k( 38) = ( 0.4743590 -0.4370112 -0.2847645), wk = 0.0036232 k( 39) = ( 0.4871795 -0.4488223 -0.2924608), wk = 0.0036232 k( 40) = ( 0.5000000 -0.4606334 -0.3001572), wk = 0.0036232 k( 41) = ( 0.5000000 -0.4606334 -0.3001572), wk = 0.0036232 k( 42) = ( 0.5000000 -0.4503240 -0.3159785), wk = 0.0036232 k( 43) = ( 0.5000000 -0.4400145 -0.3317998), wk = 0.0036232 k( 44) = ( 0.5000000 -0.4297051 -0.3476211), wk = 0.0036232 k( 45) = ( 0.5000000 -0.4193956 -0.3634424), wk = 0.0036232 k( 46) = ( 0.5000000 -0.4090862 -0.3792637), wk = 0.0036232 k( 47) = ( 0.5000000 -0.3987767 -0.3950850), wk = 0.0036232 k( 48) = ( 0.5000000 -0.3884672 -0.4109063), wk = 0.0036232 k( 49) = ( 0.5000000 -0.3781578 -0.4267276), wk = 0.0036232 k( 50) = ( 0.5000000 -0.3678483 -0.4425489), wk = 0.0036232 k( 51) = ( 0.5000000 -0.3575389 -0.4583702), wk = 0.0036232 k( 52) = ( 0.5000000 -0.3472294 -0.4741915), wk = 0.0036232 k( 53) = ( 0.5000000 -0.3369200 -0.4900128), wk = 0.0036232 k( 54) = ( 0.5000000 -0.3266105 -0.5058342), wk = 0.0036232 k( 55) = ( 0.5000000 -0.3163011 -0.5216555), wk = 0.0036232 k( 56) = ( 0.5000000 -0.3059916 -0.5374768), wk = 0.0036232 k( 57) = ( 0.5000000 -0.2956822 -0.5532981), wk = 0.0036232 k( 58) = ( 0.5000000 -0.2853727 -0.5691194), wk = 0.0036232 k( 59) = ( 0.5000000 -0.2750633 -0.5849407), wk = 0.0036232 k( 60) = ( 0.5000000 -0.2647538 -0.6007620), wk = 0.0036232 k( 61) = ( 0.5000000 -0.2544444 -0.6165833), wk = 0.0036232 k( 62) = ( 0.5000000 -0.2441349 -0.6324046), wk = 0.0036232 k( 63) = ( 0.5000000 -0.2338255 -0.6482259), wk = 0.0036232 k( 64) = ( 0.5000000 -0.2235160 -0.6640472), wk = 0.0036232 k( 65) = ( 0.5000000 -0.2132065 -0.6798685), wk = 0.0036232 k( 66) = ( 0.5000000 -0.2028971 -0.6956898), wk = 0.0036232 k( 67) = ( 0.5000000 -0.1925876 -0.7115111), wk = 0.0036232 k( 68) = ( 0.5000000 -0.1822782 -0.7273324), wk = 0.0036232 k( 69) = ( 0.5000000 -0.1719687 -0.7431537), wk = 0.0036232 k( 70) = ( 0.7876968 -0.0458384 -0.4574750), wk = 0.0036232 k( 71) = ( 0.7801258 -0.0388635 -0.4416772), wk = 0.0036232 k( 72) = ( 0.7725548 -0.0318886 -0.4258795), wk = 0.0036232 k( 73) = ( 0.7649839 -0.0249137 -0.4100818), wk = 0.0036232 k( 74) = ( 0.7574129 -0.0179389 -0.3942840), wk = 0.0036232 k( 75) = ( 0.7498419 -0.0109640 -0.3784862), wk = 0.0036232 k( 76) = ( 0.7422710 -0.0039891 -0.3626885), wk = 0.0036232 k( 77) = ( 0.7347000 0.0029858 -0.3468908), wk = 0.0036232 k( 78) = ( 0.7271290 0.0099607 -0.3310930), wk = 0.0036232 k( 79) = ( 0.7195581 0.0169356 -0.3152953), wk = 0.0036232 k( 80) = ( 0.7119871 0.0239104 -0.2994975), wk = 0.0036232 k( 81) = ( 0.7044161 0.0308853 -0.2836998), wk = 0.0036232 k( 82) = ( 0.6968452 0.0378602 -0.2679020), wk = 0.0036232 k( 83) = ( 0.6892742 0.0448351 -0.2521043), wk = 0.0036232 k( 84) = ( 0.6817032 0.0518100 -0.2363065), wk = 0.0036232 k( 85) = ( 0.6741323 0.0587848 -0.2205088), wk = 0.0036232 k( 86) = ( 0.6665613 0.0657597 -0.2047110), wk = 0.0036232 k( 87) = ( 0.6589903 0.0727346 -0.1889133), wk = 0.0036232 k( 88) = ( 0.6514193 0.0797095 -0.1731155), wk = 0.0036232 k( 89) = ( 0.6438484 0.0866844 -0.1573178), wk = 0.0036232 k( 90) = ( 0.6362774 0.0936592 -0.1415201), wk = 0.0036232 k( 91) = ( 0.6287065 0.1006341 -0.1257223), wk = 0.0036232 k( 92) = ( 0.6211355 0.1076090 -0.1099246), wk = 0.0036232 k( 93) = ( 0.6135645 0.1145839 -0.0941268), wk = 0.0036232 k( 94) = ( 0.6059935 0.1215588 -0.0783291), wk = 0.0036232 k( 95) = ( 0.5984226 0.1285337 -0.0625313), wk = 0.0036232 k( 96) = ( 0.5908516 0.1355085 -0.0467336), wk = 0.0036232 k( 97) = ( 0.5832806 0.1424834 -0.0309358), wk = 0.0036232 k( 98) = ( 0.5757097 0.1494583 -0.0151381), wk = 0.0036232 k( 99) = ( 0.5681387 0.1564332 0.0006597), wk = 0.0036232 k( 100) = ( 0.5605677 0.1634081 0.0164574), wk = 0.0036232 k( 101) = ( 0.5529968 0.1703829 0.0322552), wk = 0.0036232 k( 102) = ( 0.5454258 0.1773578 0.0480529), wk = 0.0036232 k( 103) = ( 0.5378548 0.1843327 0.0638506), wk = 0.0036232 k( 104) = ( 0.5302839 0.1913076 0.0796484), wk = 0.0036232 k( 105) = ( 0.5227129 0.1982825 0.0954461), wk = 0.0036232 k( 106) = ( 0.5151419 0.2052573 0.1112439), wk = 0.0036232 k( 107) = ( 0.5075710 0.2122322 0.1270416), wk = 0.0036232 k( 108) = ( 0.5000000 0.2192071 0.1428394), wk = 0.0036232 k( 109) = ( 0.5000000 0.2192071 0.1428394), wk = 0.0036232 k( 110) = ( 0.4833333 0.2119002 0.1380781), wk = 0.0036232 k( 111) = ( 0.4666667 0.2045933 0.1333168), wk = 0.0036232 k( 112) = ( 0.4500000 0.1972864 0.1285554), wk = 0.0036232 k( 113) = ( 0.4333333 0.1899795 0.1237941), wk = 0.0036232 k( 114) = ( 0.4166667 0.1826726 0.1190328), wk = 0.0036232 k( 115) = ( 0.4000000 0.1753657 0.1142715), wk = 0.0036232 k( 116) = ( 0.3833333 0.1680588 0.1095102), wk = 0.0036232 k( 117) = ( 0.3666667 0.1607519 0.1047489), wk = 0.0036232 k( 118) = ( 0.3500000 0.1534450 0.0999876), wk = 0.0036232 k( 119) = ( 0.3333333 0.1461381 0.0952262), wk = 0.0036232 k( 120) = ( 0.3166667 0.1388312 0.0904649), wk = 0.0036232 k( 121) = ( 0.3000000 0.1315243 0.0857036), wk = 0.0036232 k( 122) = ( 0.2833333 0.1242174 0.0809423), wk = 0.0036232 k( 123) = ( 0.2666667 0.1169105 0.0761810), wk = 0.0036232 k( 124) = ( 0.2500000 0.1096036 0.0714197), wk = 0.0036232 k( 125) = ( 0.2333333 0.1022967 0.0666584), wk = 0.0036232 k( 126) = ( 0.2166667 0.0949898 0.0618971), wk = 0.0036232 k( 127) = ( 0.2000000 0.0876828 0.0571358), wk = 0.0036232 k( 128) = ( 0.1833333 0.0803759 0.0523744), wk = 0.0036232 k( 129) = ( 0.1666667 0.0730690 0.0476131), wk = 0.0036232 k( 130) = ( 0.1500000 0.0657621 0.0428518), wk = 0.0036232 k( 131) = ( 0.1333333 0.0584552 0.0380905), wk = 0.0036232 k( 132) = ( 0.1166667 0.0511483 0.0333292), wk = 0.0036232 k( 133) = ( 0.1000000 0.0438414 0.0285679), wk = 0.0036232 k( 134) = ( 0.0833333 0.0365345 0.0238066), wk = 0.0036232 k( 135) = ( 0.0666667 0.0292276 0.0190453), wk = 0.0036232 k( 136) = ( 0.0500000 0.0219207 0.0142839), wk = 0.0036232 k( 137) = ( 0.0333333 0.0146138 0.0095226), wk = 0.0036232 k( 138) = ( 0.0166667 0.0073069 0.0047613), wk = 0.0036232 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 141) = ( 0.0075777 -0.0069811 -0.0158118), wk = 0.0036232 k( 142) = ( 0.0151554 -0.0139622 -0.0316236), wk = 0.0036232 k( 143) = ( 0.0227331 -0.0209432 -0.0474353), wk = 0.0036232 k( 144) = ( 0.0303108 -0.0279243 -0.0632471), wk = 0.0036232 k( 145) = ( 0.0378885 -0.0349054 -0.0790589), wk = 0.0036232 k( 146) = ( 0.0454662 -0.0418865 -0.0948707), wk = 0.0036232 k( 147) = ( 0.0530439 -0.0488675 -0.1106825), wk = 0.0036232 k( 148) = ( 0.0606216 -0.0558486 -0.1264942), wk = 0.0036232 k( 149) = ( 0.0681993 -0.0628297 -0.1423060), wk = 0.0036232 k( 150) = ( 0.0757769 -0.0698108 -0.1581178), wk = 0.0036232 k( 151) = ( 0.0833546 -0.0767919 -0.1739296), wk = 0.0036232 k( 152) = ( 0.0909323 -0.0837729 -0.1897414), wk = 0.0036232 k( 153) = ( 0.0985100 -0.0907540 -0.2055532), wk = 0.0036232 k( 154) = ( 0.1060877 -0.0977351 -0.2213650), wk = 0.0036232 k( 155) = ( 0.1136654 -0.1047162 -0.2371767), wk = 0.0036232 k( 156) = ( 0.1212431 -0.1116972 -0.2529885), wk = 0.0036232 k( 157) = ( 0.1288208 -0.1186783 -0.2688003), wk = 0.0036232 k( 158) = ( 0.1363985 -0.1256594 -0.2846121), wk = 0.0036232 k( 159) = ( 0.1439762 -0.1326405 -0.3004238), wk = 0.0036232 k( 160) = ( 0.1515539 -0.1396216 -0.3162356), wk = 0.0036232 k( 161) = ( 0.1591316 -0.1466026 -0.3320474), wk = 0.0036232 k( 162) = ( 0.1667093 -0.1535837 -0.3478592), wk = 0.0036232 k( 163) = ( 0.1742870 -0.1605648 -0.3636710), wk = 0.0036232 k( 164) = ( 0.1818646 -0.1675459 -0.3794827), wk = 0.0036232 k( 165) = ( 0.1894424 -0.1745270 -0.3952945), wk = 0.0036232 k( 166) = ( 0.1970200 -0.1815080 -0.4111063), wk = 0.0036232 k( 167) = ( 0.2045977 -0.1884891 -0.4269181), wk = 0.0036232 k( 168) = ( 0.2121754 -0.1954702 -0.4427299), wk = 0.0036232 k( 169) = ( 0.2197531 -0.2024513 -0.4585417), wk = 0.0036232 k( 170) = ( 0.2273308 -0.2094323 -0.4743535), wk = 0.0036232 k( 171) = ( 0.2349085 -0.2164134 -0.4901652), wk = 0.0036232 k( 172) = ( 0.2424862 -0.2233945 -0.5059770), wk = 0.0036232 k( 173) = ( 0.2500639 -0.2303756 -0.5217888), wk = 0.0036232 k( 174) = ( 0.2576416 -0.2373566 -0.5376006), wk = 0.0036232 k( 175) = ( 0.2652193 -0.2443377 -0.5534124), wk = 0.0036232 k( 176) = ( 0.2727970 -0.2513188 -0.5692241), wk = 0.0036232 k( 177) = ( 0.2803747 -0.2582999 -0.5850359), wk = 0.0036232 k( 178) = ( 0.2879524 -0.2652810 -0.6008477), wk = 0.0036232 k( 179) = ( 0.2955301 -0.2722620 -0.6166595), wk = 0.0036232 k( 180) = ( 0.3031078 -0.2792431 -0.6324713), wk = 0.0036232 k( 181) = ( 0.3106854 -0.2862242 -0.6482830), wk = 0.0036232 k( 182) = ( 0.3182631 -0.2932053 -0.6640948), wk = 0.0036232 k( 183) = ( 0.3258408 -0.3001864 -0.6799066), wk = 0.0036232 k( 184) = ( 0.3334185 -0.3071674 -0.6957184), wk = 0.0036232 k( 185) = ( 0.3409962 -0.3141485 -0.7115302), wk = 0.0036232 k( 186) = ( 0.3485739 -0.3211296 -0.7273420), wk = 0.0036232 k( 187) = ( 0.3561516 -0.3281107 -0.7431537), wk = 0.0036232 k( 188) = ( 0.6438484 -0.1089035 -0.6003144), wk = 0.0036232 k( 189) = ( 0.6362774 -0.0916346 -0.6003144), wk = 0.0036232 k( 190) = ( 0.6287065 -0.0743656 -0.6003144), wk = 0.0036232 k( 191) = ( 0.6211355 -0.0570966 -0.6003144), wk = 0.0036232 k( 192) = ( 0.6135645 -0.0398276 -0.6003144), wk = 0.0036232 k( 193) = ( 0.6059935 -0.0225586 -0.6003144), wk = 0.0036232 k( 194) = ( 0.5984226 -0.0052897 -0.6003144), wk = 0.0036232 k( 195) = ( 0.5908516 0.0119793 -0.6003144), wk = 0.0036232 k( 196) = ( 0.5832806 0.0292483 -0.6003144), wk = 0.0036232 k( 197) = ( 0.5757097 0.0465173 -0.6003144), wk = 0.0036232 k( 198) = ( 0.5681387 0.0637863 -0.6003144), wk = 0.0036232 k( 199) = ( 0.5605677 0.0810553 -0.6003144), wk = 0.0036232 k( 200) = ( 0.5529968 0.0983242 -0.6003144), wk = 0.0036232 k( 201) = ( 0.5454258 0.1155932 -0.6003144), wk = 0.0036232 k( 202) = ( 0.5378548 0.1328622 -0.6003144), wk = 0.0036232 k( 203) = ( 0.5302839 0.1501312 -0.6003144), wk = 0.0036232 k( 204) = ( 0.5227129 0.1674002 -0.6003144), wk = 0.0036232 k( 205) = ( 0.5151419 0.1846691 -0.6003144), wk = 0.0036232 k( 206) = ( 0.5075710 0.2019381 -0.6003144), wk = 0.0036232 k( 207) = ( 0.5000000 0.2192071 -0.6003144), wk = 0.0036232 k( 208) = ( 0.5000000 0.2192071 -0.6003144), wk = 0.0036232 k( 209) = ( 0.5119874 0.2244625 -0.5884111), wk = 0.0036232 k( 210) = ( 0.5239747 0.2297180 -0.5765078), wk = 0.0036232 k( 211) = ( 0.5359621 0.2349734 -0.5646045), wk = 0.0036232 k( 212) = ( 0.5479495 0.2402288 -0.5527012), wk = 0.0036232 k( 213) = ( 0.5599368 0.2454843 -0.5407980), wk = 0.0036232 k( 214) = ( 0.5719242 0.2507397 -0.5288947), wk = 0.0036232 k( 215) = ( 0.5839116 0.2559951 -0.5169914), wk = 0.0036232 k( 216) = ( 0.5958989 0.2612506 -0.5050881), wk = 0.0036232 k( 217) = ( 0.6078863 0.2665060 -0.4931848), wk = 0.0036232 k( 218) = ( 0.6198737 0.2717614 -0.4812815), wk = 0.0036232 k( 219) = ( 0.6318610 0.2770169 -0.4693783), wk = 0.0036232 k( 220) = ( 0.6438484 0.2822723 -0.4574750), wk = 0.0036232 k( 221) = ( 0.6438484 0.2822723 -0.4574750), wk = 0.0036232 k( 222) = ( 0.6394893 0.2803612 -0.4392836), wk = 0.0036232 k( 223) = ( 0.6351303 0.2784502 -0.4210923), wk = 0.0036232 k( 224) = ( 0.6307713 0.2765391 -0.4029010), wk = 0.0036232 k( 225) = ( 0.6264122 0.2746280 -0.3847096), wk = 0.0036232 k( 226) = ( 0.6220532 0.2727170 -0.3665183), wk = 0.0036232 k( 227) = ( 0.6176941 0.2708059 -0.3483269), wk = 0.0036232 k( 228) = ( 0.6133351 0.2688948 -0.3301356), wk = 0.0036232 k( 229) = ( 0.6089760 0.2669838 -0.3119442), wk = 0.0036232 k( 230) = ( 0.6046170 0.2650727 -0.2937529), wk = 0.0036232 k( 231) = ( 0.6002580 0.2631616 -0.2755615), wk = 0.0036232 k( 232) = ( 0.5958989 0.2612506 -0.2573702), wk = 0.0036232 k( 233) = ( 0.5915399 0.2593395 -0.2391788), wk = 0.0036232 k( 234) = ( 0.5871808 0.2574284 -0.2209875), wk = 0.0036232 k( 235) = ( 0.5828218 0.2555174 -0.2027962), wk = 0.0036232 k( 236) = ( 0.5784628 0.2536063 -0.1846048), wk = 0.0036232 k( 237) = ( 0.5741037 0.2516952 -0.1664135), wk = 0.0036232 k( 238) = ( 0.5697447 0.2497842 -0.1482221), wk = 0.0036232 k( 239) = ( 0.5653856 0.2478731 -0.1300308), wk = 0.0036232 k( 240) = ( 0.5610266 0.2459620 -0.1118394), wk = 0.0036232 k( 241) = ( 0.5566676 0.2440510 -0.0936481), wk = 0.0036232 k( 242) = ( 0.5523085 0.2421399 -0.0754568), wk = 0.0036232 k( 243) = ( 0.5479495 0.2402288 -0.0572654), wk = 0.0036232 k( 244) = ( 0.5435904 0.2383178 -0.0390741), wk = 0.0036232 k( 245) = ( 0.5392314 0.2364067 -0.0208827), wk = 0.0036232 k( 246) = ( 0.5348723 0.2344956 -0.0026914), wk = 0.0036232 k( 247) = ( 0.5305133 0.2325846 0.0155000), wk = 0.0036232 k( 248) = ( 0.5261543 0.2306735 0.0336913), wk = 0.0036232 k( 249) = ( 0.5217952 0.2287624 0.0518827), wk = 0.0036232 k( 250) = ( 0.5174362 0.2268514 0.0700740), wk = 0.0036232 k( 251) = ( 0.5130771 0.2249403 0.0882653), wk = 0.0036232 k( 252) = ( 0.5087181 0.2230292 0.1064567), wk = 0.0036232 k( 253) = ( 0.5043590 0.2211182 0.1246480), wk = 0.0036232 k( 254) = ( 0.5000000 0.2192071 0.1428394), wk = 0.0036232 k( 255) = ( 0.5000000 -0.4606334 -0.3001572), wk = 0.0036232 k( 256) = ( 0.5136998 -0.4501950 -0.2933553), wk = 0.0036232 k( 257) = ( 0.5273997 -0.4397565 -0.2865534), wk = 0.0036232 k( 258) = ( 0.5410995 -0.4293181 -0.2797516), wk = 0.0036232 k( 259) = ( 0.5547994 -0.4188797 -0.2729497), wk = 0.0036232 k( 260) = ( 0.5684992 -0.4084412 -0.2661478), wk = 0.0036232 k( 261) = ( 0.5821991 -0.3980028 -0.2593459), wk = 0.0036232 k( 262) = ( 0.5958989 -0.3875644 -0.2525440), wk = 0.0036232 k( 263) = ( 0.6095988 -0.3771259 -0.2457422), wk = 0.0036232 k( 264) = ( 0.6232986 -0.3666875 -0.2389403), wk = 0.0036232 k( 265) = ( 0.6369985 -0.3562491 -0.2321384), wk = 0.0036232 k( 266) = ( 0.6506983 -0.3458106 -0.2253366), wk = 0.0036232 k( 267) = ( 0.6643982 -0.3353722 -0.2185347), wk = 0.0036232 k( 268) = ( 0.6780980 -0.3249338 -0.2117328), wk = 0.0036232 k( 269) = ( 0.6917979 -0.3144953 -0.2049309), wk = 0.0036232 k( 270) = ( 0.7054977 -0.3040569 -0.1981291), wk = 0.0036232 k( 271) = ( 0.7191975 -0.2936185 -0.1913272), wk = 0.0036232 k( 272) = ( 0.7328974 -0.2831800 -0.1845253), wk = 0.0036232 k( 273) = ( 0.7465972 -0.2727416 -0.1777234), wk = 0.0036232 k( 274) = ( 0.7602971 -0.2623032 -0.1709216), wk = 0.0036232 k( 275) = ( 0.7739969 -0.2518647 -0.1641197), wk = 0.0036232 k( 276) = ( 0.7876968 -0.2414263 -0.1573178), wk = 0.0036232 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 2) = ( 0.0128205 -0.0000000 -0.0000000), wk = 0.0036232 k( 3) = ( 0.0256410 -0.0000000 -0.0000000), wk = 0.0036232 k( 4) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0036232 k( 5) = ( 0.0512821 -0.0000000 -0.0000000), wk = 0.0036232 k( 6) = ( 0.0641026 -0.0000000 -0.0000000), wk = 0.0036232 k( 7) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0036232 k( 8) = ( 0.0897436 -0.0000000 -0.0000000), wk = 0.0036232 k( 9) = ( 0.1025641 -0.0000000 -0.0000000), wk = 0.0036232 k( 10) = ( 0.1153846 0.0000000 -0.0000000), wk = 0.0036232 k( 11) = ( 0.1282051 -0.0000000 -0.0000000), wk = 0.0036232 k( 12) = ( 0.1410256 -0.0000000 -0.0000000), wk = 0.0036232 k( 13) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0036232 k( 14) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0036232 k( 15) = ( 0.1794872 -0.0000000 -0.0000000), wk = 0.0036232 k( 16) = ( 0.1923077 0.0000000 -0.0000000), wk = 0.0036232 k( 17) = ( 0.2051282 0.0000000 -0.0000000), wk = 0.0036232 k( 18) = ( 0.2179487 0.0000000 -0.0000000), wk = 0.0036232 k( 19) = ( 0.2307692 -0.0000000 -0.0000000), wk = 0.0036232 k( 20) = ( 0.2435897 0.0000000 -0.0000000), wk = 0.0036232 k( 21) = ( 0.2564103 -0.0000000 -0.0000000), wk = 0.0036232 k( 22) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0036232 k( 23) = ( 0.2820513 -0.0000000 -0.0000000), wk = 0.0036232 k( 24) = ( 0.2948718 0.0000000 -0.0000000), wk = 0.0036232 k( 25) = ( 0.3076923 0.0000000 -0.0000000), wk = 0.0036232 k( 26) = ( 0.3205128 -0.0000000 -0.0000000), wk = 0.0036232 k( 27) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0036232 k( 28) = ( 0.3461538 -0.0000000 -0.0000000), wk = 0.0036232 k( 29) = ( 0.3589744 -0.0000000 -0.0000000), wk = 0.0036232 k( 30) = ( 0.3717949 -0.0000000 -0.0000000), wk = 0.0036232 k( 31) = ( 0.3846154 0.0000000 -0.0000000), wk = 0.0036232 k( 32) = ( 0.3974359 0.0000000 0.0000000), wk = 0.0036232 k( 33) = ( 0.4102564 -0.0000000 -0.0000000), wk = 0.0036232 k( 34) = ( 0.4230769 -0.0000000 -0.0000000), wk = 0.0036232 k( 35) = ( 0.4358974 0.0000000 -0.0000000), wk = 0.0036232 k( 36) = ( 0.4487179 -0.0000000 -0.0000000), wk = 0.0036232 k( 37) = ( 0.4615385 -0.0000000 -0.0000000), wk = 0.0036232 k( 38) = ( 0.4743590 0.0000000 -0.0000000), wk = 0.0036232 k( 39) = ( 0.4871795 0.0000000 -0.0000000), wk = 0.0036232 k( 40) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036232 k( 41) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036232 k( 42) = ( 0.5000000 0.0075823 -0.0075823), wk = 0.0036232 k( 43) = ( 0.5000000 0.0151645 -0.0151645), wk = 0.0036232 k( 44) = ( 0.5000000 0.0227468 -0.0227468), wk = 0.0036232 k( 45) = ( 0.5000000 0.0303290 -0.0303290), wk = 0.0036232 k( 46) = ( 0.5000000 0.0379113 -0.0379113), wk = 0.0036232 k( 47) = ( 0.5000000 0.0454935 -0.0454936), wk = 0.0036232 k( 48) = ( 0.5000000 0.0530758 -0.0530758), wk = 0.0036232 k( 49) = ( 0.5000000 0.0606581 -0.0606581), wk = 0.0036232 k( 50) = ( 0.5000000 0.0682403 -0.0682403), wk = 0.0036232 k( 51) = ( 0.5000000 0.0758226 -0.0758226), wk = 0.0036232 k( 52) = ( 0.5000000 0.0834048 -0.0834048), wk = 0.0036232 k( 53) = ( 0.5000000 0.0909871 -0.0909871), wk = 0.0036232 k( 54) = ( 0.5000000 0.0985694 -0.0985694), wk = 0.0036232 k( 55) = ( 0.5000000 0.1061516 -0.1061516), wk = 0.0036232 k( 56) = ( 0.5000000 0.1137339 -0.1137339), wk = 0.0036232 k( 57) = ( 0.5000000 0.1213161 -0.1213161), wk = 0.0036232 k( 58) = ( 0.5000000 0.1288984 -0.1288984), wk = 0.0036232 k( 59) = ( 0.5000000 0.1364806 -0.1364807), wk = 0.0036232 k( 60) = ( 0.5000000 0.1440629 -0.1440629), wk = 0.0036232 k( 61) = ( 0.5000000 0.1516452 -0.1516452), wk = 0.0036232 k( 62) = ( 0.5000000 0.1592274 -0.1592274), wk = 0.0036232 k( 63) = ( 0.5000000 0.1668097 -0.1668097), wk = 0.0036232 k( 64) = ( 0.5000000 0.1743919 -0.1743919), wk = 0.0036232 k( 65) = ( 0.5000000 0.1819742 -0.1819742), wk = 0.0036232 k( 66) = ( 0.5000000 0.1895565 -0.1895565), wk = 0.0036232 k( 67) = ( 0.5000000 0.1971387 -0.1971387), wk = 0.0036232 k( 68) = ( 0.5000000 0.2047210 -0.2047210), wk = 0.0036232 k( 69) = ( 0.5000000 0.2123032 -0.2123032), wk = 0.0036232 k( 70) = ( 0.7876968 0.5000000 0.2123032), wk = 0.0036232 k( 71) = ( 0.7801258 0.5000000 0.2198742), wk = 0.0036232 k( 72) = ( 0.7725548 0.5000000 0.2274452), wk = 0.0036232 k( 73) = ( 0.7649839 0.5000000 0.2350161), wk = 0.0036232 k( 74) = ( 0.7574129 0.5000000 0.2425871), wk = 0.0036232 k( 75) = ( 0.7498419 0.5000000 0.2501581), wk = 0.0036232 k( 76) = ( 0.7422710 0.5000000 0.2577290), wk = 0.0036232 k( 77) = ( 0.7347000 0.5000000 0.2653000), wk = 0.0036232 k( 78) = ( 0.7271290 0.5000000 0.2728710), wk = 0.0036232 k( 79) = ( 0.7195581 0.5000000 0.2804419), wk = 0.0036232 k( 80) = ( 0.7119871 0.5000000 0.2880129), wk = 0.0036232 k( 81) = ( 0.7044161 0.5000000 0.2955839), wk = 0.0036232 k( 82) = ( 0.6968452 0.5000000 0.3031548), wk = 0.0036232 k( 83) = ( 0.6892742 0.5000000 0.3107258), wk = 0.0036232 k( 84) = ( 0.6817032 0.5000000 0.3182968), wk = 0.0036232 k( 85) = ( 0.6741323 0.5000000 0.3258677), wk = 0.0036232 k( 86) = ( 0.6665613 0.5000000 0.3334387), wk = 0.0036232 k( 87) = ( 0.6589903 0.5000000 0.3410097), wk = 0.0036232 k( 88) = ( 0.6514193 0.5000000 0.3485806), wk = 0.0036232 k( 89) = ( 0.6438484 0.5000000 0.3561516), wk = 0.0036232 k( 90) = ( 0.6362774 0.5000000 0.3637226), wk = 0.0036232 k( 91) = ( 0.6287065 0.5000000 0.3712936), wk = 0.0036232 k( 92) = ( 0.6211355 0.5000000 0.3788645), wk = 0.0036232 k( 93) = ( 0.6135645 0.5000000 0.3864355), wk = 0.0036232 k( 94) = ( 0.6059935 0.5000000 0.3940064), wk = 0.0036232 k( 95) = ( 0.5984226 0.5000000 0.4015774), wk = 0.0036232 k( 96) = ( 0.5908516 0.5000000 0.4091484), wk = 0.0036232 k( 97) = ( 0.5832806 0.5000000 0.4167194), wk = 0.0036232 k( 98) = ( 0.5757097 0.5000000 0.4242903), wk = 0.0036232 k( 99) = ( 0.5681387 0.5000000 0.4318613), wk = 0.0036232 k( 100) = ( 0.5605677 0.5000000 0.4394323), wk = 0.0036232 k( 101) = ( 0.5529968 0.5000000 0.4470032), wk = 0.0036232 k( 102) = ( 0.5454258 0.5000000 0.4545742), wk = 0.0036232 k( 103) = ( 0.5378548 0.5000000 0.4621452), wk = 0.0036232 k( 104) = ( 0.5302839 0.5000000 0.4697161), wk = 0.0036232 k( 105) = ( 0.5227129 0.5000000 0.4772871), wk = 0.0036232 k( 106) = ( 0.5151419 0.5000000 0.4848581), wk = 0.0036232 k( 107) = ( 0.5075710 0.5000000 0.4924290), wk = 0.0036232 k( 108) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036232 k( 109) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036232 k( 110) = ( 0.4833333 0.4833333 0.4833333), wk = 0.0036232 k( 111) = ( 0.4666667 0.4666667 0.4666667), wk = 0.0036232 k( 112) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0036232 k( 113) = ( 0.4333333 0.4333333 0.4333333), wk = 0.0036232 k( 114) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0036232 k( 115) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0036232 k( 116) = ( 0.3833333 0.3833333 0.3833333), wk = 0.0036232 k( 117) = ( 0.3666667 0.3666667 0.3666667), wk = 0.0036232 k( 118) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0036232 k( 119) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0036232 k( 120) = ( 0.3166667 0.3166667 0.3166667), wk = 0.0036232 k( 121) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0036232 k( 122) = ( 0.2833333 0.2833333 0.2833333), wk = 0.0036232 k( 123) = ( 0.2666667 0.2666667 0.2666667), wk = 0.0036232 k( 124) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036232 k( 125) = ( 0.2333333 0.2333333 0.2333333), wk = 0.0036232 k( 126) = ( 0.2166667 0.2166667 0.2166667), wk = 0.0036232 k( 127) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0036232 k( 128) = ( 0.1833333 0.1833333 0.1833333), wk = 0.0036232 k( 129) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0036232 k( 130) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0036232 k( 131) = ( 0.1333333 0.1333333 0.1333333), wk = 0.0036232 k( 132) = ( 0.1166667 0.1166667 0.1166667), wk = 0.0036232 k( 133) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0036232 k( 134) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0036232 k( 135) = ( 0.0666667 0.0666667 0.0666667), wk = 0.0036232 k( 136) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0036232 k( 137) = ( 0.0333333 0.0333333 0.0333333), wk = 0.0036232 k( 138) = ( 0.0166667 0.0166667 0.0166667), wk = 0.0036232 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036232 k( 141) = ( 0.0075777 -0.0000000 -0.0075777), wk = 0.0036232 k( 142) = ( 0.0151554 -0.0000000 -0.0151554), wk = 0.0036232 k( 143) = ( 0.0227331 -0.0000000 -0.0227331), wk = 0.0036232 k( 144) = ( 0.0303108 -0.0000000 -0.0303108), wk = 0.0036232 k( 145) = ( 0.0378885 0.0000000 -0.0378885), wk = 0.0036232 k( 146) = ( 0.0454662 -0.0000000 -0.0454662), wk = 0.0036232 k( 147) = ( 0.0530439 -0.0000000 -0.0530439), wk = 0.0036232 k( 148) = ( 0.0606216 -0.0000000 -0.0606216), wk = 0.0036232 k( 149) = ( 0.0681993 -0.0000000 -0.0681993), wk = 0.0036232 k( 150) = ( 0.0757769 0.0000000 -0.0757769), wk = 0.0036232 k( 151) = ( 0.0833546 -0.0000000 -0.0833546), wk = 0.0036232 k( 152) = ( 0.0909323 -0.0000000 -0.0909323), wk = 0.0036232 k( 153) = ( 0.0985100 -0.0000000 -0.0985100), wk = 0.0036232 k( 154) = ( 0.1060877 -0.0000000 -0.1060877), wk = 0.0036232 k( 155) = ( 0.1136654 -0.0000000 -0.1136654), wk = 0.0036232 k( 156) = ( 0.1212431 -0.0000000 -0.1212431), wk = 0.0036232 k( 157) = ( 0.1288208 -0.0000000 -0.1288208), wk = 0.0036232 k( 158) = ( 0.1363985 -0.0000000 -0.1363985), wk = 0.0036232 k( 159) = ( 0.1439762 -0.0000000 -0.1439762), wk = 0.0036232 k( 160) = ( 0.1515539 0.0000000 -0.1515539), wk = 0.0036232 k( 161) = ( 0.1591316 -0.0000000 -0.1591316), wk = 0.0036232 k( 162) = ( 0.1667093 0.0000000 -0.1667093), wk = 0.0036232 k( 163) = ( 0.1742870 -0.0000000 -0.1742870), wk = 0.0036232 k( 164) = ( 0.1818646 -0.0000000 -0.1818646), wk = 0.0036232 k( 165) = ( 0.1894424 -0.0000000 -0.1894424), wk = 0.0036232 k( 166) = ( 0.1970200 -0.0000000 -0.1970200), wk = 0.0036232 k( 167) = ( 0.2045977 0.0000000 -0.2045977), wk = 0.0036232 k( 168) = ( 0.2121754 -0.0000000 -0.2121754), wk = 0.0036232 k( 169) = ( 0.2197531 -0.0000000 -0.2197531), wk = 0.0036232 k( 170) = ( 0.2273308 -0.0000000 -0.2273308), wk = 0.0036232 k( 171) = ( 0.2349085 -0.0000000 -0.2349085), wk = 0.0036232 k( 172) = ( 0.2424862 -0.0000000 -0.2424862), wk = 0.0036232 k( 173) = ( 0.2500639 -0.0000000 -0.2500639), wk = 0.0036232 k( 174) = ( 0.2576416 -0.0000000 -0.2576416), wk = 0.0036232 k( 175) = ( 0.2652193 -0.0000000 -0.2652193), wk = 0.0036232 k( 176) = ( 0.2727970 -0.0000000 -0.2727970), wk = 0.0036232 k( 177) = ( 0.2803747 -0.0000000 -0.2803747), wk = 0.0036232 k( 178) = ( 0.2879524 -0.0000000 -0.2879524), wk = 0.0036232 k( 179) = ( 0.2955301 -0.0000000 -0.2955301), wk = 0.0036232 k( 180) = ( 0.3031078 0.0000000 -0.3031078), wk = 0.0036232 k( 181) = ( 0.3106854 -0.0000000 -0.3106854), wk = 0.0036232 k( 182) = ( 0.3182631 0.0000000 -0.3182631), wk = 0.0036232 k( 183) = ( 0.3258408 -0.0000000 -0.3258408), wk = 0.0036232 k( 184) = ( 0.3334185 -0.0000000 -0.3334185), wk = 0.0036232 k( 185) = ( 0.3409962 0.0000000 -0.3409962), wk = 0.0036232 k( 186) = ( 0.3485739 -0.0000000 -0.3485739), wk = 0.0036232 k( 187) = ( 0.3561516 -0.0000000 -0.3561516), wk = 0.0036232 k( 188) = ( 0.6438484 0.3561516 -0.0000000), wk = 0.0036232 k( 189) = ( 0.6362774 0.3637226 -0.0000000), wk = 0.0036232 k( 190) = ( 0.6287065 0.3712935 0.0000000), wk = 0.0036232 k( 191) = ( 0.6211355 0.3788645 -0.0000000), wk = 0.0036232 k( 192) = ( 0.6135645 0.3864355 -0.0000000), wk = 0.0036232 k( 193) = ( 0.6059935 0.3940065 -0.0000000), wk = 0.0036232 k( 194) = ( 0.5984226 0.4015774 0.0000000), wk = 0.0036232 k( 195) = ( 0.5908516 0.4091484 -0.0000000), wk = 0.0036232 k( 196) = ( 0.5832806 0.4167194 -0.0000000), wk = 0.0036232 k( 197) = ( 0.5757097 0.4242903 -0.0000000), wk = 0.0036232 k( 198) = ( 0.5681387 0.4318613 -0.0000000), wk = 0.0036232 k( 199) = ( 0.5605677 0.4394323 -0.0000000), wk = 0.0036232 k( 200) = ( 0.5529968 0.4470032 -0.0000000), wk = 0.0036232 k( 201) = ( 0.5454258 0.4545742 -0.0000000), wk = 0.0036232 k( 202) = ( 0.5378548 0.4621452 0.0000000), wk = 0.0036232 k( 203) = ( 0.5302839 0.4697161 -0.0000000), wk = 0.0036232 k( 204) = ( 0.5227129 0.4772871 -0.0000000), wk = 0.0036232 k( 205) = ( 0.5151419 0.4848581 -0.0000000), wk = 0.0036232 k( 206) = ( 0.5075710 0.4924290 -0.0000000), wk = 0.0036232 k( 207) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0036232 k( 208) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0036232 k( 209) = ( 0.5119874 0.5119874 0.0176919), wk = 0.0036232 k( 210) = ( 0.5239747 0.5239747 0.0353839), wk = 0.0036232 k( 211) = ( 0.5359621 0.5359621 0.0530758), wk = 0.0036232 k( 212) = ( 0.5479495 0.5479495 0.0707677), wk = 0.0036232 k( 213) = ( 0.5599368 0.5599368 0.0884597), wk = 0.0036232 k( 214) = ( 0.5719242 0.5719242 0.1061516), wk = 0.0036232 k( 215) = ( 0.5839116 0.5839116 0.1238435), wk = 0.0036232 k( 216) = ( 0.5958989 0.5958989 0.1415355), wk = 0.0036232 k( 217) = ( 0.6078863 0.6078863 0.1592274), wk = 0.0036232 k( 218) = ( 0.6198737 0.6198737 0.1769194), wk = 0.0036232 k( 219) = ( 0.6318610 0.6318610 0.1946113), wk = 0.0036232 k( 220) = ( 0.6438484 0.6438484 0.2123032), wk = 0.0036232 k( 221) = ( 0.6438484 0.6438484 0.2123032), wk = 0.0036232 k( 222) = ( 0.6394893 0.6394893 0.2210213), wk = 0.0036232 k( 223) = ( 0.6351303 0.6351303 0.2297394), wk = 0.0036232 k( 224) = ( 0.6307713 0.6307713 0.2384575), wk = 0.0036232 k( 225) = ( 0.6264122 0.6264122 0.2471756), wk = 0.0036232 k( 226) = ( 0.6220532 0.6220532 0.2558936), wk = 0.0036232 k( 227) = ( 0.6176941 0.6176941 0.2646117), wk = 0.0036232 k( 228) = ( 0.6133351 0.6133351 0.2733298), wk = 0.0036232 k( 229) = ( 0.6089760 0.6089760 0.2820479), wk = 0.0036232 k( 230) = ( 0.6046170 0.6046170 0.2907660), wk = 0.0036232 k( 231) = ( 0.6002580 0.6002580 0.2994841), wk = 0.0036232 k( 232) = ( 0.5958989 0.5958989 0.3082021), wk = 0.0036232 k( 233) = ( 0.5915399 0.5915399 0.3169202), wk = 0.0036232 k( 234) = ( 0.5871808 0.5871808 0.3256383), wk = 0.0036232 k( 235) = ( 0.5828218 0.5828218 0.3343564), wk = 0.0036232 k( 236) = ( 0.5784628 0.5784628 0.3430745), wk = 0.0036232 k( 237) = ( 0.5741037 0.5741037 0.3517926), wk = 0.0036232 k( 238) = ( 0.5697447 0.5697447 0.3605107), wk = 0.0036232 k( 239) = ( 0.5653856 0.5653856 0.3692287), wk = 0.0036232 k( 240) = ( 0.5610266 0.5610266 0.3779468), wk = 0.0036232 k( 241) = ( 0.5566676 0.5566675 0.3866649), wk = 0.0036232 k( 242) = ( 0.5523085 0.5523085 0.3953830), wk = 0.0036232 k( 243) = ( 0.5479495 0.5479495 0.4041011), wk = 0.0036232 k( 244) = ( 0.5435904 0.5435904 0.4128192), wk = 0.0036232 k( 245) = ( 0.5392314 0.5392314 0.4215372), wk = 0.0036232 k( 246) = ( 0.5348723 0.5348723 0.4302553), wk = 0.0036232 k( 247) = ( 0.5305133 0.5305133 0.4389734), wk = 0.0036232 k( 248) = ( 0.5261543 0.5261542 0.4476915), wk = 0.0036232 k( 249) = ( 0.5217952 0.5217952 0.4564096), wk = 0.0036232 k( 250) = ( 0.5174362 0.5174362 0.4651277), wk = 0.0036232 k( 251) = ( 0.5130771 0.5130771 0.4738458), wk = 0.0036232 k( 252) = ( 0.5087181 0.5087181 0.4825638), wk = 0.0036232 k( 253) = ( 0.5043590 0.5043590 0.4912819), wk = 0.0036232 k( 254) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036232 k( 255) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0036232 k( 256) = ( 0.5136998 0.0169596 0.0169596), wk = 0.0036232 k( 257) = ( 0.5273997 0.0339192 0.0339192), wk = 0.0036232 k( 258) = ( 0.5410995 0.0508788 0.0508788), wk = 0.0036232 k( 259) = ( 0.5547994 0.0678384 0.0678384), wk = 0.0036232 k( 260) = ( 0.5684992 0.0847980 0.0847980), wk = 0.0036232 k( 261) = ( 0.5821991 0.1017576 0.1017576), wk = 0.0036232 k( 262) = ( 0.5958989 0.1187172 0.1187172), wk = 0.0036232 k( 263) = ( 0.6095988 0.1356768 0.1356768), wk = 0.0036232 k( 264) = ( 0.6232986 0.1526364 0.1526364), wk = 0.0036232 k( 265) = ( 0.6369985 0.1695960 0.1695960), wk = 0.0036232 k( 266) = ( 0.6506983 0.1865556 0.1865556), wk = 0.0036232 k( 267) = ( 0.6643982 0.2035152 0.2035152), wk = 0.0036232 k( 268) = ( 0.6780980 0.2204748 0.2204748), wk = 0.0036232 k( 269) = ( 0.6917979 0.2374344 0.2374344), wk = 0.0036232 k( 270) = ( 0.7054977 0.2543940 0.2543940), wk = 0.0036232 k( 271) = ( 0.7191975 0.2713536 0.2713536), wk = 0.0036232 k( 272) = ( 0.7328974 0.2883132 0.2883132), wk = 0.0036232 k( 273) = ( 0.7465972 0.3052728 0.3052728), wk = 0.0036232 k( 274) = ( 0.7602971 0.3222324 0.3222324), wk = 0.0036232 k( 275) = ( 0.7739969 0.3391920 0.3391920), wk = 0.0036232 k( 276) = ( 0.7876968 0.3561516 0.3561516), wk = 0.0036232 Dense grid: 73181 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 33207 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 252, 80) NL pseudopotentials 0.35 Mb ( 126, 180) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2035) G-vector shells 0.01 Mb ( 1657) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.23 Mb ( 252, 320) Each subspace H/S matrix 0.10 Mb ( 80, 80) Each matrix 0.44 Mb ( 180, 2, 80) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./CaSnxBO3x2.save/charge-density.dat negative rho (up, down): 2.390E-04 0.000E+00 Starting wfc are 98 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.8 secs Computing kpt #: 2 total cpu time spent up to now is 6.8 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 9.9 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 13.1 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 16.2 secs Computing kpt #: 6 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 19.3 secs Computing kpt #: 7 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 22.4 secs Computing kpt #: 8 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 25.5 secs Computing kpt #: 9 total cpu time spent up to now is 28.4 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 31.6 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 34.7 secs Computing kpt #: 12 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 37.9 secs Computing kpt #: 13 total cpu time spent up to now is 40.6 secs Computing kpt #: 14 total cpu time spent up to now is 43.3 secs Computing kpt #: 15 total cpu time spent up to now is 45.2 secs Computing kpt #: 16 total cpu time spent up to now is 47.1 secs Computing kpt #: 17 total cpu time spent up to now is 49.0 secs Computing kpt #: 18 total cpu time spent up to now is 50.8 secs Computing kpt #: 19 total cpu time spent up to now is 52.7 secs Computing kpt #: 20 total cpu time spent up to now is 54.5 secs Computing kpt #: 21 total cpu time spent up to now is 56.4 secs Computing kpt #: 22 total cpu time spent up to now is 58.2 secs Computing kpt #: 23 total cpu time spent up to now is 60.0 secs Computing kpt #: 24 total cpu time spent up to now is 61.7 secs Computing kpt #: 25 total cpu time spent up to now is 63.5 secs Computing kpt #: 26 total cpu time spent up to now is 65.2 secs Computing kpt #: 27 total cpu time spent up to now is 67.0 secs Computing kpt #: 28 total cpu time spent up to now is 68.7 secs Computing kpt #: 29 total cpu time spent up to now is 70.3 secs Computing kpt #: 30 total cpu time spent up to now is 71.9 secs Computing kpt #: 31 total cpu time spent up to now is 73.5 secs Computing kpt #: 32 total cpu time spent up to now is 75.1 secs Computing kpt #: 33 total cpu time spent up to now is 76.6 secs Computing kpt #: 34 total cpu time spent up to now is 78.3 secs Computing kpt #: 35 total cpu time spent up to now is 79.7 secs Computing kpt #: 36 total cpu time spent up to now is 81.3 secs Computing kpt #: 37 total cpu time spent up to now is 82.9 secs Computing kpt #: 38 total cpu time spent up to now is 84.6 secs Computing kpt #: 39 total cpu time spent up to now is 86.1 secs Computing kpt #: 40 total cpu time spent up to now is 87.6 secs Computing kpt #: 41 total cpu time spent up to now is 89.1 secs Computing kpt #: 42 total cpu time spent up to now is 90.6 secs Computing kpt #: 43 total cpu time spent up to now is 92.1 secs Computing kpt #: 44 total cpu time spent up to now is 93.8 secs Computing kpt #: 45 total cpu time spent up to now is 95.4 secs Computing kpt #: 46 total cpu time spent up to now is 97.1 secs Computing kpt #: 47 total cpu time spent up to now is 98.7 secs Computing kpt #: 48 total cpu time spent up to now is 100.3 secs Computing kpt #: 49 total cpu time spent up to now is 102.0 secs Computing kpt #: 50 total cpu time spent up to now is 103.6 secs Computing kpt #: 51 total cpu time spent up to now is 105.3 secs Computing kpt #: 52 total cpu time spent up to now is 107.0 secs Computing kpt #: 53 total cpu time spent up to now is 108.6 secs Computing kpt #: 54 total cpu time spent up to now is 110.3 secs Computing kpt #: 55 total cpu time spent up to now is 112.0 secs Computing kpt #: 56 total cpu time spent up to now is 113.8 secs Computing kpt #: 57 total cpu time spent up to now is 115.5 secs Computing kpt #: 58 total cpu time spent up to now is 117.3 secs Computing kpt #: 59 total cpu time spent up to now is 119.2 secs Computing kpt #: 60 total cpu time spent up to now is 121.0 secs Computing kpt #: 61 total cpu time spent up to now is 123.0 secs Computing kpt #: 62 total cpu time spent up to now is 124.8 secs Computing kpt #: 63 total cpu time spent up to now is 126.7 secs Computing kpt #: 64 total cpu time spent up to now is 128.8 secs Computing kpt #: 65 total cpu time spent up to now is 130.7 secs Computing kpt #: 66 total cpu time spent up to now is 132.6 secs Computing kpt #: 67 total cpu time spent up to now is 134.3 secs Computing kpt #: 68 total cpu time spent up to now is 136.2 secs Computing kpt #: 69 total cpu time spent up to now is 137.9 secs Computing kpt #: 70 total cpu time spent up to now is 139.6 secs Computing kpt #: 71 total cpu time spent up to now is 141.3 secs Computing kpt #: 72 total cpu time spent up to now is 142.8 secs Computing kpt #: 73 total cpu time spent up to now is 144.5 secs Computing kpt #: 74 total cpu time spent up to now is 146.1 secs Computing kpt #: 75 total cpu time spent up to now is 147.7 secs Computing kpt #: 76 total cpu time spent up to now is 149.5 secs Computing kpt #: 77 total cpu time spent up to now is 151.1 secs Computing kpt #: 78 total cpu time spent up to now is 152.6 secs Computing kpt #: 79 total cpu time spent up to now is 154.1 secs Computing kpt #: 80 total cpu time spent up to now is 155.7 secs Computing kpt #: 81 total cpu time spent up to now is 157.4 secs Computing kpt #: 82 total cpu time spent up to now is 159.0 secs Computing kpt #: 83 total cpu time spent up to now is 160.7 secs Computing kpt #: 84 total cpu time spent up to now is 162.5 secs Computing kpt #: 85 total cpu time spent up to now is 164.5 secs Computing kpt #: 86 total cpu time spent up to now is 166.3 secs Computing kpt #: 87 total cpu time spent up to now is 168.7 secs Computing kpt #: 88 total cpu time spent up to now is 171.0 secs Computing kpt #: 89 total cpu time spent up to now is 173.2 secs Computing kpt #: 90 total cpu time spent up to now is 175.7 secs Computing kpt #: 91 total cpu time spent up to now is 178.4 secs Computing kpt #: 92 total cpu time spent up to now is 180.5 secs Computing kpt #: 93 total cpu time spent up to now is 182.4 secs Computing kpt #: 94 total cpu time spent up to now is 184.2 secs Computing kpt #: 95 total cpu time spent up to now is 186.1 secs Computing kpt #: 96 total cpu time spent up to now is 187.7 secs Computing kpt #: 97 total cpu time spent up to now is 189.3 secs Computing kpt #: 98 total cpu time spent up to now is 191.0 secs Computing kpt #: 99 total cpu time spent up to now is 192.8 secs Computing kpt #: 100 total cpu time spent up to now is 194.5 secs Computing kpt #: 101 total cpu time spent up to now is 196.1 secs Computing kpt #: 102 total cpu time spent up to now is 197.6 secs Computing kpt #: 103 total cpu time spent up to now is 199.1 secs Computing kpt #: 104 total cpu time spent up to now is 200.7 secs Computing kpt #: 105 total cpu time spent up to now is 202.1 secs Computing kpt #: 106 total cpu time spent up to now is 203.6 secs Computing kpt #: 107 total cpu time spent up to now is 205.0 secs Computing kpt #: 108 total cpu time spent up to now is 206.4 secs Computing kpt #: 109 total cpu time spent up to now is 207.7 secs Computing kpt #: 110 total cpu time spent up to now is 209.2 secs Computing kpt #: 111 total cpu time spent up to now is 210.7 secs Computing kpt #: 112 total cpu time spent up to now is 212.2 secs Computing kpt #: 113 total cpu time spent up to now is 213.7 secs Computing kpt #: 114 total cpu time spent up to now is 215.3 secs Computing kpt #: 115 total cpu time spent up to now is 216.8 secs Computing kpt #: 116 total cpu time spent up to now is 218.2 secs Computing kpt #: 117 total cpu time spent up to now is 219.7 secs Computing kpt #: 118 total cpu time spent up to now is 221.1 secs Computing kpt #: 119 total cpu time spent up to now is 222.6 secs Computing kpt #: 120 total cpu time spent up to now is 224.1 secs Computing kpt #: 121 total cpu time spent up to now is 225.8 secs Computing kpt #: 122 total cpu time spent up to now is 227.4 secs Computing kpt #: 123 total cpu time spent up to now is 229.0 secs Computing kpt #: 124 total cpu time spent up to now is 230.7 secs Computing kpt #: 125 total cpu time spent up to now is 232.5 secs Computing kpt #: 126 total cpu time spent up to now is 234.2 secs Computing kpt #: 127 total cpu time spent up to now is 236.0 secs Computing kpt #: 128 total cpu time spent up to now is 237.8 secs Computing kpt #: 129 total cpu time spent up to now is 239.6 secs Computing kpt #: 130 total cpu time spent up to now is 241.4 secs Computing kpt #: 131 total cpu time spent up to now is 243.2 secs Computing kpt #: 132 total cpu time spent up to now is 245.5 secs Computing kpt #: 133 total cpu time spent up to now is 247.5 secs Computing kpt #: 134 total cpu time spent up to now is 249.6 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 252.8 secs Computing kpt #: 136 total cpu time spent up to now is 254.7 secs Computing kpt #: 137 total cpu time spent up to now is 256.6 secs Computing kpt #: 138 total cpu time spent up to now is 259.1 secs Computing kpt #: 139 total cpu time spent up to now is 260.9 secs Computing kpt #: 140 total cpu time spent up to now is 262.3 secs Computing kpt #: 141 total cpu time spent up to now is 264.2 secs Computing kpt #: 142 total cpu time spent up to now is 266.1 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 269.3 secs Computing kpt #: 144 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 272.4 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 275.5 secs Computing kpt #: 146 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 278.6 secs Computing kpt #: 147 total cpu time spent up to now is 281.6 secs Computing kpt #: 148 total cpu time spent up to now is 283.7 secs Computing kpt #: 149 total cpu time spent up to now is 286.2 secs Computing kpt #: 150 total cpu time spent up to now is 288.6 secs Computing kpt #: 151 total cpu time spent up to now is 290.6 secs Computing kpt #: 152 total cpu time spent up to now is 292.6 secs Computing kpt #: 153 total cpu time spent up to now is 294.5 secs Computing kpt #: 154 total cpu time spent up to now is 296.4 secs Computing kpt #: 155 total cpu time spent up to now is 298.3 secs Computing kpt #: 156 total cpu time spent up to now is 300.1 secs Computing kpt #: 157 total cpu time spent up to now is 302.0 secs Computing kpt #: 158 total cpu time spent up to now is 303.7 secs Computing kpt #: 159 total cpu time spent up to now is 305.5 secs Computing kpt #: 160 total cpu time spent up to now is 307.4 secs Computing kpt #: 161 total cpu time spent up to now is 309.2 secs Computing kpt #: 162 total cpu time spent up to now is 311.0 secs Computing kpt #: 163 total cpu time spent up to now is 312.8 secs Computing kpt #: 164 total cpu time spent up to now is 314.6 secs Computing kpt #: 165 total cpu time spent up to now is 316.3 secs Computing kpt #: 166 total cpu time spent up to now is 318.0 secs Computing kpt #: 167 total cpu time spent up to now is 319.8 secs Computing kpt #: 168 total cpu time spent up to now is 321.4 secs Computing kpt #: 169 total cpu time spent up to now is 323.1 secs Computing kpt #: 170 total cpu time spent up to now is 324.8 secs Computing kpt #: 171 total cpu time spent up to now is 326.5 secs Computing kpt #: 172 total cpu time spent up to now is 328.2 secs Computing kpt #: 173 total cpu time spent up to now is 329.8 secs Computing kpt #: 174 total cpu time spent up to now is 331.5 secs Computing kpt #: 175 total cpu time spent up to now is 333.2 secs Computing kpt #: 176 total cpu time spent up to now is 335.0 secs Computing kpt #: 177 total cpu time spent up to now is 336.7 secs Computing kpt #: 178 total cpu time spent up to now is 338.5 secs Computing kpt #: 179 total cpu time spent up to now is 340.4 secs Computing kpt #: 180 total cpu time spent up to now is 342.3 secs Computing kpt #: 181 total cpu time spent up to now is 344.2 secs Computing kpt #: 182 total cpu time spent up to now is 346.1 secs Computing kpt #: 183 total cpu time spent up to now is 348.0 secs Computing kpt #: 184 total cpu time spent up to now is 349.8 secs Computing kpt #: 185 total cpu time spent up to now is 351.5 secs Computing kpt #: 186 total cpu time spent up to now is 353.3 secs Computing kpt #: 187 total cpu time spent up to now is 355.2 secs Computing kpt #: 188 total cpu time spent up to now is 356.9 secs Computing kpt #: 189 total cpu time spent up to now is 358.7 secs Computing kpt #: 190 total cpu time spent up to now is 360.4 secs Computing kpt #: 191 total cpu time spent up to now is 362.1 secs Computing kpt #: 192 total cpu time spent up to now is 363.9 secs Computing kpt #: 193 total cpu time spent up to now is 365.6 secs Computing kpt #: 194 total cpu time spent up to now is 367.3 secs Computing kpt #: 195 total cpu time spent up to now is 369.0 secs Computing kpt #: 196 total cpu time spent up to now is 370.6 secs Computing kpt #: 197 total cpu time spent up to now is 372.3 secs Computing kpt #: 198 total cpu time spent up to now is 374.0 secs Computing kpt #: 199 total cpu time spent up to now is 375.5 secs Computing kpt #: 200 total cpu time spent up to now is 377.2 secs Computing kpt #: 201 total cpu time spent up to now is 378.8 secs Computing kpt #: 202 total cpu time spent up to now is 380.3 secs Computing kpt #: 203 total cpu time spent up to now is 381.9 secs Computing kpt #: 204 total cpu time spent up to now is 383.3 secs Computing kpt #: 205 total cpu time spent up to now is 384.8 secs Computing kpt #: 206 total cpu time spent up to now is 386.4 secs Computing kpt #: 207 total cpu time spent up to now is 387.9 secs Computing kpt #: 208 total cpu time spent up to now is 389.5 secs Computing kpt #: 209 total cpu time spent up to now is 391.0 secs Computing kpt #: 210 total cpu time spent up to now is 392.4 secs Computing kpt #: 211 total cpu time spent up to now is 393.8 secs Computing kpt #: 212 total cpu time spent up to now is 395.2 secs Computing kpt #: 213 total cpu time spent up to now is 396.7 secs Computing kpt #: 214 total cpu time spent up to now is 398.2 secs Computing kpt #: 215 total cpu time spent up to now is 399.7 secs Computing kpt #: 216 total cpu time spent up to now is 401.3 secs Computing kpt #: 217 total cpu time spent up to now is 402.9 secs Computing kpt #: 218 total cpu time spent up to now is 404.5 secs Computing kpt #: 219 total cpu time spent up to now is 405.9 secs Computing kpt #: 220 total cpu time spent up to now is 407.4 secs Computing kpt #: 221 total cpu time spent up to now is 409.0 secs Computing kpt #: 222 total cpu time spent up to now is 410.8 secs Computing kpt #: 223 total cpu time spent up to now is 412.4 secs Computing kpt #: 224 total cpu time spent up to now is 414.3 secs Computing kpt #: 225 total cpu time spent up to now is 415.9 secs Computing kpt #: 226 total cpu time spent up to now is 417.7 secs Computing kpt #: 227 total cpu time spent up to now is 421.1 secs Computing kpt #: 228 total cpu time spent up to now is 423.1 secs Computing kpt #: 229 total cpu time spent up to now is 425.1 secs Computing kpt #: 230 total cpu time spent up to now is 427.2 secs Computing kpt #: 231 total cpu time spent up to now is 429.4 secs Computing kpt #: 232 total cpu time spent up to now is 431.8 secs Computing kpt #: 233 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 435.0 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 438.3 secs Computing kpt #: 235 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 441.4 secs Computing kpt #: 236 total cpu time spent up to now is 444.5 secs Computing kpt #: 237 total cpu time spent up to now is 446.7 secs Computing kpt #: 238 total cpu time spent up to now is 448.9 secs Computing kpt #: 239 total cpu time spent up to now is 450.8 secs Computing kpt #: 240 total cpu time spent up to now is 452.7 secs Computing kpt #: 241 total cpu time spent up to now is 454.3 secs Computing kpt #: 242 total cpu time spent up to now is 456.1 secs Computing kpt #: 243 total cpu time spent up to now is 457.6 secs Computing kpt #: 244 total cpu time spent up to now is 459.3 secs Computing kpt #: 245 total cpu time spent up to now is 460.9 secs Computing kpt #: 246 total cpu time spent up to now is 462.5 secs Computing kpt #: 247 total cpu time spent up to now is 464.0 secs Computing kpt #: 248 total cpu time spent up to now is 465.4 secs Computing kpt #: 249 total cpu time spent up to now is 466.9 secs Computing kpt #: 250 total cpu time spent up to now is 468.5 secs Computing kpt #: 251 total cpu time spent up to now is 470.0 secs Computing kpt #: 252 total cpu time spent up to now is 471.4 secs Computing kpt #: 253 total cpu time spent up to now is 472.9 secs Computing kpt #: 254 total cpu time spent up to now is 474.3 secs Computing kpt #: 255 total cpu time spent up to now is 475.8 secs Computing kpt #: 256 total cpu time spent up to now is 477.3 secs Computing kpt #: 257 total cpu time spent up to now is 478.7 secs Computing kpt #: 258 total cpu time spent up to now is 480.1 secs Computing kpt #: 259 total cpu time spent up to now is 481.6 secs Computing kpt #: 260 total cpu time spent up to now is 483.0 secs Computing kpt #: 261 total cpu time spent up to now is 484.5 secs Computing kpt #: 262 total cpu time spent up to now is 485.9 secs Computing kpt #: 263 total cpu time spent up to now is 487.4 secs Computing kpt #: 264 total cpu time spent up to now is 489.1 secs Computing kpt #: 265 total cpu time spent up to now is 490.6 secs Computing kpt #: 266 total cpu time spent up to now is 492.1 secs Computing kpt #: 267 total cpu time spent up to now is 493.7 secs Computing kpt #: 268 total cpu time spent up to now is 495.3 secs Computing kpt #: 269 total cpu time spent up to now is 496.8 secs Computing kpt #: 270 total cpu time spent up to now is 498.5 secs Computing kpt #: 271 total cpu time spent up to now is 500.0 secs Computing kpt #: 272 total cpu time spent up to now is 501.4 secs Computing kpt #: 273 total cpu time spent up to now is 502.9 secs Computing kpt #: 274 total cpu time spent up to now is 504.4 secs Computing kpt #: 275 total cpu time spent up to now is 506.1 secs Computing kpt #: 276 total cpu time spent up to now is 507.6 secs ethr = 1.52E-08, avg # of iterations = 47.1 total cpu time spent up to now is 507.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1588 -14.1588 -14.1334 -14.1334 -13.1412 -13.1412 -13.1244 -13.1244 -12.8547 -12.8547 -12.8172 -12.8172 -12.7595 -12.7595 -12.4809 -12.4809 -12.2950 -12.2950 -11.4195 -11.4195 -10.5520 -10.5520 -10.5150 -10.5150 -10.0223 -10.0223 -10.0123 -10.0123 -1.6344 -1.6344 -0.1452 -0.1452 1.0326 1.0326 1.0926 1.0926 1.5527 1.5527 1.9261 1.9261 1.9296 1.9296 3.7449 3.7449 4.7205 4.7205 4.7958 4.7958 4.8410 4.8410 4.9376 4.9376 4.9471 4.9471 5.4721 5.4721 5.4887 5.4887 5.6329 5.6329 6.0409 6.0409 6.0554 6.0554 10.5954 10.5954 13.1937 13.1937 13.7253 13.7253 13.9932 13.9932 14.0023 14.0023 14.2621 14.2621 15.8392 15.8392 k = 0.0128-0.0118-0.0077 ( 4129 PWs) bands (ev): -31.1653 -31.1653 -14.1589 -14.1589 -14.1336 -14.1336 -13.1413 -13.1413 -13.1246 -13.1246 -12.8559 -12.8559 -12.8154 -12.8154 -12.7593 -12.7593 -12.4802 -12.4802 -12.2945 -12.2945 -11.4196 -11.4196 -10.5530 -10.5530 -10.5160 -10.5160 -10.0221 -10.0221 -10.0120 -10.0120 -1.6336 -1.6336 -0.1444 -0.1444 1.0324 1.0324 1.0924 1.0924 1.5540 1.5540 1.9263 1.9263 1.9301 1.9301 3.7443 3.7443 4.7199 4.7199 4.7932 4.7932 4.8374 4.8374 4.9398 4.9398 4.9500 4.9500 5.4690 5.4690 5.4861 5.4861 5.6380 5.6380 6.0398 6.0398 6.0545 6.0545 10.5979 10.5979 13.1932 13.1932 13.7257 13.7257 13.9935 13.9935 14.0027 14.0027 14.2619 14.2619 15.8031 15.8031 k = 0.0256-0.0236-0.0154 ( 4131 PWs) bands (ev): -31.1653 -31.1653 -14.1592 -14.1592 -14.1339 -14.1339 -13.1417 -13.1417 -13.1254 -13.1254 -12.8591 -12.8591 -12.8108 -12.8108 -12.7587 -12.7587 -12.4783 -12.4783 -12.2933 -12.2933 -11.4199 -11.4199 -10.5560 -10.5560 -10.5190 -10.5190 -10.0217 -10.0217 -10.0112 -10.0112 -1.6309 -1.6309 -0.1419 -0.1419 1.0318 1.0318 1.0920 1.0920 1.5577 1.5577 1.9261 1.9261 1.9324 1.9324 3.7427 3.7427 4.7175 4.7175 4.7862 4.7862 4.8279 4.8279 4.9450 4.9450 4.9586 4.9586 5.4582 5.4582 5.4817 5.4817 5.6516 5.6516 6.0363 6.0363 6.0522 6.0522 10.6056 10.6056 13.1917 13.1917 13.7269 13.7269 13.9940 13.9940 14.0045 14.0045 14.2615 14.2615 15.7750 15.7752 k = 0.0385-0.0354-0.0231 ( 4130 PWs) bands (ev): -31.1653 -31.1653 -14.1596 -14.1596 -14.1345 -14.1345 -13.1424 -13.1424 -13.1266 -13.1266 -12.8633 -12.8633 -12.8044 -12.8044 -12.7576 -12.7576 -12.4751 -12.4751 -12.2912 -12.2912 -11.4204 -11.4204 -10.5613 -10.5613 -10.5236 -10.5236 -10.0216 -10.0216 -10.0093 -10.0093 -1.6264 -1.6264 -0.1377 -0.1377 1.0304 1.0304 1.0919 1.0919 1.5638 1.5638 1.9249 1.9249 1.9371 1.9371 3.7399 3.7399 4.7111 4.7111 4.7772 4.7772 4.8154 4.8154 4.9516 4.9516 4.9713 4.9713 5.4403 5.4403 5.4779 5.4779 5.6705 5.6705 6.0294 6.0294 6.0497 6.0497 10.6184 10.6184 13.1892 13.1892 13.7289 13.7289 13.9935 13.9935 14.0084 14.0084 14.2608 14.2608 15.7484 15.7486 k = 0.0513-0.0472-0.0308 ( 4133 PWs) bands (ev): -31.1653 -31.1653 -14.1603 -14.1603 -14.1352 -14.1352 -13.1433 -13.1433 -13.1281 -13.1281 -12.8679 -12.8679 -12.7972 -12.7972 -12.7557 -12.7557 -12.4708 -12.4708 -12.2883 -12.2883 -11.4211 -11.4211 -10.5690 -10.5690 -10.5295 -10.5295 -10.0222 -10.0222 -10.0061 -10.0061 -1.6202 -1.6202 -0.1318 -0.1318 1.0277 1.0277 1.0925 1.0925 1.5722 1.5722 1.9229 1.9229 1.9439 1.9439 3.7360 3.7360 4.6982 4.6982 4.7674 4.7674 4.8033 4.8033 4.9592 4.9592 4.9864 4.9864 5.4186 5.4186 5.4742 5.4742 5.6923 5.6923 6.0186 6.0186 6.0474 6.0474 10.6360 10.6360 13.1859 13.1859 13.7316 13.7316 13.9921 13.9921 14.0145 14.0145 14.2599 14.2599 15.7235 15.7235 k = 0.0641-0.0591-0.0385 ( 4131 PWs) bands (ev): -31.1653 -31.1653 -14.1612 -14.1612 -14.1362 -14.1362 -13.1447 -13.1447 -13.1297 -13.1297 -12.8725 -12.8725 -12.7902 -12.7902 -12.7523 -12.7523 -12.4655 -12.4655 -12.2844 -12.2844 -11.4220 -11.4220 -10.5792 -10.5792 -10.5362 -10.5362 -10.0237 -10.0237 -10.0016 -10.0016 -1.6122 -1.6122 -0.1243 -0.1243 1.0232 1.0232 1.0946 1.0946 1.5830 1.5830 1.9201 1.9201 1.9527 1.9527 3.7310 3.7310 4.6780 4.6780 4.7537 4.7537 4.7966 4.7966 4.9674 4.9674 5.0029 5.0029 5.3952 5.3952 5.4699 5.4699 5.7154 5.7154 6.0045 6.0045 6.0453 6.0453 10.6583 10.6583 13.1819 13.1819 13.7350 13.7350 13.9898 13.9898 14.0223 14.0223 14.2588 14.2588 15.7004 15.7004 k = 0.0769-0.0709-0.0462 ( 4129 PWs) bands (ev): -31.1653 -31.1653 -14.1623 -14.1623 -14.1372 -14.1372 -13.1466 -13.1466 -13.1314 -13.1314 -12.8769 -12.8769 -12.7842 -12.7842 -12.7468 -12.7468 -12.4593 -12.4593 -12.2795 -12.2795 -11.4232 -11.4232 -10.5920 -10.5920 -10.5434 -10.5434 -10.0261 -10.0261 -9.9961 -9.9961 -1.6025 -1.6025 -0.1151 -0.1151 1.0167 1.0167 1.0985 1.0985 1.5959 1.5959 1.9167 1.9167 1.9634 1.9634 3.7249 3.7249 4.6518 4.6518 4.7340 4.7340 4.7968 4.7968 4.9759 4.9759 5.0203 5.0203 5.3712 5.3712 5.4649 5.4649 5.7392 5.7392 5.9875 5.9875 6.0432 6.0432 10.6851 10.6851 13.1774 13.1774 13.7392 13.7392 13.9870 13.9870 14.0313 14.0313 14.2577 14.2577 15.6791 15.6792 k = 0.0897-0.0827-0.0539 ( 4118 PWs) bands (ev): -31.1652 -31.1652 -14.1636 -14.1636 -14.1384 -14.1384 -13.1491 -13.1491 -13.1331 -13.1331 -12.8809 -12.8809 -12.7798 -12.7798 -12.7387 -12.7387 -12.4525 -12.4525 -12.2736 -12.2736 -11.4248 -11.4248 -10.6071 -10.6071 -10.5510 -10.5510 -10.0294 -10.0294 -9.9898 -9.9898 -1.5911 -1.5911 -0.1044 -0.1044 1.0083 1.0083 1.1044 1.1044 1.6109 1.6109 1.9125 1.9125 1.9760 1.9760 3.7176 3.7176 4.6211 4.6211 4.7098 4.7098 4.8008 4.8008 4.9845 4.9845 5.0387 5.0387 5.3472 5.3472 5.4591 5.4591 5.7632 5.7632 5.9682 5.9682 6.0409 6.0409 10.7161 10.7161 13.1726 13.1726 13.7440 13.7440 13.9836 13.9836 14.0411 14.0411 14.2566 14.2566 15.6596 15.6596 k = 0.1026-0.0945-0.0616 ( 4125 PWs) bands (ev): -31.1652 -31.1652 -14.1653 -14.1653 -14.1395 -14.1395 -13.1521 -13.1521 -13.1345 -13.1345 -12.8845 -12.8845 -12.7770 -12.7770 -12.7282 -12.7282 -12.4451 -12.4451 -12.2666 -12.2666 -11.4267 -11.4267 -10.6242 -10.6242 -10.5590 -10.5590 -10.0337 -10.0337 -9.9827 -9.9827 -1.5781 -1.5781 -0.0922 -0.0922 0.9982 0.9982 1.1121 1.1121 1.6277 1.6277 1.9077 1.9077 1.9903 1.9903 3.7092 3.7092 4.5870 4.5870 4.6824 4.6824 4.8060 4.8060 4.9930 4.9930 5.0580 5.0580 5.3236 5.3236 5.4527 5.4527 5.7870 5.7870 5.9471 5.9471 6.0384 6.0384 10.7509 10.7509 13.1675 13.1675 13.7495 13.7495 13.9797 13.9797 14.0510 14.0510 14.2557 14.2557 15.6415 15.6415 k = 0.1154-0.1063-0.0693 ( 4131 PWs) bands (ev): -31.1652 -31.1652 -14.1673 -14.1673 -14.1407 -14.1407 -13.1556 -13.1556 -13.1358 -13.1358 -12.8875 -12.8875 -12.7752 -12.7752 -12.7160 -12.7160 -12.4373 -12.4373 -12.2585 -12.2585 -11.4292 -11.4292 -10.6428 -10.6428 -10.5673 -10.5673 -10.0391 -10.0391 -9.9751 -9.9751 -1.5635 -1.5635 -0.0786 -0.0786 0.9870 0.9870 1.1215 1.1215 1.6462 1.6462 1.9022 1.9022 2.0064 2.0064 3.6994 3.6994 4.5501 4.5501 4.6526 4.6526 4.8108 4.8108 5.0013 5.0013 5.0782 5.0782 5.3009 5.3009 5.4455 5.4455 5.8104 5.8104 5.9248 5.9248 6.0358 6.0358 10.7892 10.7892 13.1624 13.1624 13.7556 13.7556 13.9754 13.9754 14.0608 14.0608 14.2551 14.2551 15.6241 15.6241 k = 0.1282-0.1181-0.0770 ( 4133 PWs) bands (ev): -31.1652 -31.1652 -14.1697 -14.1697 -14.1419 -14.1419 -13.1595 -13.1595 -13.1370 -13.1370 -12.8899 -12.8899 -12.7742 -12.7742 -12.7027 -12.7027 -12.4293 -12.4293 -12.2492 -12.2492 -11.4321 -11.4321 -10.6625 -10.6625 -10.5761 -10.5761 -10.0457 -10.0457 -9.9671 -9.9671 -1.5473 -1.5473 -0.0636 -0.0636 0.9750 0.9750 1.1324 1.1324 1.6661 1.6661 1.8961 1.8961 2.0241 2.0241 3.6881 3.6881 4.5110 4.5110 4.6208 4.6208 4.8140 4.8140 5.0095 5.0095 5.0994 5.0994 5.2796 5.2796 5.4377 5.4377 5.8325 5.8325 5.9027 5.9027 6.0331 6.0331 10.8307 10.8307 13.1573 13.1573 13.7624 13.7624 13.9707 13.9707 14.0698 14.0698 14.2550 14.2550 15.6059 15.6060 k = 0.1410-0.1299-0.0847 ( 4137 PWs) bands (ev): -31.1652 -31.1652 -14.1723 -14.1723 -14.1430 -14.1430 -13.1637 -13.1637 -13.1381 -13.1381 -12.8915 -12.8915 -12.7735 -12.7735 -12.6885 -12.6885 -12.4212 -12.4212 -12.2388 -12.2388 -11.4356 -11.4356 -10.6831 -10.6831 -10.5853 -10.5853 -10.0536 -10.0536 -9.9586 -9.9586 -1.5296 -1.5296 -0.0473 -0.0473 0.9625 0.9625 1.1448 1.1448 1.6871 1.6871 1.8897 1.8897 2.0434 2.0434 3.6752 3.6752 4.4701 4.4701 4.5872 4.5872 4.8147 4.8147 5.0175 5.0175 5.1208 5.1208 5.2606 5.2606 5.4294 5.4294 5.8488 5.8488 5.8855 5.8855 6.0302 6.0302 10.8750 10.8750 13.1524 13.1524 13.7697 13.7697 13.9658 13.9658 14.0776 14.0776 14.2557 14.2557 15.5845 15.5846 k = 0.1538-0.1417-0.0924 ( 4141 PWs) bands (ev): -31.1651 -31.1651 -14.1753 -14.1753 -14.1440 -14.1440 -13.1681 -13.1681 -13.1391 -13.1391 -12.8924 -12.8924 -12.7730 -12.7730 -12.6739 -12.6739 -12.4130 -12.4130 -12.2271 -12.2271 -11.4398 -11.4398 -10.7040 -10.7040 -10.5949 -10.5949 -10.0629 -10.0629 -9.9499 -9.9499 -1.5104 -1.5104 -0.0300 -0.0300 0.9500 0.9500 1.1584 1.1584 1.7087 1.7087 1.8832 1.8832 2.0642 2.0642 3.6604 3.6604 4.4281 4.4281 4.5521 4.5521 4.8122 4.8122 5.0252 5.0252 5.1409 5.1409 5.2455 5.2455 5.4208 5.4208 5.8417 5.8417 5.8914 5.8914 6.0273 6.0273 10.9218 10.9218 13.1477 13.1477 13.7776 13.7776 13.9605 13.9605 14.0839 14.0839 14.2573 14.2573 15.5574 15.5574 k = 0.1667-0.1535-0.1001 ( 4142 PWs) bands (ev): -31.1651 -31.1651 -14.1786 -14.1786 -14.1450 -14.1450 -13.1727 -13.1727 -13.1401 -13.1401 -12.8924 -12.8924 -12.7727 -12.7727 -12.6590 -12.6590 -12.4048 -12.4048 -12.2143 -12.2143 -11.4447 -11.4447 -10.7250 -10.7250 -10.6049 -10.6049 -10.0736 -10.0736 -9.9410 -9.9410 -1.4899 -1.4899 -0.0118 -0.0118 0.9378 0.9378 1.1733 1.1733 1.7303 1.7303 1.8772 1.8772 2.0865 2.0865 3.6433 3.6433 4.3855 4.3855 4.5157 4.5157 4.8060 4.8060 5.0323 5.0323 5.1559 5.1559 5.2381 5.2381 5.4122 5.4122 5.8206 5.8206 5.9113 5.9113 6.0243 6.0243 10.9707 10.9707 13.1433 13.1433 13.7861 13.7861 13.9551 13.9551 14.0884 14.0884 14.2599 14.2599 15.5238 15.5238 k = 0.1795-0.1654-0.1077 ( 4148 PWs) bands (ev): -31.1651 -31.1651 -14.1821 -14.1821 -14.1458 -14.1458 -13.1775 -13.1775 -13.1410 -13.1410 -12.8914 -12.8914 -12.7724 -12.7724 -12.6441 -12.6441 -12.3968 -12.3968 -12.2005 -12.2005 -11.4503 -11.4503 -10.7457 -10.7457 -10.6152 -10.6152 -10.0857 -10.0857 -9.9319 -9.9319 -1.4680 -1.4680 0.0070 0.0070 0.9265 0.9265 1.1892 1.1892 1.7503 1.7503 1.8729 1.8729 2.1102 2.1102 3.6235 3.6235 4.3429 4.3429 4.4782 4.4782 4.7958 4.7958 5.0385 5.0385 5.1605 5.1605 5.2434 5.2434 5.4042 5.4042 5.7976 5.7976 5.9333 5.9333 6.0215 6.0215 11.0214 11.0214 13.1392 13.1392 13.7951 13.7951 13.9494 13.9494 14.0909 14.0909 14.2635 14.2635 15.4849 15.4849 k = 0.1923-0.1772-0.1154 ( 4153 PWs) bands (ev): -31.1651 -31.1651 -14.1859 -14.1859 -14.1467 -14.1467 -13.1823 -13.1823 -13.1419 -13.1419 -12.8896 -12.8896 -12.7722 -12.7722 -12.6293 -12.6293 -12.3888 -12.3888 -12.1856 -12.1856 -11.4566 -11.4566 -10.7660 -10.7660 -10.6258 -10.6258 -10.0993 -10.0993 -9.9227 -9.9227 -1.4449 -1.4449 0.0262 0.0262 0.9163 0.9163 1.2061 1.2061 1.7667 1.7667 1.8724 1.8724 2.1351 2.1351 3.6006 3.6006 4.3009 4.3009 4.4397 4.4397 4.7817 4.7817 5.0433 5.0433 5.1558 5.1558 5.2595 5.2595 5.3976 5.3976 5.7748 5.7748 5.9558 5.9558 6.0189 6.0189 11.0735 11.0735 13.1353 13.1353 13.8045 13.8045 13.9435 13.9435 14.0916 14.0916 14.2681 14.2681 15.4422 15.4422 k = 0.2051-0.1890-0.1231 ( 4151 PWs) bands (ev): -31.1650 -31.1650 -14.1899 -14.1899 -14.1474 -14.1474 -13.1872 -13.1872 -13.1427 -13.1427 -12.8867 -12.8867 -12.7721 -12.7721 -12.6148 -12.6148 -12.3808 -12.3808 -12.1701 -12.1701 -11.4636 -11.4636 -10.7854 -10.7854 -10.6367 -10.6367 -10.1144 -10.1144 -9.9135 -9.9135 -1.4207 -1.4207 0.0454 0.0454 0.9079 0.9079 1.2240 1.2240 1.7764 1.7764 1.8787 1.8787 2.1612 2.1612 3.5743 3.5743 4.2600 4.2600 4.4006 4.4006 4.7639 4.7639 5.0464 5.0464 5.1474 5.1474 5.2794 5.2794 5.3939 5.3939 5.7527 5.7527 5.9781 5.9781 6.0168 6.0168 11.1268 11.1268 13.1316 13.1316 13.8143 13.8143 13.9375 13.9375 14.0906 14.0906 14.2734 14.2734 15.3972 15.3972 k = 0.2179-0.2008-0.1308 ( 4155 PWs) bands (ev): -31.1650 -31.1650 -14.1940 -14.1940 -14.1481 -14.1481 -13.1920 -13.1920 -13.1435 -13.1435 -12.8830 -12.8830 -12.7719 -12.7719 -12.6006 -12.6006 -12.3730 -12.3730 -12.1539 -12.1539 -11.4712 -11.4712 -10.8039 -10.8039 -10.6479 -10.6479 -10.1310 -10.1310 -9.9043 -9.9043 -1.3954 -1.3954 0.0642 0.0642 0.9015 0.9015 1.2426 1.2426 1.7781 1.7781 1.8928 1.8928 2.1884 2.1884 3.5441 3.5441 4.2206 4.2206 4.3614 4.3614 4.7426 4.7426 5.0471 5.0471 5.1386 5.1386 5.2972 5.2972 5.3956 5.3956 5.7317 5.7317 5.9993 5.9993 6.0162 6.0162 11.1809 11.1809 13.1280 13.1280 13.8243 13.8243 13.9314 13.9314 14.0885 14.0885 14.2792 14.2792 15.3508 15.3509 k = 0.2308-0.2126-0.1385 ( 4155 PWs) bands (ev): -31.1650 -31.1650 -14.1983 -14.1983 -14.1488 -14.1488 -13.1969 -13.1969 -13.1443 -13.1443 -12.8782 -12.8782 -12.7717 -12.7717 -12.5868 -12.5868 -12.3652 -12.3652 -12.1375 -12.1375 -11.4792 -11.4792 -10.8211 -10.8211 -10.6592 -10.6592 -10.1491 -10.1491 -9.8952 -9.8952 -1.3691 -1.3691 0.0823 0.0823 0.8978 0.8978 1.2620 1.2620 1.7734 1.7734 1.9131 1.9131 2.2165 2.2165 3.5098 3.5098 4.1826 4.1826 4.3227 4.3227 4.7184 4.7184 5.0452 5.0452 5.1305 5.1305 5.3091 5.3091 5.4051 5.4051 5.7121 5.7121 6.0093 6.0093 6.0273 6.0273 11.2355 11.2355 13.1245 13.1245 13.8344 13.8344 13.9251 13.9251 14.0855 14.0855 14.2853 14.2853 15.3039 15.3039 k = 0.2436-0.2244-0.1462 ( 4156 PWs) bands (ev): -31.1649 -31.1649 -14.2026 -14.2026 -14.1494 -14.1494 -13.2016 -13.2016 -13.1451 -13.1451 -12.8725 -12.8725 -12.7715 -12.7715 -12.5736 -12.5736 -12.3575 -12.3575 -12.1212 -12.1212 -11.4874 -11.4874 -10.8370 -10.8370 -10.6707 -10.6707 -10.1685 -10.1685 -9.8861 -9.8861 -1.3420 -1.3420 0.0991 0.0991 0.8972 0.8972 1.2819 1.2819 1.7648 1.7648 1.9369 1.9369 2.2455 2.2455 3.4714 3.4714 4.1457 4.1457 4.2855 4.2855 4.6916 4.6916 5.0409 5.0409 5.1232 5.1232 5.3146 5.3146 5.4218 5.4218 5.6940 5.6940 6.0095 6.0095 6.0488 6.0488 11.2905 11.2905 13.1210 13.1210 13.8443 13.8443 13.9187 13.9187 14.0823 14.0823 14.2915 14.2915 15.2569 15.2569 k = 0.2564-0.2362-0.1539 ( 4156 PWs) bands (ev): -31.1649 -31.1649 -14.2070 -14.2070 -14.1500 -14.1500 -13.2063 -13.2063 -13.1458 -13.1458 -12.8660 -12.8660 -12.7712 -12.7712 -12.5610 -12.5610 -12.3499 -12.3499 -12.1053 -12.1053 -11.4954 -11.4954 -10.8514 -10.8514 -10.6823 -10.6823 -10.1893 -10.1893 -9.8772 -9.8772 -1.3141 -1.3141 0.1143 0.1143 0.9001 0.9001 1.3022 1.3022 1.7541 1.7541 1.9625 1.9625 2.2752 2.2752 3.4290 3.4290 4.1090 4.1090 4.2508 4.2508 4.6628 4.6628 5.0345 5.0345 5.1159 5.1159 5.3166 5.3166 5.4422 5.4422 5.6780 5.6780 6.0093 6.0093 6.0714 6.0714 11.3455 11.3455 13.1172 13.1172 13.8538 13.8538 13.9125 13.9125 14.0791 14.0791 14.2975 14.2975 15.2104 15.2104 k = 0.2692-0.2480-0.1616 ( 4158 PWs) bands (ev): -31.1649 -31.1649 -14.2114 -14.2114 -14.1505 -14.1505 -13.2108 -13.2108 -13.1465 -13.1465 -12.8586 -12.8586 -12.7709 -12.7709 -12.5489 -12.5489 -12.3423 -12.3423 -12.0904 -12.0904 -11.5028 -11.5028 -10.8644 -10.8644 -10.6940 -10.6940 -10.2113 -10.2113 -9.8685 -9.8685 -1.2856 -1.2856 0.1275 0.1275 0.9070 0.9070 1.3228 1.3228 1.7421 1.7421 1.9889 1.9889 2.3053 2.3053 3.3829 3.3829 4.0713 4.0713 4.2201 4.2201 4.6325 4.6325 5.0266 5.0266 5.1082 5.1082 5.3175 5.3175 5.4628 5.4628 5.6645 5.6645 6.0097 6.0097 6.0942 6.0942 11.4003 11.4003 13.1131 13.1131 13.8622 13.8622 13.9066 13.9066 14.0766 14.0766 14.3032 14.3032 15.1649 15.1649 k = 0.2821-0.2598-0.1693 ( 4161 PWs) bands (ev): -31.1648 -31.1648 -14.2158 -14.2158 -14.1510 -14.1510 -13.2152 -13.2152 -13.1471 -13.1471 -12.8504 -12.8504 -12.7705 -12.7705 -12.5374 -12.5374 -12.3348 -12.3348 -12.0770 -12.0770 -11.5091 -11.5091 -10.8758 -10.8758 -10.7059 -10.7059 -10.2344 -10.2344 -9.8601 -9.8601 -1.2566 -1.2566 0.1382 0.1382 0.9182 0.9182 1.3435 1.3435 1.7295 1.7295 2.0153 2.0153 2.3358 2.3358 3.3336 3.3336 4.0318 4.0318 4.1943 4.1943 4.6010 4.6010 5.0178 5.0178 5.0996 5.0996 5.3188 5.3188 5.4807 5.4807 5.6546 5.6546 6.0109 6.0109 6.1172 6.1172 11.4546 11.4546 13.1085 13.1085 13.8687 13.8687 13.9019 13.9019 14.0751 14.0751 14.3085 14.3085 15.1207 15.1207 k = 0.2949-0.2717-0.1770 ( 4159 PWs) bands (ev): -31.1648 -31.1648 -14.2201 -14.2201 -14.1515 -14.1515 -13.2194 -13.2194 -13.1477 -13.1477 -12.8417 -12.8417 -12.7699 -12.7699 -12.5264 -12.5264 -12.3274 -12.3274 -12.0658 -12.0658 -11.5136 -11.5136 -10.8858 -10.8858 -10.7178 -10.7178 -10.2584 -10.2584 -9.8519 -9.8519 -1.2273 -1.2273 0.1463 0.1463 0.9338 0.9338 1.3641 1.3641 1.7168 1.7168 2.0414 2.0414 2.3663 2.3663 3.2817 3.2817 3.9902 3.9902 4.1737 4.1737 4.5688 4.5688 5.0084 5.0084 5.0899 5.0899 5.3209 5.3209 5.4938 5.4938 5.6492 5.6492 6.0130 6.0130 6.1403 6.1403 11.5084 11.5084 13.1033 13.1033 13.8717 13.8717 13.8996 13.8996 14.0751 14.0751 14.3133 14.3133 15.0781 15.0781 k = 0.3077-0.2835-0.1847 ( 4159 PWs) bands (ev): -31.1648 -31.1648 -14.2244 -14.2244 -14.1520 -14.1520 -13.2234 -13.2234 -13.1483 -13.1483 -12.8325 -12.8325 -12.7692 -12.7692 -12.5159 -12.5159 -12.3202 -12.3202 -12.0572 -12.0572 -11.5159 -11.5159 -10.8943 -10.8943 -10.7297 -10.7297 -10.2833 -10.2833 -9.8439 -9.8439 -1.1979 -1.1979 0.1517 0.1517 0.9539 0.9539 1.3843 1.3843 1.7042 1.7042 2.0668 2.0668 2.3966 2.3966 3.2281 3.2281 3.9466 3.9466 4.1582 4.1582 4.5363 4.5363 4.9988 4.9988 5.0791 5.0791 5.3240 5.3240 5.5005 5.5005 5.6491 5.6491 6.0160 6.0160 6.1634 6.1634 11.5613 11.5613 13.0974 13.0974 13.8703 13.8703 13.9005 13.9005 14.0767 14.0767 14.3174 14.3174 15.0375 15.0375 k = 0.3205-0.2953-0.1924 ( 4156 PWs) bands (ev): -31.1648 -31.1648 -14.2285 -14.2285 -14.1524 -14.1524 -13.2272 -13.2272 -13.1488 -13.1488 -12.8230 -12.8230 -12.7681 -12.7681 -12.5058 -12.5058 -12.3131 -12.3131 -12.0518 -12.0518 -11.5153 -11.5153 -10.9015 -10.9015 -10.7418 -10.7418 -10.3088 -10.3088 -9.8364 -9.8364 -1.1685 -1.1685 0.1544 0.1544 0.9782 0.9782 1.4040 1.4040 1.6921 1.6921 2.0912 2.0912 2.4262 2.4262 3.1734 3.1734 3.9017 3.9017 4.1469 4.1469 4.5036 4.5036 4.9891 4.9891 5.0674 5.0674 5.3279 5.3279 5.5008 5.5008 5.6540 5.6540 6.0200 6.0200 6.1865 6.1865 11.6131 11.6131 13.0906 13.0906 13.8659 13.8659 13.9032 13.9032 14.0801 14.0801 14.3209 14.3209 14.9992 14.9992 k = 0.3333-0.3071-0.2001 ( 4160 PWs) bands (ev): -31.1647 -31.1647 -14.2325 -14.2325 -14.1528 -14.1528 -13.2307 -13.2307 -13.1493 -13.1493 -12.8135 -12.8135 -12.7665 -12.7665 -12.4960 -12.4960 -12.3062 -12.3062 -12.0500 -12.0500 -11.5114 -11.5114 -10.9075 -10.9075 -10.7539 -10.7539 -10.3347 -10.3347 -9.8292 -9.8292 -1.1393 -1.1393 0.1545 0.1545 1.0064 1.0064 1.4227 1.4227 1.6809 1.6809 2.1144 2.1144 2.4546 2.4546 3.1187 3.1187 3.8563 3.8563 4.1392 4.1392 4.4712 4.4712 4.9796 4.9796 5.0551 5.0551 5.3325 5.3325 5.4961 5.4961 5.6621 5.6621 6.0249 6.0249 6.2093 6.2093 11.6637 11.6637 13.0830 13.0830 13.8602 13.8602 13.9058 13.9058 14.0854 14.0854 14.3236 14.3236 14.9634 14.9634 k = 0.3462-0.3189-0.2078 ( 4154 PWs) bands (ev): -31.1647 -31.1647 -14.2363 -14.2363 -14.1532 -14.1532 -13.2341 -13.2341 -13.1497 -13.1497 -12.8046 -12.8046 -12.7640 -12.7640 -12.4863 -12.4863 -12.2996 -12.2996 -12.0519 -12.0519 -11.5041 -11.5041 -10.9123 -10.9123 -10.7660 -10.7660 -10.3608 -10.3608 -9.8224 -9.8224 -1.1105 -1.1105 0.1525 0.1525 1.0382 1.0382 1.4401 1.4401 1.6710 1.6710 2.1362 2.1362 2.4812 2.4812 3.0648 3.0648 3.8111 3.8111 4.1345 4.1345 4.4394 4.4394 4.9704 4.9704 5.0425 5.0425 5.3374 5.3374 5.4882 5.4882 5.6718 5.6718 6.0306 6.0306 6.2319 6.2319 11.7128 11.7128 13.0744 13.0744 13.8543 13.8543 13.9076 13.9076 14.0925 14.0925 14.3255 14.3255 14.9303 14.9303 k = 0.3590-0.3307-0.2155 ( 4158 PWs) bands (ev): -31.1647 -31.1647 -14.2399 -14.2399 -14.1535 -14.1535 -13.2372 -13.2372 -13.1501 -13.1501 -12.7968 -12.7968 -12.7603 -12.7603 -12.4768 -12.4768 -12.2932 -12.2932 -12.0575 -12.0575 -11.4934 -11.4934 -10.9162 -10.9162 -10.7782 -10.7782 -10.3868 -10.3868 -9.8160 -9.8160 -1.0824 -1.0824 0.1485 0.1485 1.0729 1.0729 1.4557 1.4557 1.6628 1.6628 2.1564 2.1564 2.5052 2.5052 3.0131 3.0131 3.7668 3.7668 4.1322 4.1322 4.4083 4.4083 4.9617 4.9617 5.0298 5.0298 5.3425 5.3425 5.4784 5.4784 5.6817 5.6817 6.0368 6.0368 6.2540 6.2540 11.7602 11.7602 13.0649 13.0649 13.8484 13.8484 13.9084 13.9084 14.1009 14.1009 14.3266 14.3266 14.9001 14.9001 k = 0.3718-0.3425-0.2232 ( 4154 PWs) bands (ev): -31.1646 -31.1646 -14.2433 -14.2433 -14.1538 -14.1538 -13.2400 -13.2400 -13.1505 -13.1505 -12.7907 -12.7907 -12.7549 -12.7549 -12.4673 -12.4673 -12.2871 -12.2871 -12.0665 -12.0665 -11.4796 -11.4796 -10.9193 -10.9193 -10.7905 -10.7905 -10.4123 -10.4123 -9.8101 -9.8101 -1.0553 -1.0553 0.1430 0.1430 1.1098 1.1098 1.4691 1.4691 1.6567 1.6567 2.1749 2.1749 2.5253 2.5253 2.9650 2.9650 3.7240 3.7240 4.1317 4.1317 4.3782 4.3782 4.9534 4.9534 5.0173 5.0173 5.3476 5.3476 5.4678 5.4678 5.6910 5.6910 6.0434 6.0434 6.2753 6.2753 11.8055 11.8055 13.0545 13.0545 13.8429 13.8429 13.9082 13.9082 14.1105 14.1105 14.3269 14.3269 14.8729 14.8729 k = 0.3846-0.3543-0.2309 ( 4156 PWs) bands (ev): -31.1646 -31.1646 -14.2465 -14.2465 -14.1541 -14.1541 -13.2426 -13.2426 -13.1509 -13.1509 -12.7865 -12.7865 -12.7478 -12.7478 -12.4577 -12.4577 -12.2812 -12.2812 -12.0785 -12.0785 -11.4633 -11.4633 -10.9217 -10.9217 -10.8027 -10.8027 -10.4371 -10.4371 -9.8046 -9.8046 -1.0294 -1.0294 0.1364 0.1364 1.1482 1.1482 1.4799 1.4799 1.6531 1.6531 2.1914 2.1914 2.5401 2.5401 2.9223 2.9223 3.6832 3.6832 4.1327 4.1327 4.3495 4.3495 4.9458 4.9458 5.0052 5.0052 5.3526 5.3526 5.4569 5.4569 5.6992 5.6992 6.0501 6.0501 6.2957 6.2957 11.8486 11.8486 13.0435 13.0435 13.8379 13.8379 13.9072 13.9072 14.1207 14.1207 14.3265 14.3265 14.8489 14.8489 k = 0.3974-0.3661-0.2386 ( 4156 PWs) bands (ev): -31.1646 -31.1646 -14.2494 -14.2494 -14.1544 -14.1544 -13.2449 -13.2449 -13.1512 -13.1512 -12.7837 -12.7837 -12.7397 -12.7397 -12.4480 -12.4480 -12.2757 -12.2757 -12.0929 -12.0929 -11.4450 -11.4450 -10.9235 -10.9235 -10.8149 -10.8149 -10.4607 -10.4607 -9.7997 -9.7997 -1.0050 -1.0050 0.1291 0.1291 1.1873 1.1873 1.4877 1.4877 1.6523 1.6523 2.2059 2.2059 2.5478 2.5478 2.8872 2.8872 3.6452 3.6452 4.1348 4.1348 4.3223 4.3223 4.9388 4.9388 4.9937 4.9937 5.3573 5.3573 5.4462 5.4462 5.7063 5.7063 6.0567 6.0567 6.3148 6.3148 11.8889 11.8889 13.0320 13.0320 13.8334 13.8334 13.9056 13.9056 14.1312 14.1312 14.3254 14.3254 14.8279 14.8279 k = 0.4103-0.3780-0.2463 ( 4152 PWs) bands (ev): -31.1646 -31.1646 -14.2519 -14.2519 -14.1546 -14.1546 -13.2469 -13.2469 -13.1514 -13.1514 -12.7819 -12.7819 -12.7313 -12.7313 -12.4382 -12.4382 -12.2703 -12.2703 -12.1090 -12.1090 -11.4256 -11.4256 -10.9250 -10.9250 -10.8269 -10.8269 -10.4827 -10.4827 -9.7953 -9.7953 -0.9824 -0.9824 0.1215 0.1215 1.2260 1.2260 1.4927 1.4927 1.6540 1.6540 2.2182 2.2182 2.5471 2.5471 2.8615 2.8615 3.6103 3.6103 4.1378 4.1378 4.2970 4.2970 4.9325 4.9325 4.9829 4.9829 5.3618 5.3618 5.4361 5.4361 5.7123 5.7123 6.0631 6.0631 6.3325 6.3325 11.9263 11.9263 13.0202 13.0202 13.8295 13.8295 13.9035 13.9035 14.1415 14.1415 14.3238 14.3238 14.8100 14.8100 k = 0.4231-0.3898-0.2540 ( 4156 PWs) bands (ev): -31.1646 -31.1646 -14.2542 -14.2542 -14.1548 -14.1548 -13.2487 -13.2487 -13.1516 -13.1516 -12.7808 -12.7808 -12.7230 -12.7230 -12.4283 -12.4283 -12.2651 -12.2651 -12.1263 -12.1263 -11.4059 -11.4059 -10.9262 -10.9262 -10.8385 -10.8385 -10.5029 -10.5029 -9.7915 -9.7915 -0.9620 -0.9620 0.1139 0.1139 1.2634 1.2634 1.4954 1.4954 1.6577 1.6577 2.2282 2.2282 2.5381 2.5381 2.8456 2.8456 3.5791 3.5791 4.1413 4.1413 4.2739 4.2739 4.9270 4.9270 4.9732 4.9732 5.3660 5.3660 5.4267 5.4267 5.7172 5.7172 6.0689 6.0689 6.3484 6.3484 11.9601 11.9601 13.0087 13.0087 13.8262 13.8262 13.9013 13.9013 14.1514 14.1514 14.3219 14.3219 14.7950 14.7950 k = 0.4359-0.4016-0.2617 ( 4160 PWs) bands (ev): -31.1646 -31.1646 -14.2562 -14.2562 -14.1550 -14.1550 -13.2502 -13.2502 -13.1518 -13.1518 -12.7800 -12.7800 -12.7155 -12.7155 -12.4185 -12.4185 -12.2600 -12.2600 -12.1441 -12.1441 -11.3868 -11.3868 -10.9274 -10.9274 -10.8494 -10.8494 -10.5206 -10.5206 -9.7882 -9.7882 -0.9440 -0.9440 0.1068 0.1068 1.2982 1.2982 1.4963 1.4963 1.6627 1.6627 2.2359 2.2359 2.5228 2.5228 2.8382 2.8382 3.5518 3.5518 4.1453 4.1453 4.2531 4.2531 4.9224 4.9224 4.9647 4.9647 5.3698 5.3698 5.4181 5.4181 5.7212 5.7212 6.0740 6.0740 6.3623 6.3623 11.9900 11.9900 12.9977 12.9977 13.8234 13.8234 13.8990 13.8990 14.1605 14.1605 14.3197 14.3197 14.7827 14.7827 k = 0.4487-0.4134-0.2694 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2578 -14.2578 -14.1551 -14.1551 -13.2514 -13.2514 -13.1520 -13.1520 -12.7794 -12.7794 -12.7089 -12.7089 -12.4092 -12.4092 -12.2546 -12.2546 -12.1619 -12.1619 -11.3691 -11.3691 -10.9286 -10.9286 -10.8591 -10.8591 -10.5357 -10.5357 -9.7855 -9.7855 -0.9288 -0.9288 0.1005 0.1005 1.3292 1.3292 1.4962 1.4962 1.6682 1.6682 2.2412 2.2412 2.5047 2.5047 2.8366 2.8366 3.5291 3.5291 4.1496 4.1496 4.2349 4.2349 4.9185 4.9185 4.9575 4.9575 5.3734 5.3734 5.4105 5.4105 5.7243 5.7243 6.0784 6.0784 6.3740 6.3740 12.0154 12.0154 12.9878 12.9878 13.8212 13.8212 13.8970 13.8970 14.1684 14.1684 14.3175 14.3175 14.7731 14.7731 k = 0.4615-0.4252-0.2771 ( 4151 PWs) bands (ev): -31.1645 -31.1645 -14.2591 -14.2591 -14.1553 -14.1553 -13.2523 -13.2523 -13.1521 -13.1521 -12.7790 -12.7790 -12.7036 -12.7036 -12.4007 -12.4007 -12.2487 -12.2487 -12.1789 -12.1789 -11.3540 -11.3540 -10.9299 -10.9299 -10.8673 -10.8673 -10.5477 -10.5477 -9.7833 -9.7833 -0.9166 -0.9166 0.0952 0.0952 1.3550 1.3550 1.4956 1.4956 1.6734 1.6734 2.2445 2.2445 2.4873 2.4873 2.8380 2.8380 3.5110 3.5110 4.1540 4.1540 4.2195 4.2195 4.9154 4.9154 4.9517 4.9517 5.3766 5.3766 5.4040 5.4040 5.7266 5.7266 6.0819 6.0819 6.3833 6.3833 12.0359 12.0359 12.9794 12.9794 13.8194 13.8194 13.8952 13.8952 14.1750 14.1750 14.3156 14.3156 14.7658 14.7658 k = 0.4744-0.4370-0.2848 ( 4147 PWs) bands (ev): -31.1645 -31.1645 -14.2600 -14.2600 -14.1553 -14.1553 -13.2530 -13.2530 -13.1522 -13.1522 -12.7788 -12.7788 -12.6997 -12.6997 -12.3939 -12.3939 -12.2421 -12.2421 -12.1945 -12.1945 -11.3423 -11.3423 -10.9311 -10.9311 -10.8733 -10.8733 -10.5565 -10.5565 -9.7818 -9.7818 -0.9077 -0.9077 0.0912 0.0912 1.3745 1.3745 1.4951 1.4951 1.6776 1.6776 2.2461 2.2461 2.4732 2.4732 2.8404 2.8404 3.4979 3.4979 4.1583 4.1583 4.2073 4.2073 4.9132 4.9132 4.9475 4.9475 5.3797 5.3797 5.3986 5.3986 5.7282 5.7282 6.0844 6.0844 6.3901 6.3901 12.0509 12.0509 12.9731 12.9731 13.8182 13.8182 13.8939 13.8939 14.1798 14.1798 14.3140 14.3140 14.7607 14.7607 k = 0.4872-0.4488-0.2925 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2605 -14.2605 -14.1554 -14.1554 -13.2534 -13.2534 -13.1522 -13.1522 -12.7787 -12.7787 -12.6973 -12.6973 -12.3894 -12.3894 -12.2346 -12.2346 -12.2079 -12.2079 -11.3348 -11.3348 -10.9321 -10.9321 -10.8771 -10.8771 -10.5618 -10.5618 -9.7809 -9.7809 -0.9023 -0.9023 0.0888 0.0888 1.3866 1.3866 1.4948 1.4948 1.6803 1.6803 2.2467 2.2467 2.4642 2.4642 2.8423 2.8423 3.4900 3.4900 4.1620 4.1620 4.1988 4.1988 4.9119 4.9119 4.9449 4.9449 5.3824 5.3824 5.3944 5.3944 5.7291 5.7291 6.0860 6.0860 6.3942 6.3942 12.0600 12.0600 12.9691 12.9691 13.8175 13.8175 13.8930 13.8930 14.1828 14.1828 14.3130 14.3130 14.7578 14.7578 k = 0.5000-0.4606-0.3002 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2607 -14.2607 -14.1554 -14.1554 -13.2536 -13.2536 -13.1523 -13.1523 -12.7786 -12.7786 -12.6965 -12.6965 -12.3879 -12.3879 -12.2294 -12.2294 -12.2152 -12.2152 -11.3323 -11.3323 -10.9324 -10.9324 -10.8783 -10.8783 -10.5636 -10.5636 -9.7806 -9.7806 -0.9005 -0.9005 0.0880 0.0880 1.3907 1.3907 1.4947 1.4947 1.6813 1.6813 2.2468 2.2468 2.4611 2.4611 2.8430 2.8430 3.4873 3.4873 4.1636 4.1636 4.1957 4.1957 4.9115 4.9115 4.9441 4.9441 5.3837 5.3837 5.3926 5.3926 5.7295 5.7295 6.0865 6.0865 6.3955 6.3955 12.0631 12.0631 12.9677 12.9677 13.8173 13.8173 13.8927 13.8927 14.1838 14.1838 14.3127 14.3127 14.7568 14.7568 k = 0.5000-0.4606-0.3002 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2607 -14.2607 -14.1554 -14.1554 -13.2536 -13.2536 -13.1523 -13.1523 -12.7786 -12.7786 -12.6965 -12.6965 -12.3879 -12.3879 -12.2294 -12.2294 -12.2152 -12.2152 -11.3323 -11.3323 -10.9324 -10.9324 -10.8783 -10.8783 -10.5636 -10.5636 -9.7806 -9.7806 -0.9005 -0.9005 0.0880 0.0880 1.3907 1.3907 1.4947 1.4947 1.6813 1.6813 2.2468 2.2468 2.4611 2.4611 2.8430 2.8430 3.4873 3.4873 4.1636 4.1636 4.1957 4.1957 4.9115 4.9115 4.9441 4.9441 5.3837 5.3837 5.3926 5.3926 5.7295 5.7295 6.0865 6.0865 6.3955 6.3955 12.0631 12.0631 12.9677 12.9677 13.8173 13.8173 13.8927 13.8927 14.1838 14.1838 14.3127 14.3127 14.7568 14.7568 k = 0.5000-0.4503-0.3160 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2605 -14.2605 -14.1556 -14.1556 -13.2534 -13.2534 -13.1524 -13.1524 -12.7786 -12.7786 -12.6966 -12.6966 -12.3886 -12.3886 -12.2325 -12.2325 -12.2104 -12.2104 -11.3324 -11.3324 -10.9332 -10.9332 -10.8809 -10.8809 -10.5602 -10.5602 -9.7816 -9.7816 -0.8999 -0.8999 0.0898 0.0898 1.3870 1.3870 1.4923 1.4923 1.6854 1.6854 2.2464 2.2464 2.4620 2.4620 2.8412 2.8412 3.4890 3.4890 4.1568 4.1568 4.2026 4.2026 4.9018 4.9018 4.9533 4.9533 5.3818 5.3818 5.3952 5.3952 5.7275 5.7275 6.0871 6.0871 6.3954 6.3954 12.0632 12.0632 12.9693 12.9693 13.8167 13.8167 13.8923 13.8923 14.1832 14.1832 14.3146 14.3146 14.7559 14.7559 k = 0.5000-0.4400-0.3318 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2601 -14.2601 -14.1560 -14.1560 -13.2531 -13.2531 -13.1529 -13.1529 -12.7787 -12.7787 -12.6970 -12.6970 -12.3909 -12.3909 -12.2375 -12.2375 -12.2002 -12.2002 -11.3327 -11.3327 -10.9365 -10.9365 -10.8870 -10.8870 -10.5503 -10.5503 -9.7847 -9.7847 -0.8981 -0.8981 0.0951 0.0951 1.3762 1.3762 1.4862 1.4862 1.6969 1.6969 2.2452 2.2452 2.4646 2.4646 2.8358 2.8358 3.4941 3.4941 4.1435 4.1435 4.2163 4.2163 4.8841 4.8841 4.9696 4.9696 5.3784 5.3784 5.4006 5.4006 5.7217 5.7217 6.0889 6.0889 6.3951 6.3951 12.0636 12.0636 12.9739 12.9739 13.8150 13.8150 13.8913 13.8913 14.1813 14.1813 14.3201 14.3201 14.7533 14.7533 k = 0.5000-0.4297-0.3476 ( 4162 PWs) bands (ev): -31.1645 -31.1645 -14.2593 -14.2593 -14.1568 -14.1568 -13.2525 -13.2525 -13.1537 -13.1537 -12.7787 -12.7787 -12.6975 -12.6975 -12.3944 -12.3944 -12.2422 -12.2422 -12.1874 -12.1874 -11.3332 -11.3332 -10.9453 -10.9453 -10.8925 -10.8925 -10.5353 -10.5353 -9.7898 -9.7898 -0.8952 -0.8952 0.1041 0.1041 1.3586 1.3586 1.4779 1.4779 1.7136 1.7136 2.2432 2.2432 2.4690 2.4690 2.8272 2.8272 3.5022 3.5022 4.1289 4.1289 4.2317 4.2317 4.8648 4.8648 4.9866 4.9866 5.3749 5.3749 5.4074 5.4074 5.7123 5.7123 6.0919 6.0919 6.3945 6.3945 12.0643 12.0643 12.9814 12.9814 13.8113 13.8113 13.8902 13.8902 14.1789 14.1789 14.3287 14.3287 14.7491 14.7491 k = 0.5000-0.4194-0.3634 ( 4156 PWs) bands (ev): -31.1645 -31.1645 -14.2583 -14.2583 -14.1579 -14.1579 -13.2517 -13.2517 -13.1549 -13.1549 -12.7788 -12.7788 -12.6982 -12.6982 -12.3989 -12.3989 -12.2462 -12.2462 -12.1722 -12.1722 -11.3341 -11.3341 -10.9617 -10.9617 -10.8937 -10.8937 -10.5167 -10.5167 -9.7968 -9.7968 -0.8911 -0.8911 0.1166 0.1166 1.3353 1.3353 1.4687 1.4687 1.7333 1.7333 2.2406 2.2406 2.4749 2.4749 2.8157 2.8157 3.5129 3.5129 4.1140 4.1140 4.2479 4.2479 4.8453 4.8453 5.0026 5.0026 5.3712 5.3712 5.4154 5.4154 5.6997 5.6997 6.0959 6.0959 6.3937 6.3937 12.0653 12.0653 12.9918 12.9918 13.8050 13.8050 13.8900 13.8900 14.1765 14.1765 14.3395 14.3395 14.7434 14.7434 k = 0.5000-0.4091-0.3793 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2569 -14.2569 -14.1594 -14.1594 -13.2507 -13.2507 -13.1563 -13.1563 -12.7788 -12.7788 -12.6991 -12.6991 -12.4042 -12.4042 -12.2498 -12.2498 -12.1549 -12.1549 -11.3353 -11.3353 -10.9841 -10.9841 -10.8908 -10.8908 -10.4957 -10.4957 -9.8058 -9.8058 -0.8860 -0.8860 0.1326 0.1326 1.3075 1.3075 1.4590 1.4590 1.7547 1.7547 2.2372 2.2372 2.4824 2.4824 2.8019 2.8019 3.5256 3.5256 4.0995 4.0995 4.2644 4.2644 4.8259 4.8259 5.0171 5.0171 5.3675 5.3675 5.4245 5.4245 5.6843 5.6843 6.1008 6.1008 6.3926 6.3926 12.0668 12.0668 13.0049 13.0049 13.7954 13.7954 13.8913 13.8913 14.1747 14.1747 14.3520 14.3520 14.7363 14.7363 k = 0.5000-0.3988-0.3951 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2553 -14.2553 -14.1610 -14.1610 -13.2494 -13.2494 -13.1580 -13.1580 -12.7789 -12.7789 -12.7001 -12.7001 -12.4101 -12.4101 -12.2530 -12.2530 -12.1357 -12.1357 -11.3371 -11.3371 -11.0104 -11.0104 -10.8851 -10.8851 -10.4733 -10.4733 -9.8166 -9.8166 -0.8798 -0.8798 0.1519 0.1519 1.2764 1.2764 1.4485 1.4485 1.7766 1.7766 2.2333 2.2333 2.4912 2.4912 2.7864 2.7864 3.5396 3.5396 4.0857 4.0857 4.2812 4.2812 4.8069 4.8069 5.0297 5.0297 5.3634 5.3634 5.4345 5.4345 5.6668 5.6668 6.1066 6.1066 6.3912 6.3912 12.0687 12.0687 13.0205 13.0205 13.7823 13.7823 13.8944 13.8944 14.1738 14.1738 14.3656 14.3656 14.7281 14.7281 k = 0.5000-0.3885-0.4109 ( 4148 PWs) bands (ev): -31.1645 -31.1645 -14.2534 -14.2534 -14.1630 -14.1630 -13.2479 -13.2479 -13.1599 -13.1599 -12.7790 -12.7790 -12.7012 -12.7012 -12.4164 -12.4164 -12.2562 -12.2562 -12.1145 -12.1145 -11.3396 -11.3396 -11.0385 -11.0385 -10.8773 -10.8773 -10.4502 -10.4502 -9.8292 -9.8292 -0.8728 -0.8728 0.1745 0.1745 1.2430 1.2430 1.4372 1.4372 1.7984 1.7984 2.2288 2.2288 2.5012 2.5012 2.7697 2.7697 3.5541 3.5541 4.0730 4.0730 4.2982 4.2982 4.7885 4.7885 5.0399 5.0399 5.3587 5.3587 5.4452 5.4452 5.6480 5.6480 6.1132 6.1132 6.3894 6.3894 12.0712 12.0712 13.0383 13.0383 13.7660 13.7660 13.8989 13.8989 14.1742 14.1742 14.3797 14.3797 14.7189 14.7189 k = 0.5000-0.3782-0.4267 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2512 -14.2512 -14.1652 -14.1652 -13.2463 -13.2463 -13.1620 -13.1620 -12.7790 -12.7790 -12.7023 -12.7023 -12.4230 -12.4230 -12.2592 -12.2592 -12.0917 -12.0917 -11.3432 -11.3432 -11.0674 -11.0674 -10.8681 -10.8681 -10.4271 -10.4271 -9.8435 -9.8435 -0.8649 -0.8649 0.2003 0.2003 1.2079 1.2079 1.4248 1.4248 1.8198 1.8198 2.2237 2.2237 2.5123 2.5123 2.7525 2.7525 3.5684 3.5684 4.0617 4.0617 4.3154 4.3154 4.7708 4.7708 5.0474 5.0474 5.3529 5.3529 5.4565 5.4565 5.6287 5.6287 6.1205 6.1205 6.3872 6.3872 12.0743 12.0743 13.0581 13.0581 13.7468 13.7468 13.9045 13.9045 14.1760 14.1760 14.3940 14.3940 14.7093 14.7093 k = 0.5000-0.3678-0.4425 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2488 -14.2488 -14.1676 -14.1676 -13.2444 -13.2444 -13.1643 -13.1643 -12.7790 -12.7790 -12.7035 -12.7035 -12.4298 -12.4298 -12.2622 -12.2622 -12.0673 -12.0673 -11.3483 -11.3483 -11.0958 -11.0958 -10.8576 -10.8576 -10.4044 -10.4044 -9.8592 -9.8592 -0.8563 -0.8563 0.2292 0.2292 1.1719 1.1719 1.4114 1.4114 1.8403 1.8403 2.2182 2.2182 2.5241 2.5241 2.7353 2.7353 3.5819 3.5819 4.0523 4.0523 4.3327 4.3327 4.7537 4.7537 5.0522 5.0522 5.3454 5.3454 5.4680 5.4680 5.6101 5.6101 6.1287 6.1287 6.3846 6.3846 12.0782 12.0782 13.0795 13.0795 13.7254 13.7254 13.9108 13.9108 14.1793 14.1793 14.4079 14.4079 14.6997 14.6997 k = 0.5000-0.3575-0.4584 ( 4156 PWs) bands (ev): -31.1645 -31.1645 -14.2462 -14.2462 -14.1702 -14.1702 -13.2423 -13.2423 -13.1667 -13.1667 -12.7790 -12.7790 -12.7046 -12.7046 -12.4366 -12.4366 -12.2652 -12.2652 -12.0414 -12.0414 -11.3555 -11.3555 -11.1227 -11.1227 -10.8462 -10.8462 -10.3823 -10.3823 -9.8763 -9.8763 -0.8472 -0.8472 0.2609 0.2609 1.1353 1.1353 1.3968 1.3968 1.8599 1.8599 2.2123 2.2123 2.5366 2.5366 2.7187 2.7187 3.5935 3.5935 4.0454 4.0454 4.3503 4.3503 4.7374 4.7374 5.0540 5.0540 5.3354 5.3354 5.4796 5.4796 5.5935 5.5935 6.1376 6.1376 6.3813 6.3813 12.0827 12.0827 13.1024 13.1024 13.7020 13.7020 13.9172 13.9172 14.1843 14.1843 14.4209 14.4209 14.6907 14.6907 k = 0.5000-0.3472-0.4742 ( 4166 PWs) bands (ev): -31.1645 -31.1645 -14.2434 -14.2434 -14.1730 -14.1730 -13.2401 -13.2401 -13.1692 -13.1692 -12.7789 -12.7789 -12.7057 -12.7057 -12.4435 -12.4435 -12.2683 -12.2683 -12.0141 -12.0141 -11.3655 -11.3655 -11.1471 -11.1471 -10.8339 -10.8339 -10.3612 -10.3612 -9.8946 -9.8946 -0.8376 -0.8376 0.2953 0.2953 1.0984 1.0984 1.3810 1.3810 1.8784 1.8784 2.2059 2.2059 2.5494 2.5494 2.7032 2.7032 3.6028 3.6028 4.0415 4.0415 4.3680 4.3680 4.7217 4.7217 5.0528 5.0528 5.3218 5.3218 5.4909 5.4909 5.5799 5.5799 6.1473 6.1473 6.3775 6.3775 12.0880 12.0880 13.1263 13.1263 13.6772 13.6772 13.9235 13.9235 14.1908 14.1908 14.4322 14.4322 14.6832 14.6832 k = 0.5000-0.3369-0.4900 ( 4162 PWs) bands (ev): -31.1645 -31.1645 -14.2403 -14.2403 -14.1760 -14.1760 -13.2377 -13.2377 -13.1718 -13.1718 -12.7788 -12.7788 -12.7068 -12.7068 -12.4504 -12.4504 -12.2715 -12.2715 -11.9855 -11.9855 -11.3790 -11.3790 -11.1680 -11.1680 -10.8210 -10.8210 -10.3413 -10.3413 -9.9138 -9.9138 -0.8279 -0.8279 0.3322 0.3322 1.0617 1.0617 1.3641 1.3641 1.8957 1.8957 2.1991 2.1991 2.5620 2.5620 2.6895 2.6895 3.6091 3.6091 4.0409 4.0409 4.3858 4.3858 4.7066 4.7066 5.0489 5.0489 5.3043 5.3043 5.5017 5.5017 5.5704 5.5704 6.1579 6.1579 6.3731 6.3731 12.0941 12.0941 13.1511 13.1511 13.6512 13.6512 13.9294 13.9294 14.1988 14.1988 14.4410 14.4410 14.6781 14.6781 k = 0.5000-0.3266-0.5058 ( 4164 PWs) bands (ev): -31.1645 -31.1645 -14.2371 -14.2371 -14.1790 -14.1790 -13.2352 -13.2352 -13.1743 -13.1743 -12.7786 -12.7786 -12.7078 -12.7078 -12.4572 -12.4572 -12.2748 -12.2748 -11.9559 -11.9559 -11.3965 -11.3965 -11.1846 -11.1846 -10.8076 -10.8076 -10.3228 -10.3228 -9.9337 -9.9337 -0.8181 -0.8181 0.3714 0.3714 1.0255 1.0255 1.3462 1.3462 1.9117 1.9117 2.1919 2.1919 2.5739 2.5739 2.6784 2.6784 3.6120 3.6120 4.0440 4.0440 4.4036 4.4036 4.6920 4.6920 5.0426 5.0426 5.2826 5.2826 5.5119 5.5119 5.5651 5.5651 6.1692 6.1692 6.3679 6.3679 12.1008 12.1008 13.1764 13.1764 13.6245 13.6245 13.9346 13.9346 14.2081 14.2081 14.4466 14.4466 14.6766 14.6766 k = 0.5000-0.3163-0.5217 ( 4166 PWs) bands (ev): -31.1645 -31.1645 -14.2338 -14.2338 -14.1821 -14.1821 -13.2325 -13.2325 -13.1768 -13.1768 -12.7784 -12.7784 -12.7088 -12.7088 -12.4639 -12.4639 -12.2783 -12.2783 -11.9252 -11.9252 -11.4179 -11.4179 -11.1969 -11.1969 -10.7940 -10.7940 -10.3060 -10.3060 -9.9537 -9.9537 -0.8085 -0.8085 0.4125 0.4125 0.9901 0.9901 1.3272 1.3272 1.9264 1.9264 2.1843 2.1843 2.5842 2.5842 2.6708 2.6708 3.6115 3.6115 4.0506 4.0506 4.4215 4.4215 4.6779 4.6779 5.0340 5.0340 5.2572 5.2572 5.5214 5.5214 5.5638 5.5638 6.1813 6.1813 6.3619 6.3619 12.1081 12.1081 13.2019 13.2019 13.5971 13.5971 13.9392 13.9392 14.2187 14.2187 14.4482 14.4482 14.6793 14.6793 k = 0.5000-0.3060-0.5375 ( 4168 PWs) bands (ev): -31.1645 -31.1645 -14.2303 -14.2303 -14.1853 -14.1853 -13.2298 -13.2298 -13.1792 -13.1792 -12.7782 -12.7782 -12.7098 -12.7098 -12.4704 -12.4704 -12.2820 -12.2820 -11.8936 -11.8936 -11.4426 -11.4426 -11.2051 -11.2051 -10.7803 -10.7803 -10.2913 -10.2913 -9.9736 -9.9736 -0.7994 -0.7994 0.4553 0.4553 0.9557 0.9557 1.3074 1.3074 1.9399 1.9399 2.1762 2.1762 2.5917 2.5917 2.6681 2.6681 3.6076 3.6076 4.0605 4.0605 4.4393 4.4393 4.6639 4.6639 5.0236 5.0236 5.2291 5.2291 5.5302 5.5302 5.5656 5.5656 6.1940 6.1940 6.3551 6.3551 12.1159 12.1159 13.2273 13.2273 13.5696 13.5696 13.9429 13.9429 14.2301 14.2301 14.4457 14.4457 14.6865 14.6865 k = 0.5000-0.2957-0.5533 ( 4162 PWs) bands (ev): -31.1644 -31.1644 -14.2267 -14.2267 -14.1884 -14.1884 -13.2271 -13.2271 -13.1815 -13.1815 -12.7779 -12.7779 -12.7108 -12.7108 -12.4766 -12.4766 -12.2860 -12.2860 -11.8612 -11.8612 -11.4699 -11.4699 -11.2099 -11.2099 -10.7668 -10.7668 -10.2790 -10.2790 -9.9926 -9.9926 -0.7909 -0.7909 0.4993 0.4993 0.9228 0.9228 1.2870 1.2870 1.9522 1.9522 2.1678 2.1678 2.5957 2.5957 2.6707 2.6707 3.6008 3.6008 4.0734 4.0734 4.4571 4.4571 4.6499 4.6499 5.0119 5.0119 5.1993 5.1993 5.5385 5.5385 5.5696 5.5696 6.2072 6.2072 6.3475 6.3475 12.1240 12.1240 13.2523 13.2523 13.5422 13.5422 13.9459 13.9459 14.2422 14.2422 14.4395 14.4395 14.6981 14.6981 k = 0.5000-0.2854-0.5691 ( 4160 PWs) bands (ev): -31.1644 -31.1644 -14.2231 -14.2231 -14.1916 -14.1916 -13.2244 -13.2244 -13.1835 -13.1835 -12.7776 -12.7776 -12.7117 -12.7117 -12.4826 -12.4826 -12.2903 -12.2903 -11.8282 -11.8282 -11.4987 -11.4987 -11.2119 -11.2119 -10.7537 -10.7537 -10.2695 -10.2695 -10.0102 -10.0102 -0.7833 -0.7833 0.5441 0.5441 0.8915 0.8915 1.2662 1.2662 1.9633 1.9633 2.1590 2.1590 2.5969 2.5969 2.6781 2.6781 3.5915 3.5915 4.0885 4.0885 4.4746 4.4746 4.6357 4.6357 4.9991 4.9991 5.1690 5.1690 5.5461 5.5461 5.5752 5.5752 6.2207 6.2207 6.3389 6.3389 12.1323 12.1323 13.2765 13.2765 13.5152 13.5152 13.9483 13.9483 14.2547 14.2547 14.4305 14.4305 14.7131 14.7131 k = 0.5000-0.2751-0.5849 ( 4154 PWs) bands (ev): -31.1644 -31.1644 -14.2195 -14.2195 -14.1946 -14.1946 -13.2218 -13.2218 -13.1851 -13.1851 -12.7773 -12.7773 -12.7128 -12.7128 -12.4882 -12.4882 -12.2951 -12.2951 -11.7947 -11.7947 -11.5282 -11.5282 -11.2118 -11.2118 -10.7413 -10.7413 -10.2634 -10.2634 -10.0254 -10.0254 -0.7770 -0.7770 0.5891 0.5891 0.8624 0.8624 1.2454 1.2454 1.9736 1.9736 2.1497 2.1497 2.5967 2.5967 2.6884 2.6884 3.5803 3.5803 4.1053 4.1053 4.4917 4.4917 4.6213 4.6213 4.9859 4.9859 5.1391 5.1391 5.5530 5.5530 5.5817 5.5817 6.2344 6.2344 6.3293 6.3293 12.1403 12.1403 13.2997 13.2997 13.4889 13.4889 13.9501 13.9501 14.2670 14.2670 14.4197 14.4197 14.7304 14.7304 k = 0.5000-0.2648-0.6008 ( 4158 PWs) bands (ev): -31.1644 -31.1644 -14.2160 -14.2160 -14.1973 -14.1973 -13.2195 -13.2195 -13.1864 -13.1864 -12.7771 -12.7771 -12.7139 -12.7139 -12.4934 -12.4934 -12.3003 -12.3003 -11.7611 -11.7611 -11.5578 -11.5578 -11.2099 -11.2099 -10.7299 -10.7299 -10.2610 -10.2610 -10.0377 -10.0377 -0.7722 -0.7722 0.6333 0.6333 0.8357 0.8357 1.2249 1.2249 1.9832 1.9832 2.1401 2.1401 2.5964 2.5964 2.7003 2.7003 3.5677 3.5677 4.1232 4.1232 4.5081 4.5081 4.6066 4.6066 4.9725 4.9725 5.1105 5.1105 5.5592 5.5592 5.5888 5.5888 6.2479 6.2479 6.3187 6.3187 12.1480 12.1480 13.3214 13.3214 13.4640 13.4640 13.9514 13.9514 14.2787 14.2787 14.4081 14.4081 14.7488 14.7488 k = 0.5000-0.2544-0.6166 ( 4156 PWs) bands (ev): -31.1644 -31.1644 -14.2129 -14.2129 -14.1996 -14.1996 -13.2175 -13.2175 -13.1870 -13.1870 -12.7768 -12.7768 -12.7151 -12.7151 -12.4983 -12.4983 -12.3060 -12.3060 -11.7278 -11.7278 -11.5863 -11.5863 -11.2067 -11.2067 -10.7199 -10.7199 -10.2624 -10.2624 -10.0464 -10.0464 -0.7691 -0.7691 0.6755 0.6755 0.8123 0.8123 1.2055 1.2055 1.9923 1.9923 2.1300 2.1300 2.5967 2.5967 2.7128 2.7128 3.5543 3.5543 4.1416 4.1416 4.5226 4.5226 4.5927 4.5927 4.9595 4.9595 5.0841 5.0841 5.5646 5.5646 5.5963 5.5963 6.2610 6.2610 6.3073 6.3073 12.1549 12.1549 13.3410 13.3410 13.4411 13.4411 13.9525 13.9525 14.2891 14.2891 14.3970 14.3970 14.7668 14.7668 k = 0.5000-0.2441-0.6324 ( 4156 PWs) bands (ev): -31.1644 -31.1644 -14.2109 -14.2109 -14.2007 -14.2007 -13.2159 -13.2159 -13.1870 -13.1870 -12.7766 -12.7766 -12.7164 -12.7164 -12.5027 -12.5027 -12.3123 -12.3123 -11.6966 -11.6966 -11.6120 -11.6120 -11.2024 -11.2024 -10.7118 -10.7118 -10.2671 -10.2671 -10.0515 -10.0515 -0.7681 -0.7681 0.7128 0.7128 0.7939 0.7939 1.1880 1.1880 2.0013 2.0013 2.1196 2.1196 2.5976 2.5976 2.7252 2.7252 3.5403 3.5403 4.1600 4.1600 4.5315 4.5315 4.5829 4.5829 4.9474 4.9474 5.0604 5.0604 5.5692 5.5692 5.6039 5.6039 6.2731 6.2731 6.2952 6.2952 12.1606 12.1606 13.3569 13.3569 13.4220 13.4220 13.9533 13.9533 14.2973 14.2973 14.3877 14.3877 14.7827 14.7827 k = 0.5000-0.2338-0.6482 ( 4160 PWs) bands (ev): -31.1644 -31.1644 -14.2109 -14.2109 -14.1996 -14.1996 -13.2149 -13.2149 -13.1862 -13.1862 -12.7764 -12.7764 -12.7179 -12.7179 -12.5067 -12.5067 -12.3193 -12.3193 -11.6761 -11.6761 -11.6258 -11.6258 -11.1972 -11.1972 -10.7059 -10.7059 -10.2743 -10.2743 -10.0533 -10.0533 -0.7693 -0.7693 0.7365 0.7365 0.7880 0.7880 1.1738 1.1738 2.0104 2.0104 2.1088 2.1088 2.5991 2.5991 2.7371 2.7371 3.5263 3.5263 4.1779 4.1779 4.5277 4.5277 4.5846 4.5846 4.9363 4.9363 5.0399 5.0399 5.5732 5.5732 5.6115 5.6115 6.2774 6.2774 6.2890 6.2890 12.1649 12.1649 13.3646 13.3646 13.4112 13.4112 13.9540 13.9540 14.3021 14.3021 14.3818 14.3818 14.7948 14.7948 k = 0.5000-0.2235-0.6640 ( 4164 PWs) bands (ev): -31.1644 -31.1644 -14.2123 -14.2123 -14.1970 -14.1970 -13.2145 -13.2145 -13.1847 -13.1847 -12.7762 -12.7762 -12.7195 -12.7195 -12.5104 -12.5104 -12.3269 -12.3269 -11.6849 -11.6849 -11.6090 -11.6090 -11.1912 -11.1912 -10.7028 -10.7028 -10.2826 -10.2826 -10.0525 -10.0525 -0.7729 -0.7729 0.7365 0.7365 0.8028 0.8028 1.1644 1.1644 2.0200 2.0200 2.0978 2.0978 2.6012 2.6012 2.7483 2.7483 3.5126 3.5126 4.1950 4.1950 4.5126 4.5126 4.5965 4.5965 4.9267 4.9267 5.0232 5.0232 5.5766 5.5766 5.6188 5.6188 6.2646 6.2646 6.2977 6.2977 12.1671 12.1671 13.3597 13.3597 13.4136 13.4136 13.9546 13.9546 14.3024 14.3024 14.3805 14.3805 14.8020 14.8020 k = 0.5000-0.2132-0.6799 ( 4166 PWs) bands (ev): -31.1644 -31.1644 -14.2142 -14.2142 -14.1937 -14.1937 -13.2144 -13.2144 -13.1827 -13.1827 -12.7762 -12.7762 -12.7212 -12.7212 -12.5137 -12.5137 -12.3351 -12.3351 -11.7060 -11.7060 -11.5787 -11.5787 -11.1846 -11.1846 -10.7028 -10.7028 -10.2908 -10.2908 -10.0498 -10.0498 -0.7792 -0.7792 0.7273 0.7273 0.8216 0.8216 1.1617 1.1617 2.0299 2.0299 2.0869 2.0869 2.6034 2.6034 2.7585 2.7585 3.4995 3.4995 4.2108 4.2108 4.4929 4.4929 4.6125 4.6125 4.9185 4.9185 5.0104 5.0104 5.5796 5.5796 5.6258 5.6258 6.2491 6.2491 6.3068 6.3068 12.1670 12.1670 13.3485 13.3485 13.4230 13.4230 13.9551 13.9551 14.2988 14.2988 14.3837 14.3837 14.8045 14.8045 k = 0.5000-0.2029-0.6957 ( 4166 PWs) bands (ev): -31.1644 -31.1644 -14.2161 -14.2161 -14.1903 -14.1903 -13.2146 -13.2146 -13.1801 -13.1801 -12.7762 -12.7762 -12.7232 -12.7232 -12.5169 -12.5169 -12.3439 -12.3439 -11.7279 -11.7279 -11.5462 -11.5462 -11.1776 -11.1776 -10.7061 -10.7061 -10.2977 -10.2977 -10.0458 -10.0458 -0.7882 -0.7882 0.7184 0.7184 0.8335 0.8335 1.1672 1.1672 2.0393 2.0393 2.0774 2.0774 2.6054 2.6054 2.7676 2.7676 3.4874 3.4874 4.2249 4.2249 4.4718 4.4718 4.6302 4.6302 4.9118 4.9118 5.0017 5.0017 5.5823 5.5823 5.6323 5.6323 6.2323 6.2323 6.3146 6.3146 12.1641 12.1641 13.3374 13.3374 13.4333 13.4333 13.9554 13.9554 14.2929 14.2929 14.3897 14.3897 14.8038 14.8038 k = 0.5000-0.1926-0.7115 ( 4160 PWs) bands (ev): -31.1644 -31.1644 -14.2180 -14.2180 -14.1868 -14.1868 -13.2150 -13.2150 -13.1773 -13.1773 -12.7763 -12.7763 -12.7253 -12.7253 -12.5200 -12.5200 -12.3531 -12.3531 -11.7486 -11.7486 -11.5136 -11.5136 -11.1702 -11.1702 -10.7129 -10.7129 -10.3025 -10.3025 -10.0409 -10.0409 -0.7999 -0.7999 0.7114 0.7114 0.8361 0.8361 1.1808 1.1808 2.0436 2.0436 2.0741 2.0741 2.6071 2.6071 2.7753 2.7753 3.4766 3.4766 4.2369 4.2369 4.4509 4.4509 4.6489 4.6489 4.9063 4.9063 4.9972 4.9972 5.5847 5.5847 5.6384 5.6384 6.2145 6.2145 6.3207 6.3207 12.1580 12.1580 13.3286 13.3286 13.4427 13.4427 13.9554 13.9554 14.2864 14.2864 14.3973 14.3973 14.8017 14.8017 k = 0.5000-0.1823-0.7273 ( 4164 PWs) bands (ev): -31.1644 -31.1644 -14.2196 -14.2196 -14.1833 -14.1833 -13.2154 -13.2154 -13.1743 -13.1743 -12.7766 -12.7766 -12.7276 -12.7276 -12.5233 -12.5233 -12.3625 -12.3625 -11.7676 -11.7676 -11.4816 -11.4816 -11.1628 -11.1628 -10.7227 -10.7227 -10.3049 -10.3049 -10.0355 -10.0355 -0.8143 -0.8143 0.7068 0.7068 0.8301 0.8301 1.2011 1.2011 2.0373 2.0373 2.0827 2.0827 2.6079 2.6079 2.7817 2.7817 3.4675 3.4675 4.2458 4.2458 4.4321 4.4321 4.6683 4.6683 4.9021 4.9021 4.9967 4.9967 5.5869 5.5869 5.6439 5.6439 6.1957 6.1957 6.3249 6.3249 12.1486 12.1486 13.3226 13.3226 13.4507 13.4507 13.9550 13.9550 14.2802 14.2802 14.4054 14.4054 14.7995 14.7995 k = 0.5000-0.1720-0.7432 ( 4156 PWs) bands (ev): -31.1644 -31.1644 -14.2211 -14.2211 -14.1800 -14.1800 -13.2158 -13.2158 -13.1713 -13.1713 -12.7769 -12.7769 -12.7301 -12.7301 -12.5270 -12.5270 -12.3718 -12.3718 -11.7846 -11.7846 -11.4507 -11.4507 -11.1555 -11.1555 -10.7351 -10.7351 -10.3047 -10.3047 -10.0297 -10.0297 -0.8315 -0.8315 0.7045 0.7045 0.8177 0.8177 1.2257 1.2257 2.0255 2.0255 2.0982 2.0982 2.6076 2.6076 2.7867 2.7867 3.4604 3.4604 4.2506 4.2506 4.4173 4.4173 4.6883 4.6883 4.8991 4.8991 5.0000 5.0000 5.5889 5.5889 5.6489 5.6489 6.1760 6.1760 6.3270 6.3270 12.1356 12.1356 13.3199 13.3199 13.4572 13.4572 13.9542 13.9542 14.2751 14.2751 14.4134 14.4134 14.7985 14.7985 k = 0.7877-0.0458-0.4575 ( 4156 PWs) bands (ev): -31.1644 -31.1644 -14.2211 -14.2211 -14.1800 -14.1800 -13.2158 -13.2158 -13.1713 -13.1713 -12.7769 -12.7769 -12.7301 -12.7301 -12.5271 -12.5271 -12.3717 -12.3717 -11.7845 -11.7845 -11.4507 -11.4507 -11.1555 -11.1555 -10.7351 -10.7351 -10.3049 -10.3049 -10.0297 -10.0297 -0.8315 -0.8315 0.7046 0.7046 0.8176 0.8176 1.2257 1.2257 2.0255 2.0255 2.0982 2.0982 2.6077 2.6077 2.7867 2.7867 3.4604 3.4604 4.2505 4.2505 4.4173 4.4173 4.6884 4.6884 4.8991 4.8991 5.0001 5.0001 5.5887 5.5887 5.6489 5.6489 6.1759 6.1759 6.3271 6.3271 12.1356 12.1356 13.3199 13.3199 13.4572 13.4572 13.9542 13.9542 14.2751 14.2751 14.4134 14.4134 14.7985 14.7985 k = 0.7801-0.0389-0.4417 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2222 -14.2222 -14.1768 -14.1768 -13.2161 -13.2161 -13.1682 -13.1682 -12.7775 -12.7775 -12.7329 -12.7329 -12.5315 -12.5315 -12.3805 -12.3805 -11.7994 -11.7994 -11.4213 -11.4213 -11.1486 -11.1486 -10.7491 -10.7491 -10.3023 -10.3023 -10.0238 -10.0238 -0.8511 -0.8511 0.7041 0.7041 0.8009 0.8009 1.2524 1.2524 2.0117 2.0117 2.1170 2.1170 2.6061 2.6061 2.7903 2.7903 3.4555 3.4555 4.2496 4.2496 4.4088 4.4088 4.7088 4.7088 4.8974 4.8974 5.0067 5.0067 5.5907 5.5907 5.6534 5.6534 6.1554 6.1554 6.3270 6.3270 12.1189 12.1189 13.3206 13.3206 13.4622 13.4622 13.9526 13.9526 14.2712 14.2712 14.4209 14.4209 14.7993 14.7993 k = 0.7726-0.0319-0.4259 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2231 -14.2231 -14.1737 -14.1737 -13.2162 -13.2162 -13.1652 -13.1652 -12.7783 -12.7783 -12.7359 -12.7359 -12.5368 -12.5368 -12.3883 -12.3883 -11.8122 -11.8122 -11.3939 -11.3939 -11.1425 -11.1425 -10.7636 -10.7636 -10.2975 -10.2975 -10.0177 -10.0177 -0.8731 -0.8731 0.7043 0.7043 0.7822 0.7822 1.2794 1.2794 1.9968 1.9968 2.1381 2.1381 2.6031 2.6031 2.7928 2.7928 3.4533 3.4533 4.2426 4.2426 4.4077 4.4077 4.7296 4.7296 4.8971 4.8971 5.0161 5.0161 5.5925 5.5925 5.6574 5.6574 6.1342 6.1342 6.3246 6.3246 12.0985 12.0985 13.3244 13.3244 13.4659 13.4659 13.9502 13.9502 14.2689 14.2689 14.4276 14.4276 14.8024 14.8024 k = 0.7650-0.0249-0.4101 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2238 -14.2238 -14.1707 -14.1707 -13.2163 -13.2163 -13.1622 -13.1622 -12.7794 -12.7794 -12.7392 -12.7392 -12.5432 -12.5432 -12.3948 -12.3948 -11.8230 -11.8230 -11.3690 -11.3690 -11.1374 -11.1374 -10.7776 -10.7776 -10.2910 -10.2910 -10.0116 -10.0116 -0.8973 -0.8973 0.7030 0.7030 0.7649 0.7649 1.3056 1.3056 1.9810 1.9810 2.1609 2.1609 2.5985 2.5985 2.7944 2.7944 3.4539 3.4539 4.2303 4.2303 4.4139 4.4139 4.7506 4.7506 4.8983 4.8983 5.0279 5.0279 5.5943 5.5943 5.6610 5.6610 6.1123 6.1123 6.3200 6.3200 12.0746 12.0746 13.3313 13.3313 13.4684 13.4684 13.9469 13.9469 14.2680 14.2680 14.4334 14.4334 14.8083 14.8083 k = 0.7574-0.0179-0.3943 ( 4146 PWs) bands (ev): -31.1645 -31.1645 -14.2241 -14.2241 -14.1679 -14.1679 -13.2162 -13.2162 -13.1595 -13.1595 -12.7809 -12.7809 -12.7428 -12.7428 -12.5506 -12.5506 -12.3998 -12.3998 -11.8318 -11.8318 -11.3474 -11.3474 -11.1333 -11.1333 -10.7898 -10.7898 -10.2831 -10.2831 -10.0054 -10.0054 -0.9235 -0.9235 0.6954 0.6954 0.7540 0.7540 1.3302 1.3302 1.9644 1.9644 2.1846 2.1846 2.5923 2.5923 2.7953 2.7953 3.4576 3.4576 4.2146 4.2146 4.4261 4.4261 4.7716 4.7716 4.9010 4.9010 5.0419 5.0419 5.5960 5.5960 5.6642 5.6642 6.0899 6.0899 6.3129 6.3129 12.0473 12.0473 13.3410 13.3410 13.4699 13.4699 13.9427 13.9427 14.2686 14.2686 14.4380 14.4380 14.8172 14.8172 k = 0.7498-0.0110-0.3785 ( 4148 PWs) bands (ev): -31.1645 -31.1645 -14.2241 -14.2241 -14.1653 -14.1653 -13.2159 -13.2159 -13.1568 -13.1568 -12.7832 -12.7832 -12.7466 -12.7466 -12.5589 -12.5589 -12.4030 -12.4030 -11.8388 -11.8388 -11.3303 -11.3303 -11.1301 -11.1301 -10.7992 -10.7992 -10.2740 -10.2740 -9.9991 -9.9991 -0.9514 -0.9514 0.6784 0.6784 0.7529 0.7529 1.3527 1.3527 1.9470 1.9470 2.2086 2.2086 2.5847 2.5847 2.7961 2.7961 3.4643 3.4643 4.1973 4.1973 4.4428 4.4428 4.7924 4.7924 4.9054 4.9054 5.0576 5.0576 5.5976 5.5976 5.6670 5.6670 6.0670 6.0670 6.3035 6.3035 12.0168 12.0168 13.3532 13.3532 13.4705 13.4705 13.9376 13.9376 14.2703 14.2703 14.4414 14.4414 14.8293 14.8293 k = 0.7423-0.0040-0.3627 ( 4140 PWs) bands (ev): -31.1645 -31.1645 -14.2239 -14.2239 -14.1628 -14.1628 -13.2154 -13.2154 -13.1544 -13.1544 -12.7865 -12.7865 -12.7506 -12.7506 -12.5677 -12.5677 -12.4045 -12.4045 -11.8440 -11.8440 -11.3187 -11.3187 -11.1270 -11.1270 -10.8050 -10.8050 -10.2640 -10.2640 -9.9926 -9.9926 -0.9808 -0.9808 0.6553 0.6553 0.7584 0.7584 1.3729 1.3729 1.9289 1.9289 2.2321 2.2321 2.5758 2.5758 2.7971 2.7971 3.4743 3.4743 4.1797 4.1797 4.4632 4.4632 4.8129 4.8129 4.9114 4.9114 5.0748 5.0748 5.5991 5.5991 5.6694 5.6694 6.0439 6.0439 6.2918 6.2918 11.9834 11.9834 13.3674 13.3674 13.4704 13.4704 13.9317 13.9317 14.2729 14.2729 14.4435 14.4435 14.8446 14.8446 k = 0.7347 0.0030-0.3469 ( 4140 PWs) bands (ev): -31.1645 -31.1645 -14.2233 -14.2233 -14.1605 -14.1605 -13.2147 -13.2147 -13.1522 -13.1522 -12.7913 -12.7913 -12.7544 -12.7544 -12.5764 -12.5764 -12.4045 -12.4045 -11.8476 -11.8476 -11.3143 -11.3143 -11.1228 -11.1228 -10.8070 -10.8070 -10.2533 -10.2533 -9.9860 -9.9860 -1.0114 -1.0114 0.6293 0.6293 0.7672 0.7672 1.3907 1.3907 1.9102 1.9102 2.2541 2.2541 2.5660 2.5660 2.7988 2.7988 3.4873 3.4873 4.1628 4.1628 4.4865 4.4865 4.8328 4.8328 4.9192 4.9192 5.0933 5.0933 5.6004 5.6004 5.6715 5.6715 6.0207 6.0207 6.2778 6.2778 11.9474 11.9474 13.3834 13.3834 13.4697 13.4697 13.9251 13.9251 14.2762 14.2762 14.4442 14.4442 14.8632 14.8632 k = 0.7271 0.0100-0.3311 ( 4144 PWs) bands (ev): -31.1646 -31.1646 -14.2225 -14.2225 -14.1585 -14.1585 -13.2138 -13.2138 -13.1502 -13.1502 -12.7981 -12.7981 -12.7578 -12.7578 -12.5845 -12.5845 -12.4032 -12.4032 -11.8498 -11.8498 -11.3178 -11.3178 -11.1162 -11.1162 -10.8054 -10.8054 -10.2418 -10.2418 -9.9792 -9.9792 -1.0431 -1.0431 0.6020 0.6020 0.7778 0.7778 1.4059 1.4059 1.8910 1.8910 2.2738 2.2738 2.5556 2.5556 2.8018 2.8018 3.5032 3.5032 4.1473 4.1473 4.5124 4.5124 4.8520 4.8520 4.9286 4.9286 5.1129 5.1129 5.6016 5.6016 5.6732 5.6732 5.9975 5.9975 6.2616 6.2616 11.9092 11.9092 13.4007 13.4007 13.4685 13.4685 13.9178 13.9178 14.2799 14.2799 14.4436 14.4436 14.8849 14.8849 k = 0.7196 0.0169-0.3153 ( 4144 PWs) bands (ev): -31.1646 -31.1646 -14.2214 -14.2214 -14.1566 -14.1566 -13.2128 -13.2128 -13.1484 -13.1484 -12.8072 -12.8072 -12.7605 -12.7605 -12.5915 -12.5915 -12.4008 -12.4008 -11.8507 -11.8507 -11.3291 -11.3291 -11.1069 -11.1069 -10.8008 -10.8008 -10.2298 -10.2298 -9.9722 -9.9722 -1.0756 -1.0756 0.5739 0.5739 0.7894 0.7894 1.4185 1.4185 1.8717 1.8717 2.2904 2.2904 2.5449 2.5449 2.8062 2.8062 3.5220 3.5220 4.1335 4.1335 4.5404 4.5404 4.8705 4.8705 4.9398 4.9398 5.1336 5.1336 5.6024 5.6024 5.6745 5.6745 5.9747 5.9747 6.2434 6.2434 11.8690 11.8690 13.4189 13.4189 13.4670 13.4670 13.9100 13.9100 14.2836 14.2836 14.4417 14.4417 14.9095 14.9095 k = 0.7120 0.0239-0.2995 ( 4148 PWs) bands (ev): -31.1646 -31.1646 -14.2200 -14.2200 -14.1548 -14.1548 -13.2115 -13.2115 -13.1469 -13.1469 -12.8186 -12.8186 -12.7626 -12.7626 -12.5971 -12.5971 -12.3975 -12.3975 -11.8503 -11.8503 -11.3473 -11.3473 -11.0951 -11.0951 -10.7939 -10.7939 -10.2171 -10.2171 -9.9651 -9.9651 -1.1086 -1.1086 0.5454 0.5454 0.8015 0.8015 1.4281 1.4281 1.8527 1.8527 2.3033 2.3033 2.5342 2.5342 2.8121 2.8121 3.5433 3.5433 4.1220 4.1220 4.5702 4.5702 4.8883 4.8883 4.9526 4.9526 5.1550 5.1550 5.6027 5.6027 5.6755 5.6755 5.9523 5.9523 6.2233 6.2233 11.8271 11.8271 13.4376 13.4376 13.4654 13.4654 13.9019 13.9019 14.2872 14.2872 14.4386 14.4386 14.9369 14.9369 k = 0.7044 0.0309-0.2837 ( 4144 PWs) bands (ev): -31.1646 -31.1646 -14.2183 -14.2183 -14.1533 -14.1533 -13.2101 -13.2101 -13.1456 -13.1456 -12.8321 -12.8321 -12.7641 -12.7641 -12.6011 -12.6011 -12.3935 -12.3935 -11.8489 -11.8489 -11.3708 -11.3708 -11.0814 -11.0814 -10.7855 -10.7855 -10.2038 -10.2038 -9.9577 -9.9577 -1.1421 -1.1421 0.5168 0.5168 0.8138 0.8138 1.4346 1.4346 1.8346 1.8346 2.3124 2.3124 2.5239 2.5239 2.8195 2.8195 3.5669 3.5669 4.1130 4.1130 4.6013 4.6013 4.9054 4.9054 4.9668 4.9668 5.1772 5.1772 5.6023 5.6023 5.6761 5.6761 5.9309 5.9309 6.2015 6.2015 11.7839 11.7839 13.4537 13.4537 13.4664 13.4664 13.8935 13.8935 14.2903 14.2903 14.4344 14.4344 14.9666 14.9666 k = 0.6968 0.0379-0.2679 ( 4142 PWs) bands (ev): -31.1647 -31.1647 -14.2164 -14.2164 -14.1519 -14.1519 -13.2084 -13.2084 -13.1445 -13.1445 -12.8474 -12.8474 -12.7652 -12.7652 -12.6036 -12.6036 -12.3889 -12.3889 -11.8465 -11.8465 -11.3984 -11.3984 -11.0666 -11.0666 -10.7763 -10.7763 -10.1898 -10.1898 -9.9502 -9.9502 -1.1757 -1.1757 0.4882 0.4882 0.8262 0.8262 1.4375 1.4375 1.8182 1.8182 2.3175 2.3175 2.5141 2.5141 2.8279 2.8279 3.5927 3.5927 4.1067 4.1067 4.6335 4.6335 4.9223 4.9223 4.9822 4.9822 5.2001 5.2001 5.6007 5.6007 5.6765 5.6765 5.9105 5.9105 6.1783 6.1783 11.7395 11.7395 13.4566 13.4566 13.4805 13.4805 13.8851 13.8851 14.2926 14.2926 14.4292 14.4292 14.9982 14.9982 k = 0.6893 0.0448-0.2521 ( 4136 PWs) bands (ev): -31.1647 -31.1647 -14.2143 -14.2143 -14.1507 -14.1507 -13.2066 -13.2066 -13.1436 -13.1436 -12.8640 -12.8640 -12.7660 -12.7660 -12.6045 -12.6045 -12.3839 -12.3839 -11.8434 -11.8434 -11.4290 -11.4290 -11.0511 -11.0511 -10.7670 -10.7670 -10.1750 -10.1750 -9.9425 -9.9425 -1.2093 -1.2093 0.4596 0.4596 0.8384 0.8384 1.4363 1.4363 1.8042 1.8042 2.3189 2.3189 2.5049 2.5049 2.8367 2.8367 3.6205 3.6205 4.1034 4.1034 4.6663 4.6663 4.9391 4.9391 4.9986 4.9986 5.2235 5.2235 5.5976 5.5976 5.6767 5.6767 5.8917 5.8917 6.1539 6.1539 11.6944 11.6944 13.4540 13.4540 13.4998 13.4998 13.8768 13.8768 14.2939 14.2939 14.4233 14.4233 15.0313 15.0313 k = 0.6817 0.0518-0.2363 ( 4136 PWs) bands (ev): -31.1647 -31.1647 -14.2119 -14.2119 -14.1497 -14.1497 -13.2047 -13.2047 -13.1429 -13.1429 -12.8816 -12.8816 -12.7666 -12.7666 -12.6040 -12.6040 -12.3786 -12.3786 -11.8395 -11.8395 -11.4615 -11.4615 -11.0353 -11.0353 -10.7582 -10.7582 -10.1594 -10.1594 -9.9348 -9.9348 -1.2427 -1.2427 0.4311 0.4311 0.8503 0.8503 1.4307 1.4307 1.7936 1.7936 2.3170 2.3170 2.4966 2.4966 2.8453 2.8453 3.6499 3.6499 4.1029 4.1029 4.6993 4.6993 4.9562 4.9562 5.0157 5.0157 5.2475 5.2475 5.5925 5.5925 5.6772 5.6772 5.8746 5.8746 6.1285 6.1285 11.6487 11.6487 13.4504 13.4504 13.5195 13.5195 13.8686 13.8686 14.2939 14.2939 14.4167 14.4167 15.0651 15.0651 k = 0.6741 0.0588-0.2205 ( 4132 PWs) bands (ev): -31.1648 -31.1648 -14.2093 -14.2093 -14.1488 -14.1488 -13.2025 -13.2025 -13.1424 -13.1424 -12.8999 -12.8999 -12.7670 -12.7670 -12.6022 -12.6022 -12.3729 -12.3729 -11.8350 -11.8350 -11.4955 -11.4955 -11.0193 -11.0193 -10.7502 -10.7502 -10.1431 -10.1431 -9.9270 -9.9270 -1.2759 -1.2759 0.4028 0.4028 0.8618 0.8618 1.4204 1.4204 1.7868 1.7868 2.3123 2.3123 2.4892 2.4892 2.8530 2.8530 3.6808 3.6808 4.1054 4.1054 4.7319 4.7319 4.9738 4.9738 5.0335 5.0335 5.2719 5.2719 5.5847 5.5847 5.6778 5.6778 5.8594 5.8594 6.1026 6.1026 11.6026 11.6026 13.4462 13.4462 13.5391 13.5391 13.8608 13.8608 14.2924 14.2924 14.4095 14.4095 15.0987 15.0987 k = 0.6666 0.0658-0.2047 ( 4126 PWs) bands (ev): -31.1648 -31.1648 -14.2066 -14.2066 -14.1480 -14.1480 -13.2003 -13.2003 -13.1421 -13.1421 -12.9185 -12.9185 -12.7673 -12.7673 -12.5993 -12.5993 -12.3672 -12.3672 -11.8302 -11.8302 -11.5302 -11.5302 -11.0033 -11.0033 -10.7434 -10.7434 -10.1259 -10.1259 -9.9192 -9.9192 -1.3085 -1.3085 0.3749 0.3749 0.8729 0.8729 1.4056 1.4056 1.7843 1.7843 2.3051 2.3051 2.4826 2.4826 2.8593 2.8593 3.7130 3.7130 4.1107 4.1107 4.7636 4.7636 4.9920 4.9920 5.0521 5.0521 5.2968 5.2968 5.5742 5.5742 5.6788 5.6788 5.8463 5.8463 6.0766 6.0766 11.5565 11.5565 13.4415 13.4415 13.5585 13.5585 13.8534 13.8534 14.2893 14.2893 14.4019 14.4019 15.1311 15.1311 k = 0.6590 0.0727-0.1889 ( 4124 PWs) bands (ev): -31.1648 -31.1648 -14.2038 -14.2038 -14.1474 -14.1474 -13.1979 -13.1979 -13.1420 -13.1420 -12.9372 -12.9372 -12.7676 -12.7676 -12.5954 -12.5954 -12.3612 -12.3612 -11.8250 -11.8250 -11.5654 -11.5654 -10.9875 -10.9875 -10.7379 -10.7379 -10.1080 -10.1080 -9.9114 -9.9114 -1.3406 -1.3406 0.3472 0.3472 0.8834 0.8834 1.3867 1.3867 1.7860 1.7860 2.2959 2.2959 2.4770 2.4770 2.8636 2.8636 3.7462 3.7462 4.1185 4.1185 4.7942 4.7942 5.0106 5.0106 5.0717 5.0717 5.3219 5.3219 5.5610 5.5610 5.6799 5.6799 5.8353 5.8353 6.0508 6.0508 11.5105 11.5105 13.4363 13.4363 13.5775 13.5775 13.8466 13.8466 14.2844 14.2844 14.3938 14.3938 15.1604 15.1604 k = 0.6514 0.0797-0.1731 ( 4124 PWs) bands (ev): -31.1648 -31.1648 -14.2008 -14.2008 -14.1469 -14.1469 -13.1954 -13.1954 -13.1420 -13.1420 -12.9558 -12.9558 -12.7678 -12.7678 -12.5906 -12.5906 -12.3552 -12.3552 -11.8199 -11.8199 -11.6003 -11.6003 -10.9719 -10.9719 -10.7338 -10.7338 -10.0895 -10.0895 -9.9038 -9.9038 -1.3719 -1.3719 0.3199 0.3199 0.8933 0.8933 1.3644 1.3644 1.7916 1.7916 2.2852 2.2852 2.4723 2.4723 2.8658 2.8658 3.7804 3.7804 4.1284 4.1284 4.8232 4.8232 5.0293 5.0293 5.0926 5.0926 5.3473 5.3473 5.5453 5.5453 5.6808 5.6808 5.8262 5.8262 6.0257 6.0257 11.4649 11.4649 13.4305 13.4305 13.5961 13.5961 13.8404 13.8404 14.2777 14.2777 14.3854 14.3854 15.1837 15.1837 k = 0.6438 0.0867-0.1573 ( 4128 PWs) bands (ev): -31.1649 -31.1649 -14.1978 -14.1978 -14.1465 -14.1465 -13.1929 -13.1929 -13.1421 -13.1421 -12.9740 -12.9740 -12.7679 -12.7679 -12.5851 -12.5851 -12.3492 -12.3492 -11.8152 -11.8152 -11.6346 -11.6346 -10.9566 -10.9566 -10.7312 -10.7312 -10.0704 -10.0704 -9.8963 -9.8963 -1.4024 -1.4024 0.2931 0.2931 0.9027 0.9027 1.3396 1.3396 1.8004 1.8004 2.2731 2.2731 2.4683 2.4683 2.8657 2.8657 3.8153 3.8153 4.1402 4.1402 4.8504 4.8504 5.0477 5.0477 5.1149 5.1149 5.3729 5.3729 5.5275 5.5275 5.6811 5.6811 5.8191 5.8191 6.0017 6.0017 11.4198 11.4198 13.4243 13.4243 13.6141 13.6141 13.8349 13.8349 14.2692 14.2692 14.3765 14.3765 15.1970 15.1970 k = 0.6363 0.0937-0.1415 ( 4124 PWs) bands (ev): -31.1649 -31.1649 -14.1947 -14.1947 -14.1461 -14.1461 -13.1903 -13.1903 -13.1423 -13.1423 -12.9917 -12.9917 -12.7680 -12.7680 -12.5788 -12.5788 -12.3432 -12.3432 -11.8116 -11.8116 -11.6673 -11.6673 -10.9417 -10.9417 -10.7300 -10.7300 -10.0510 -10.0510 -9.8889 -9.8889 -1.4319 -1.4319 0.2668 0.2668 0.9114 0.9114 1.3130 1.3130 1.8122 1.8122 2.2602 2.2602 2.4651 2.4651 2.8633 2.8633 3.8506 3.8506 4.1534 4.1534 4.8759 4.8759 5.0655 5.0655 5.1385 5.1385 5.3985 5.3985 5.5084 5.5084 5.6802 5.6802 5.8137 5.8137 5.9793 5.9793 11.3756 11.3756 13.4176 13.4176 13.6316 13.6316 13.8303 13.8303 14.2590 14.2590 14.3671 14.3671 15.1975 15.1975 k = 0.6287 0.1006-0.1257 ( 4126 PWs) bands (ev): -31.1649 -31.1649 -14.1916 -14.1916 -14.1459 -14.1459 -13.1878 -13.1878 -13.1425 -13.1425 -13.0088 -13.0088 -12.7681 -12.7681 -12.5720 -12.5720 -12.3372 -12.3372 -11.8107 -11.8107 -11.6970 -11.6970 -10.9271 -10.9271 -10.7301 -10.7301 -10.0313 -10.0313 -9.8818 -9.8818 -1.4604 -1.4604 0.2412 0.2412 0.9196 0.9196 1.2853 1.2853 1.8263 1.8263 2.2467 2.2467 2.4625 2.4625 2.8586 2.8586 3.8863 3.8863 4.1676 4.1676 4.8997 4.8997 5.0822 5.0822 5.1631 5.1631 5.4238 5.4238 5.4889 5.4889 5.6778 5.6778 5.8101 5.8101 5.9589 5.9589 11.3323 11.3323 13.4105 13.4105 13.6485 13.6485 13.8264 13.8264 14.2473 14.2473 14.3571 14.3571 15.1863 15.1863 k = 0.6211 0.1076-0.1099 ( 4130 PWs) bands (ev): -31.1650 -31.1650 -14.1885 -14.1885 -14.1456 -14.1456 -13.1853 -13.1853 -13.1428 -13.1428 -13.0252 -13.0252 -12.7681 -12.7681 -12.5646 -12.5646 -12.3312 -12.3312 -11.8151 -11.8151 -11.7205 -11.7205 -10.9130 -10.9130 -10.7313 -10.7313 -10.0116 -10.0116 -9.8750 -9.8750 -1.4878 -1.4878 0.2162 0.2162 0.9272 0.9272 1.2573 1.2573 1.8423 1.8423 2.2327 2.2327 2.4603 2.4603 2.8519 2.8519 3.9221 3.9221 4.1822 4.1822 4.9220 4.9220 5.0979 5.0979 5.1877 5.1877 5.4455 5.4455 5.4724 5.4724 5.6738 5.6738 5.8081 5.8081 5.9407 5.9407 11.2902 11.2902 13.4030 13.4030 13.6648 13.6648 13.8235 13.8235 14.2343 14.2343 14.3463 14.3463 15.1675 15.1675 k = 0.6136 0.1146-0.0941 ( 4132 PWs) bands (ev): -31.1650 -31.1650 -14.1855 -14.1855 -14.1454 -14.1454 -13.1830 -13.1830 -13.1431 -13.1431 -13.0407 -13.0407 -12.7681 -12.7681 -12.5567 -12.5567 -12.3252 -12.3252 -11.8285 -11.8285 -11.7345 -11.7345 -10.8994 -10.8994 -10.7337 -10.7337 -9.9921 -9.9921 -9.8685 -9.8685 -1.5138 -1.5138 0.1920 0.1920 0.9343 0.9343 1.2295 1.2295 1.8599 1.8599 2.2187 2.2187 2.4586 2.4586 2.8433 2.8433 3.9578 3.9578 4.1970 4.1970 4.9431 4.9431 5.1125 5.1125 5.2113 5.2113 5.4417 5.4417 5.4818 5.4818 5.6683 5.6683 5.8076 5.8076 5.9249 5.9249 11.2495 11.2495 13.3953 13.3953 13.6805 13.6805 13.8213 13.8213 14.2201 14.2201 14.3348 14.3348 15.1445 15.1445 k = 0.6060 0.1216-0.0783 ( 4138 PWs) bands (ev): -31.1650 -31.1650 -14.1825 -14.1825 -14.1452 -14.1452 -13.1809 -13.1809 -13.1434 -13.1434 -13.0552 -13.0552 -12.7681 -12.7681 -12.5485 -12.5485 -12.3193 -12.3193 -11.8506 -11.8506 -11.7392 -11.7392 -10.8864 -10.8864 -10.7369 -10.7369 -9.9729 -9.9729 -9.8623 -9.8623 -1.5386 -1.5386 0.1686 0.1686 0.9407 0.9407 1.2023 1.2023 1.8787 1.8787 2.2047 2.2047 2.4571 2.4571 2.8331 2.8331 3.9932 3.9932 4.2115 4.2115 4.9630 4.9630 5.1258 5.1258 5.2325 5.2325 5.4240 5.4240 5.5058 5.5058 5.6619 5.6619 5.8082 5.8082 5.9113 5.9113 11.2104 11.2104 13.3874 13.3874 13.6955 13.6955 13.8200 13.8200 14.2050 14.2050 14.3225 14.3225 15.1198 15.1198 k = 0.5984 0.1285-0.0625 ( 4132 PWs) bands (ev): -31.1651 -31.1651 -14.1798 -14.1798 -14.1450 -14.1450 -13.1792 -13.1792 -13.1436 -13.1436 -13.0685 -13.0685 -12.7681 -12.7681 -12.5399 -12.5399 -12.3134 -12.3134 -11.8777 -11.8777 -11.7381 -11.7381 -10.8740 -10.8740 -10.7409 -10.7409 -9.9542 -9.9542 -9.8565 -9.8565 -1.5620 -1.5620 0.1462 0.1462 0.9466 0.9466 1.1761 1.1761 1.8984 1.8984 2.1910 2.1910 2.4559 2.4559 2.8216 2.8216 4.0281 4.0281 4.2256 4.2256 4.9821 4.9821 5.1379 5.1379 5.2499 5.2499 5.4067 5.4067 5.5310 5.5310 5.6558 5.6558 5.8098 5.8098 5.8997 5.8997 11.1731 11.1731 13.3794 13.3794 13.7100 13.7100 13.8196 13.8196 14.1891 14.1891 14.3095 14.3095 15.0946 15.0946 k = 0.5909 0.1355-0.0467 ( 4134 PWs) bands (ev): -31.1651 -31.1651 -14.1772 -14.1772 -14.1447 -14.1447 -13.1780 -13.1780 -13.1437 -13.1437 -13.0807 -13.0807 -12.7681 -12.7681 -12.5310 -12.5310 -12.3074 -12.3074 -11.9069 -11.9069 -11.7342 -11.7342 -10.8623 -10.8623 -10.7454 -10.7454 -9.9362 -9.9362 -9.8510 -9.8510 -1.5839 -1.5839 0.1249 0.1249 0.9519 0.9519 1.1512 1.1512 1.9186 1.9186 2.1777 2.1777 2.4548 2.4548 2.8090 2.8090 4.0621 4.0621 4.2389 4.2389 5.0002 5.0002 5.1483 5.1483 5.2623 5.2623 5.3917 5.3917 5.5560 5.5560 5.6510 5.6510 5.8119 5.8119 5.8899 5.8899 11.1377 11.1377 13.3714 13.3714 13.7239 13.7239 13.8198 13.8198 14.1727 14.1727 14.2959 14.2959 15.0700 15.0700 k = 0.5833 0.1425-0.0309 ( 4134 PWs) bands (ev): -31.1651 -31.1651 -14.1748 -14.1748 -14.1444 -14.1444 -13.1774 -13.1774 -13.1435 -13.1435 -13.0916 -13.0916 -12.7681 -12.7681 -12.5219 -12.5219 -12.3014 -12.3014 -11.9366 -11.9366 -11.7290 -11.7290 -10.8513 -10.8513 -10.7502 -10.7502 -9.9190 -9.9190 -9.8460 -9.8460 -1.6043 -1.6043 0.1048 0.1048 0.9566 0.9566 1.1279 1.1279 1.9392 1.9392 2.1650 2.1650 2.4538 2.4538 2.7956 2.7956 4.0952 4.0952 4.2514 4.2514 5.0176 5.0176 5.1566 5.1566 5.2692 5.2692 5.3796 5.3796 5.5804 5.5804 5.6487 5.6487 5.8141 5.8141 5.8816 5.8816 11.1045 11.1045 13.3635 13.3635 13.7372 13.7372 13.8207 13.8207 14.1559 14.1559 14.2818 14.2818 15.0465 15.0465 k = 0.5757 0.1495-0.0151 ( 4140 PWs) bands (ev): -31.1651 -31.1651 -14.1726 -14.1726 -14.1440 -14.1440 -13.1776 -13.1776 -13.1431 -13.1431 -13.1010 -13.1010 -12.7681 -12.7681 -12.5128 -12.5128 -12.2953 -12.2953 -11.9662 -11.9662 -11.7233 -11.7233 -10.8411 -10.8411 -10.7553 -10.7553 -9.9029 -9.9029 -9.8413 -9.8413 -1.6231 -1.6231 0.0859 0.0859 0.9606 0.9606 1.1064 1.1064 1.9597 1.9597 2.1529 2.1529 2.4529 2.4529 2.7817 2.7817 4.1269 4.1269 4.2628 4.2628 5.0341 5.0341 5.1621 5.1621 5.2715 5.2715 5.3700 5.3700 5.6040 5.6040 5.6494 5.6494 5.8163 5.8163 5.8744 5.8744 11.0735 11.0735 13.3559 13.3559 13.7499 13.7499 13.8222 13.8222 14.1389 14.1389 14.2675 14.2675 15.0245 15.0245 k = 0.5681 0.1564 0.0007 ( 4142 PWs) bands (ev): -31.1652 -31.1652 -14.1707 -14.1707 -14.1435 -14.1435 -13.1786 -13.1786 -13.1424 -13.1424 -13.1090 -13.1090 -12.7680 -12.7680 -12.5036 -12.5036 -12.2890 -12.2890 -11.9951 -11.9951 -11.7174 -11.7174 -10.8318 -10.8318 -10.7604 -10.7604 -9.8878 -9.8878 -9.8371 -9.8371 -1.6403 -1.6403 0.0685 0.0685 0.9640 0.9640 1.0870 1.0870 1.9800 1.9800 2.1417 2.1417 2.4521 2.4521 2.7676 2.7676 4.1571 4.1571 4.2733 4.2733 5.0497 5.0497 5.1638 5.1638 5.2716 5.2716 5.3617 5.3617 5.6262 5.6262 5.6536 5.6536 5.8183 5.8183 5.8681 5.8681 11.0450 11.0450 13.3486 13.3486 13.7621 13.7621 13.8242 13.8242 14.1219 14.1219 14.2534 14.2534 15.0044 15.0044 k = 0.5606 0.1634 0.0165 ( 4140 PWs) bands (ev): -31.1652 -31.1652 -14.1692 -14.1692 -14.1430 -14.1430 -13.1803 -13.1803 -13.1415 -13.1415 -13.1156 -13.1156 -12.7680 -12.7680 -12.4945 -12.4945 -12.2825 -12.2825 -12.0231 -12.0231 -11.7118 -11.7118 -10.8233 -10.8233 -10.7654 -10.7654 -9.8740 -9.8740 -9.8332 -9.8332 -1.6558 -1.6558 0.0526 0.0526 0.9665 0.9665 1.0698 1.0698 1.9996 1.9996 2.1314 2.1314 2.4513 2.4513 2.7536 2.7536 4.1852 4.1852 4.2828 4.2828 5.0644 5.0644 5.1614 5.1614 5.2720 5.2720 5.3534 5.3534 5.6465 5.6465 5.6611 5.6611 5.8201 5.8201 5.8624 5.8624 11.0190 11.0190 13.3418 13.3418 13.7737 13.7737 13.8265 13.8265 14.1053 14.1053 14.2396 14.2396 14.9862 14.9862 k = 0.5530 0.1704 0.0323 ( 4150 PWs) bands (ev): -31.1652 -31.1652 -14.1678 -14.1678 -14.1424 -14.1424 -13.1826 -13.1826 -13.1404 -13.1404 -13.1208 -13.1208 -12.7680 -12.7680 -12.4858 -12.4858 -12.2755 -12.2755 -12.0500 -12.0500 -11.7064 -11.7064 -10.8158 -10.8158 -10.7701 -10.7701 -9.8617 -9.8617 -9.8299 -9.8299 -1.6696 -1.6696 0.0382 0.0382 0.9681 0.9681 1.0551 1.0551 2.0182 2.0182 2.1221 2.1221 2.4505 2.4505 2.7400 2.7400 4.2110 4.2110 4.2913 4.2913 5.0780 5.0780 5.1553 5.1553 5.2740 5.2740 5.3445 5.3445 5.6637 5.6637 5.6721 5.6721 5.8216 5.8216 5.8572 5.8572 10.9958 10.9958 13.3355 13.3355 13.7846 13.7846 13.8290 13.8290 14.0890 14.0890 14.2264 14.2264 14.9701 14.9701 k = 0.5454 0.1774 0.0481 ( 4156 PWs) bands (ev): -31.1652 -31.1652 -14.1668 -14.1668 -14.1417 -14.1417 -13.1853 -13.1853 -13.1393 -13.1393 -13.1248 -13.1248 -12.7679 -12.7679 -12.4776 -12.4776 -12.2679 -12.2679 -12.0757 -12.0757 -11.7015 -11.7015 -10.8093 -10.8093 -10.7744 -10.7744 -9.8508 -9.8508 -9.8269 -9.8269 -1.6816 -1.6816 0.0256 0.0256 0.9688 0.9688 1.0430 1.0430 2.0355 2.0355 2.1138 2.1138 2.4498 2.4498 2.7272 2.7272 4.2339 4.2339 4.2990 4.2990 5.0905 5.0905 5.1468 5.1468 5.2776 5.2776 5.3351 5.3351 5.6769 5.6769 5.6862 5.6862 5.8230 5.8230 5.8523 5.8523 10.9754 10.9754 13.3299 13.3299 13.7947 13.7947 13.8318 13.8318 14.0736 14.0736 14.2143 14.2143 14.9562 14.9562 k = 0.5379 0.1843 0.0639 ( 4148 PWs) bands (ev): -31.1652 -31.1652 -14.1659 -14.1659 -14.1411 -14.1411 -13.1881 -13.1881 -13.1382 -13.1382 -13.1278 -13.1278 -12.7679 -12.7679 -12.4700 -12.4700 -12.2596 -12.2596 -12.1001 -12.1001 -11.6972 -11.6972 -10.8040 -10.8040 -10.7780 -10.7780 -9.8414 -9.8414 -9.8243 -9.8243 -1.6918 -1.6918 0.0147 0.0147 0.9684 0.9684 1.0336 1.0336 2.0510 2.0510 2.1068 2.1068 2.4492 2.4492 2.7155 2.7155 4.2535 4.2535 4.3062 4.3062 5.1017 5.1017 5.1372 5.1372 5.2820 5.2820 5.3256 5.3256 5.6883 5.6883 5.7002 5.7002 5.8241 5.8241 5.8478 5.8478 10.9580 10.9580 13.3249 13.3249 13.8038 13.8038 13.8348 13.8348 14.0592 14.0592 14.2035 14.2035 14.9445 14.9445 k = 0.5303 0.1913 0.0796 ( 4156 PWs) bands (ev): -31.1652 -31.1652 -14.1653 -14.1653 -14.1405 -14.1405 -13.1907 -13.1907 -13.1372 -13.1372 -13.1301 -13.1301 -12.7679 -12.7679 -12.4634 -12.4634 -12.2504 -12.2504 -12.1230 -12.1230 -11.6936 -11.6936 -10.7999 -10.7999 -10.7807 -10.7807 -9.8338 -9.8338 -9.8221 -9.8221 -1.7002 -1.7002 0.0057 0.0057 0.9672 0.9672 1.0268 1.0268 2.0645 2.0645 2.1009 2.1009 2.4487 2.4487 2.7053 2.7053 4.2693 4.2693 4.3129 4.3129 5.1114 5.1114 5.1279 5.1279 5.2865 5.2865 5.3166 5.3166 5.6985 5.6985 5.7123 5.7123 5.8249 5.8249 5.8438 5.8438 10.9436 10.9436 13.3208 13.3208 13.8116 13.8116 13.8380 13.8380 14.0463 14.0463 14.1942 14.1942 14.9349 14.9349 k = 0.5227 0.1983 0.0954 ( 4162 PWs) bands (ev): -31.1652 -31.1652 -14.1649 -14.1649 -14.1400 -14.1400 -13.1929 -13.1929 -13.1363 -13.1363 -13.1316 -13.1316 -12.7678 -12.7678 -12.4579 -12.4579 -12.2401 -12.2401 -12.1443 -12.1443 -11.6906 -11.6906 -10.7972 -10.7972 -10.7824 -10.7824 -9.8281 -9.8281 -9.8201 -9.8201 -1.7067 -1.7067 -0.0013 -0.0013 0.9655 0.9655 1.0223 1.0223 2.0754 2.0754 2.0963 2.0963 2.4482 2.4482 2.6968 2.6968 4.2809 4.2809 4.3191 4.3191 5.1172 5.1172 5.1220 5.1220 5.2904 5.2904 5.3088 5.3088 5.7070 5.7070 5.7223 5.7223 5.8249 5.8249 5.8407 5.8407 10.9324 10.9324 13.3175 13.3175 13.8176 13.8176 13.8412 13.8412 14.0354 14.0354 14.1867 14.1867 14.9275 14.9275 k = 0.5151 0.2053 0.1112 ( 4172 PWs) bands (ev): -31.1653 -31.1653 -14.1646 -14.1646 -14.1397 -14.1397 -13.1946 -13.1946 -13.1357 -13.1357 -13.1327 -13.1327 -12.7678 -12.7678 -12.4538 -12.4538 -12.2287 -12.2287 -12.1638 -12.1638 -11.6885 -11.6885 -10.7959 -10.7959 -10.7831 -10.7831 -9.8243 -9.8243 -9.8184 -9.8184 -1.7114 -1.7114 -0.0064 -0.0064 0.9638 0.9638 1.0195 1.0195 2.0835 2.0835 2.0930 2.0930 2.4479 2.4479 2.6906 2.6906 4.2885 4.2885 4.3245 4.3245 5.1125 5.1125 5.1265 5.1265 5.2933 5.2933 5.3029 5.3029 5.7133 5.7133 5.7301 5.7301 5.8241 5.8241 5.8390 5.8390 10.9243 10.9243 13.3151 13.3151 13.8217 13.8217 13.8443 13.8443 14.0270 14.0270 14.1813 14.1813 14.9222 14.9222 k = 0.5076 0.2122 0.1270 ( 4172 PWs) bands (ev): -31.1653 -31.1653 -14.1644 -14.1644 -14.1394 -14.1394 -13.1957 -13.1957 -13.1354 -13.1354 -13.1332 -13.1332 -12.7678 -12.7678 -12.4512 -12.4512 -12.2163 -12.2163 -12.1811 -12.1811 -11.6872 -11.6872 -10.7955 -10.7955 -10.7831 -10.7831 -9.8223 -9.8223 -9.8170 -9.8170 -1.7142 -1.7142 -0.0095 -0.0095 0.9626 0.9626 1.0180 1.0180 2.0883 2.0883 2.0912 2.0912 2.4477 2.4477 2.6867 2.6867 4.2926 4.2926 4.3282 4.3282 5.1086 5.1086 5.1302 5.1302 5.2944 5.2944 5.2998 5.2998 5.7171 5.7171 5.7351 5.7351 5.8229 5.8229 5.8384 5.8384 10.9194 10.9194 13.3137 13.3137 13.8241 13.8241 13.8466 13.8466 14.0217 14.0217 14.1779 14.1779 14.9190 14.9190 k = 0.5000 0.2192 0.1428 ( 4180 PWs) bands (ev): -31.1653 -31.1653 -14.1643 -14.1643 -14.1394 -14.1394 -13.1961 -13.1961 -13.1353 -13.1353 -13.1334 -13.1334 -12.7678 -12.7678 -12.4504 -12.4504 -12.2076 -12.2076 -12.1916 -12.1916 -11.6868 -11.6868 -10.7955 -10.7955 -10.7831 -10.7831 -9.8217 -9.8217 -9.8165 -9.8165 -1.7152 -1.7152 -0.0105 -0.0105 0.9622 0.9622 1.0176 1.0176 2.0894 2.0894 2.0910 2.0910 2.4476 2.4476 2.6854 2.6854 4.2940 4.2940 4.3296 4.3296 5.1073 5.1073 5.1315 5.1315 5.2943 5.2943 5.2992 5.2992 5.7184 5.7184 5.7368 5.7368 5.8223 5.8223 5.8382 5.8382 10.9178 10.9178 13.3132 13.3132 13.8248 13.8248 13.8474 13.8474 14.0198 14.0198 14.1768 14.1768 14.9180 14.9180 k = 0.5000 0.2192 0.1428 ( 4180 PWs) bands (ev): -31.1653 -31.1653 -14.1643 -14.1643 -14.1394 -14.1394 -13.1961 -13.1961 -13.1353 -13.1353 -13.1334 -13.1334 -12.7678 -12.7678 -12.4504 -12.4504 -12.2076 -12.2076 -12.1916 -12.1916 -11.6868 -11.6868 -10.7955 -10.7955 -10.7831 -10.7831 -9.8217 -9.8217 -9.8165 -9.8165 -1.7152 -1.7152 -0.0105 -0.0105 0.9622 0.9622 1.0176 1.0176 2.0894 2.0894 2.0910 2.0910 2.4476 2.4476 2.6854 2.6854 4.2940 4.2940 4.3296 4.3296 5.1073 5.1073 5.1315 5.1315 5.2943 5.2943 5.2992 5.2992 5.7184 5.7184 5.7368 5.7368 5.8223 5.8223 5.8382 5.8382 10.9178 10.9178 13.3132 13.3132 13.8248 13.8248 13.8474 13.8474 14.0198 14.0198 14.1768 14.1768 14.9180 14.9180 k = 0.4833 0.2119 0.1381 ( 4171 PWs) bands (ev): -31.1653 -31.1653 -14.1643 -14.1643 -14.1393 -14.1393 -13.1958 -13.1958 -13.1353 -13.1353 -13.1332 -13.1332 -12.7678 -12.7678 -12.4507 -12.4507 -12.2078 -12.2078 -12.1930 -12.1930 -11.6856 -11.6856 -10.7949 -10.7949 -10.7825 -10.7825 -9.8221 -9.8221 -9.8169 -9.8169 -1.7150 -1.7150 -0.0108 -0.0108 0.9624 0.9624 1.0177 1.0177 2.0890 2.0890 2.0906 2.0906 2.4343 2.4343 2.6992 2.6992 4.2948 4.2948 4.3304 4.3304 5.0939 5.0939 5.1451 5.1451 5.2940 5.2940 5.2988 5.2988 5.7167 5.7167 5.7351 5.7351 5.8239 5.8239 5.8398 5.8398 10.9172 10.9172 13.3142 13.3142 13.8252 13.8252 13.8479 13.8479 13.9985 13.9985 14.1988 14.1988 14.9167 14.9167 k = 0.4667 0.2046 0.1333 ( 4159 PWs) bands (ev): -31.1653 -31.1653 -14.1643 -14.1643 -14.1393 -14.1393 -13.1949 -13.1949 -13.1352 -13.1352 -13.1327 -13.1327 -12.7678 -12.7678 -12.4518 -12.4518 -12.2085 -12.2085 -12.1972 -12.1972 -11.6821 -11.6821 -10.7932 -10.7932 -10.7806 -10.7806 -9.8233 -9.8233 -9.8182 -9.8182 -1.7144 -1.7144 -0.0117 -0.0117 0.9629 0.9629 1.0183 1.0183 2.0876 2.0876 2.0892 2.0892 2.4009 2.4009 2.7340 2.7340 4.2974 4.2974 4.3330 4.3330 5.0731 5.0731 5.1664 5.1664 5.2929 5.2929 5.2976 5.2976 5.7118 5.7118 5.7303 5.7303 5.8284 5.8284 5.8442 5.8442 10.9154 10.9154 13.3172 13.3172 13.8260 13.8260 13.8491 13.8491 13.9533 13.9533 14.2462 14.2462 14.9129 14.9129 k = 0.4500 0.1973 0.1286 ( 4156 PWs) bands (ev): -31.1653 -31.1653 -14.1642 -14.1642 -14.1392 -14.1392 -13.1935 -13.1935 -13.1350 -13.1350 -13.1318 -13.1318 -12.7678 -12.7678 -12.4535 -12.4535 -12.2098 -12.2098 -12.2041 -12.2041 -11.6764 -11.6764 -10.7905 -10.7905 -10.7776 -10.7776 -9.8253 -9.8253 -9.8203 -9.8203 -1.7134 -1.7134 -0.0132 -0.0132 0.9638 0.9638 1.0192 1.0192 2.0854 2.0854 2.0869 2.0869 2.3574 2.3574 2.7798 2.7798 4.3018 4.3018 4.3372 4.3372 5.0517 5.0517 5.1888 5.1888 5.2910 5.2910 5.2957 5.2957 5.7045 5.7045 5.7231 5.7231 5.8351 5.8351 5.8509 5.8509 10.9124 10.9124 13.3220 13.3220 13.8265 13.8265 13.8511 13.8511 13.9022 13.9022 14.3015 14.3015 14.9069 14.9069 k = 0.4333 0.1900 0.1238 ( 4156 PWs) bands (ev): -31.1653 -31.1653 -14.1641 -14.1641 -14.1391 -14.1391 -13.1916 -13.1916 -13.1348 -13.1348 -13.1306 -13.1306 -12.7678 -12.7678 -12.4560 -12.4560 -12.2134 -12.2134 -12.2116 -12.2116 -11.6688 -11.6688 -10.7866 -10.7866 -10.7734 -10.7734 -9.8281 -9.8281 -9.8232 -9.8232 -1.7120 -1.7120 -0.0153 -0.0153 0.9650 0.9650 1.0205 1.0205 2.0822 2.0822 2.0838 2.0838 2.3096 2.3096 2.8309 2.8309 4.3078 4.3078 4.3431 4.3431 5.0304 5.0304 5.2114 5.2114 5.2884 5.2884 5.2930 5.2930 5.6953 5.6953 5.7140 5.7140 5.8435 5.8435 5.8591 5.8591 10.9081 10.9081 13.3285 13.3285 13.8206 13.8206 13.8538 13.8538 13.8574 13.8574 14.3583 14.3583 14.8996 14.8996 k = 0.4167 0.1827 0.1190 ( 4153 PWs) bands (ev): -31.1653 -31.1653 -14.1640 -14.1640 -14.1390 -14.1390 -13.1893 -13.1893 -13.1346 -13.1346 -13.1289 -13.1289 -12.7677 -12.7677 -12.4592 -12.4592 -12.2248 -12.2248 -12.2138 -12.2138 -11.6594 -11.6594 -10.7817 -10.7817 -10.7680 -10.7680 -9.8317 -9.8317 -9.8269 -9.8269 -1.7103 -1.7103 -0.0180 -0.0180 0.9666 0.9666 1.0222 1.0222 2.0782 2.0782 2.0798 2.0798 2.2602 2.2602 2.8844 2.8844 4.3154 4.3154 4.3507 4.3507 5.0094 5.0094 5.2341 5.2341 5.2850 5.2850 5.2896 5.2896 5.6848 5.6848 5.7037 5.7037 5.8528 5.8528 5.8684 5.8684 10.9027 10.9027 13.3366 13.3366 13.7846 13.7846 13.8444 13.8444 13.8573 13.8573 14.4138 14.4138 14.8923 14.8923 k = 0.4000 0.1754 0.1143 ( 4159 PWs) bands (ev): -31.1653 -31.1653 -14.1638 -14.1638 -14.1388 -14.1388 -13.1865 -13.1865 -13.1343 -13.1343 -13.1267 -13.1267 -12.7677 -12.7677 -12.4632 -12.4632 -12.2380 -12.2380 -12.2164 -12.2164 -11.6486 -11.6486 -10.7757 -10.7757 -10.7616 -10.7616 -9.8360 -9.8360 -9.8315 -9.8315 -1.7082 -1.7082 -0.0212 -0.0212 0.9684 0.9684 1.0241 1.0241 2.0734 2.0734 2.0751 2.0751 2.2106 2.2106 2.9391 2.9391 4.3247 4.3247 4.3598 4.3598 4.9887 4.9887 5.2566 5.2566 5.2809 5.2809 5.2855 5.2855 5.6735 5.6735 5.6925 5.6925 5.8629 5.8629 5.8783 5.8783 10.8960 10.8960 13.3457 13.3457 13.7365 13.7365 13.8465 13.8465 13.8615 13.8615 14.4653 14.4653 14.8867 14.8867 k = 0.3833 0.1681 0.1095 ( 4165 PWs) bands (ev): -31.1653 -31.1653 -14.1636 -14.1636 -14.1386 -14.1386 -13.1834 -13.1834 -13.1340 -13.1340 -13.1240 -13.1240 -12.7677 -12.7677 -12.4679 -12.4679 -12.2528 -12.2528 -12.2195 -12.2195 -11.6368 -11.6368 -10.7688 -10.7688 -10.7541 -10.7541 -9.8411 -9.8411 -9.8368 -9.8368 -1.7058 -1.7058 -0.0250 -0.0250 0.9706 0.9706 1.0264 1.0264 2.0677 2.0677 2.0696 2.0696 2.1616 2.1616 2.9940 2.9940 4.3356 4.3356 4.3705 4.3705 4.9686 4.9686 5.2759 5.2759 5.2763 5.2763 5.2834 5.2834 5.6615 5.6615 5.6807 5.6807 5.8734 5.8734 5.8887 5.8887 10.8881 10.8881 13.3554 13.3554 13.6897 13.6897 13.8512 13.8512 13.8663 13.8663 14.5099 14.5099 14.8859 14.8859 k = 0.3667 0.1608 0.1047 ( 4171 PWs) bands (ev): -31.1653 -31.1653 -14.1634 -14.1634 -14.1384 -14.1384 -13.1801 -13.1801 -13.1336 -13.1336 -13.1207 -13.1207 -12.7676 -12.7676 -12.4733 -12.4733 -12.2686 -12.2686 -12.2229 -12.2229 -11.6240 -11.6240 -10.7610 -10.7610 -10.7455 -10.7455 -9.8468 -9.8468 -9.8428 -9.8428 -1.7031 -1.7031 -0.0293 -0.0293 0.9731 0.9731 1.0290 1.0290 2.0607 2.0607 2.0634 2.0634 2.1141 2.1141 3.0487 3.0487 4.3480 4.3480 4.3827 4.3827 4.9490 4.9490 5.2702 5.2702 5.2735 5.2735 5.3027 5.3027 5.6491 5.6491 5.6685 5.6685 5.8841 5.8841 5.8993 5.8993 10.8788 10.8788 13.3647 13.3647 13.6469 13.6469 13.8572 13.8572 13.8717 13.8717 14.5438 14.5438 14.8936 14.8936 k = 0.3500 0.1534 0.1000 ( 4177 PWs) bands (ev): -31.1653 -31.1653 -14.1632 -14.1632 -14.1381 -14.1381 -13.1767 -13.1767 -13.1331 -13.1331 -13.1166 -13.1166 -12.7676 -12.7676 -12.4796 -12.4796 -12.2853 -12.2853 -12.2266 -12.2266 -11.6107 -11.6107 -10.7523 -10.7523 -10.7361 -10.7361 -9.8532 -9.8532 -9.8496 -9.8496 -1.7000 -1.7000 -0.0341 -0.0341 0.9758 0.9758 1.0319 1.0319 2.0494 2.0494 2.0567 2.0567 2.0716 2.0716 3.1028 3.1028 4.3618 4.3618 4.3963 4.3963 4.9300 4.9300 5.2636 5.2636 5.2669 5.2669 5.3249 5.3249 5.6364 5.6364 5.6559 5.6559 5.8949 5.8949 5.9100 5.9100 10.8684 10.8684 13.3721 13.3721 13.6099 13.6099 13.8641 13.8641 13.8777 13.8777 14.5639 14.5639 14.9129 14.9129 k = 0.3333 0.1461 0.0952 ( 4171 PWs) bands (ev): -31.1653 -31.1653 -14.1630 -14.1630 -14.1379 -14.1379 -13.1732 -13.1732 -13.1327 -13.1327 -13.1117 -13.1117 -12.7675 -12.7675 -12.4868 -12.4868 -12.3025 -12.3025 -12.2305 -12.2305 -11.5969 -11.5969 -10.7428 -10.7428 -10.7258 -10.7258 -9.8603 -9.8603 -9.8570 -9.8570 -1.6967 -1.6967 -0.0394 -0.0394 0.9787 0.9787 1.0350 1.0350 2.0160 2.0160 2.0494 2.0494 2.0522 2.0522 3.1559 3.1559 4.3770 4.3770 4.4113 4.4113 4.9116 4.9116 5.2562 5.2562 5.2592 5.2592 5.3470 5.3470 5.6236 5.6236 5.6432 5.6432 5.9058 5.9058 5.9208 5.9208 10.8568 10.8568 13.3755 13.3755 13.5811 13.5811 13.8716 13.8716 13.8841 13.8841 14.5695 14.5695 14.9449 14.9449 k = 0.3167 0.1388 0.0905 ( 4165 PWs) bands (ev): -31.1653 -31.1653 -14.1627 -14.1627 -14.1376 -14.1376 -13.1698 -13.1698 -13.1322 -13.1322 -13.1060 -13.1060 -12.7675 -12.7675 -12.4949 -12.4949 -12.3199 -12.3199 -12.2347 -12.2347 -11.5829 -11.5829 -10.7326 -10.7326 -10.7147 -10.7147 -9.8679 -9.8679 -9.8651 -9.8651 -1.6932 -1.6932 -0.0451 -0.0451 0.9819 0.9819 1.0383 1.0383 1.9735 1.9735 2.0417 2.0417 2.0431 2.0431 3.2079 3.2079 4.3936 4.3936 4.4276 4.4276 4.8939 4.8939 5.2478 5.2478 5.2505 5.2505 5.3689 5.3689 5.6108 5.6108 5.6305 5.6305 5.9167 5.9167 5.9315 5.9315 10.8439 10.8439 13.3724 13.3724 13.5631 13.5631 13.8796 13.8796 13.8910 13.8910 14.5630 14.5630 14.9873 14.9873 k = 0.3000 0.1315 0.0857 ( 4165 PWs) bands (ev): -31.1653 -31.1653 -14.1624 -14.1624 -14.1373 -14.1373 -13.1666 -13.1666 -13.1317 -13.1317 -13.0992 -13.0992 -12.7674 -12.7674 -12.5040 -12.5040 -12.3371 -12.3371 -12.2391 -12.2391 -11.5689 -11.5689 -10.7218 -10.7218 -10.7029 -10.7029 -9.8761 -9.8761 -9.8737 -9.8737 -1.6894 -1.6894 -0.0512 -0.0512 0.9852 0.9852 1.0419 1.0419 1.9318 1.9318 2.0337 2.0337 2.0347 2.0347 3.2583 3.2583 4.4114 4.4114 4.4451 4.4451 4.8769 4.8769 5.2385 5.2385 5.2409 5.2409 5.3905 5.3905 5.5981 5.5981 5.6178 5.6178 5.9274 5.9274 5.9422 5.9422 10.8300 10.8300 13.3617 13.3617 13.5567 13.5567 13.8881 13.8881 13.8982 13.8982 14.5477 14.5477 15.0370 15.0370 k = 0.2833 0.1242 0.0809 ( 4165 PWs) bands (ev): -31.1653 -31.1653 -14.1622 -14.1622 -14.1370 -14.1370 -13.1636 -13.1636 -13.1311 -13.1311 -13.0915 -13.0915 -12.7674 -12.7674 -12.5144 -12.5144 -12.3539 -12.3539 -12.2436 -12.2436 -11.5550 -11.5550 -10.7104 -10.7104 -10.6905 -10.6905 -9.8848 -9.8848 -9.8829 -9.8829 -1.6855 -1.6855 -0.0576 -0.0576 0.9887 0.9887 1.0456 1.0456 1.8917 1.8917 2.0253 2.0253 2.0263 2.0263 3.3071 3.3071 4.4303 4.4303 4.4638 4.4638 4.8607 4.8607 5.2283 5.2283 5.2302 5.2302 5.4118 5.4118 5.5856 5.5856 5.6052 5.6052 5.9379 5.9379 5.9526 5.9526 10.8151 10.8151 13.3448 13.3448 13.5605 13.5605 13.8969 13.8969 13.9056 13.9056 14.5268 14.5268 15.0912 15.0912 k = 0.2667 0.1169 0.0762 ( 4168 PWs) bands (ev): -31.1653 -31.1653 -14.1619 -14.1619 -14.1367 -14.1367 -13.1608 -13.1608 -13.1306 -13.1306 -13.0828 -13.0828 -12.7673 -12.7673 -12.5260 -12.5260 -12.3700 -12.3700 -12.2481 -12.2481 -11.5414 -11.5414 -10.6985 -10.6985 -10.6775 -10.6775 -9.8939 -9.8939 -9.8926 -9.8926 -1.6814 -1.6814 -0.0643 -0.0643 0.9922 0.9922 1.0494 1.0494 1.8535 1.8535 2.0168 2.0168 2.0179 2.0179 3.3540 3.3540 4.4504 4.4504 4.4836 4.4836 4.8453 4.8453 5.2170 5.2170 5.2184 5.2184 5.4326 5.4326 5.5734 5.5734 5.5930 5.5930 5.9481 5.9481 5.9628 5.9628 10.7992 10.7992 13.3248 13.3248 13.5712 13.5712 13.9059 13.9059 13.9131 13.9131 14.5025 14.5025 15.1480 15.1480 k = 0.2500 0.1096 0.0714 ( 4144 PWs) bands (ev): -31.1653 -31.1653 -14.1616 -14.1616 -14.1364 -14.1364 -13.1583 -13.1583 -13.1300 -13.1300 -13.0730 -13.0730 -12.7673 -12.7673 -12.5389 -12.5389 -12.3851 -12.3851 -12.2526 -12.2526 -11.5281 -11.5281 -10.6863 -10.6863 -10.6642 -10.6642 -9.9033 -9.9033 -9.9026 -9.9026 -1.6772 -1.6772 -0.0713 -0.0713 0.9959 0.9959 1.0532 1.0532 1.8175 1.8175 2.0082 2.0082 2.0095 2.0095 3.3989 3.3989 4.4714 4.4714 4.5043 4.5043 4.8307 4.8307 5.2047 5.2047 5.2056 5.2056 5.4530 5.4530 5.5617 5.5617 5.5811 5.5811 5.9581 5.9581 5.9727 5.9727 10.7826 10.7826 13.3040 13.3040 13.5860 13.5860 13.9151 13.9151 13.9208 13.9208 14.4764 14.4764 15.2061 15.2061 k = 0.2333 0.1023 0.0667 ( 4150 PWs) bands (ev): -31.1653 -31.1653 -14.1613 -14.1613 -14.1361 -14.1361 -13.1560 -13.1560 -13.1294 -13.1294 -13.0624 -13.0624 -12.7672 -12.7672 -12.5532 -12.5532 -12.3990 -12.3990 -12.2572 -12.2572 -11.5152 -11.5152 -10.6739 -10.6739 -10.6506 -10.6506 -9.9131 -9.9131 -9.9129 -9.9129 -1.6730 -1.6730 -0.0784 -0.0784 0.9996 0.9996 1.0571 1.0571 1.7835 1.7835 1.9997 1.9997 2.0010 2.0010 3.4415 3.4415 4.4933 4.4933 4.5260 4.5260 4.8169 4.8169 5.1912 5.1912 5.1916 5.1916 5.4727 5.4727 5.5504 5.5504 5.5697 5.5697 5.9677 5.9677 5.9823 5.9823 10.7655 10.7655 13.2841 13.2841 13.6030 13.6030 13.9242 13.9242 13.9284 13.9284 14.4495 14.4495 15.2645 15.2645 k = 0.2167 0.0950 0.0619 ( 4150 PWs) bands (ev): -31.1653 -31.1653 -14.1610 -14.1610 -14.1358 -14.1358 -13.1539 -13.1539 -13.1289 -13.1289 -13.0508 -13.0508 -12.7672 -12.7672 -12.5689 -12.5689 -12.4117 -12.4117 -12.2616 -12.2616 -11.5030 -11.5030 -10.6613 -10.6613 -10.6368 -10.6368 -9.9237 -9.9237 -9.9229 -9.9229 -1.6688 -1.6688 -0.0855 -0.0855 1.0032 1.0032 1.0611 1.0611 1.7518 1.7518 1.9912 1.9912 1.9927 1.9927 3.4817 3.4817 4.5161 4.5161 4.5485 4.5485 4.8040 4.8040 5.1765 5.1765 5.1768 5.1768 5.4918 5.4918 5.5398 5.5398 5.5588 5.5588 5.9770 5.9770 5.9915 5.9915 10.7479 10.7479 13.2659 13.2659 13.6209 13.6209 13.9332 13.9332 13.9360 13.9360 14.4228 14.4228 15.3226 15.3226 k = 0.2000 0.0877 0.0571 ( 4153 PWs) bands (ev): -31.1653 -31.1653 -14.1607 -14.1607 -14.1355 -14.1355 -13.1520 -13.1520 -13.1283 -13.1283 -13.0384 -13.0384 -12.7672 -12.7672 -12.5858 -12.5858 -12.4231 -12.4231 -12.2660 -12.2660 -11.4914 -11.4914 -10.6487 -10.6487 -10.6230 -10.6230 -9.9344 -9.9344 -9.9329 -9.9329 -1.6646 -1.6646 -0.0927 -0.0927 1.0069 1.0069 1.0649 1.0649 1.7224 1.7224 1.9829 1.9829 1.9847 1.9847 3.5195 3.5195 4.5396 4.5396 4.5717 4.5717 4.7920 4.7920 5.1603 5.1603 5.1611 5.1611 5.5099 5.5099 5.5302 5.5302 5.5486 5.5486 5.9857 5.9857 6.0003 6.0003 10.7303 10.7303 13.2498 13.2498 13.6386 13.6386 13.9421 13.9421 13.9433 13.9433 14.3970 14.3970 15.3800 15.3800 k = 0.1833 0.0804 0.0524 ( 4153 PWs) bands (ev): -31.1653 -31.1653 -14.1605 -14.1605 -14.1352 -14.1352 -13.1502 -13.1502 -13.1278 -13.1278 -13.0252 -13.0252 -12.7672 -12.7672 -12.6038 -12.6038 -12.4332 -12.4332 -12.2702 -12.2702 -11.4805 -11.4805 -10.6362 -10.6362 -10.6093 -10.6093 -9.9452 -9.9452 -9.9428 -9.9428 -1.6605 -1.6605 -0.0997 -0.0997 1.0104 1.0104 1.0687 1.0687 1.6953 1.6953 1.9749 1.9749 1.9769 1.9769 3.5546 3.5546 4.5637 4.5637 4.5957 4.5957 4.7809 4.7809 5.1430 5.1430 5.1443 5.1443 5.5193 5.5193 5.5291 5.5291 5.5391 5.5391 5.9940 5.9940 6.0085 6.0085 10.7126 10.7126 13.2361 13.2361 13.6556 13.6556 13.9504 13.9504 13.9506 13.9506 14.3728 14.3728 15.4361 15.4361 k = 0.1667 0.0731 0.0476 ( 4160 PWs) bands (ev): -31.1653 -31.1653 -14.1602 -14.1602 -14.1349 -14.1349 -13.1487 -13.1487 -13.1272 -13.1272 -13.0112 -13.0112 -12.7672 -12.7672 -12.6227 -12.6227 -12.4421 -12.4421 -12.2741 -12.2741 -11.4703 -11.4703 -10.6240 -10.6240 -10.5958 -10.5958 -9.9559 -9.9559 -9.9527 -9.9527 -1.6565 -1.6565 -0.1065 -0.1065 1.0138 1.0138 1.0724 1.0724 1.6705 1.6705 1.9672 1.9672 1.9694 1.9694 3.5870 3.5870 4.5883 4.5883 4.6201 4.6201 4.7706 4.7706 5.1246 5.1246 5.1265 5.1265 5.5116 5.5116 5.5304 5.5304 5.5449 5.5449 6.0017 6.0017 6.0162 6.0162 10.6954 10.6954 13.2247 13.2247 13.6711 13.6711 13.9571 13.9571 13.9587 13.9587 14.3505 14.3505 15.4905 15.4905 k = 0.1500 0.0658 0.0429 ( 4121 PWs) bands (ev): -31.1653 -31.1653 -14.1600 -14.1600 -14.1347 -14.1347 -13.1473 -13.1473 -13.1267 -13.1267 -12.9964 -12.9964 -12.7673 -12.7673 -12.6421 -12.6421 -12.4499 -12.4499 -12.2778 -12.2778 -11.4609 -11.4609 -10.6122 -10.6122 -10.5827 -10.5827 -9.9664 -9.9664 -9.9622 -9.9622 -1.6527 -1.6527 -0.1130 -0.1130 1.0170 1.0170 1.0758 1.0758 1.6481 1.6481 1.9600 1.9600 1.9624 1.9624 3.6165 3.6165 4.6132 4.6132 4.6451 4.6451 4.7613 4.7613 5.1053 5.1053 5.1076 5.1076 5.5041 5.5041 5.5224 5.5224 5.5603 5.5603 6.0089 6.0089 6.0234 6.0234 10.6787 10.6787 13.2155 13.2155 13.6849 13.6849 13.9636 13.9636 13.9665 13.9665 14.3307 14.3307 15.5428 15.5428 k = 0.1333 0.0585 0.0381 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1598 -14.1598 -14.1344 -14.1344 -13.1460 -13.1460 -13.1263 -13.1263 -12.9810 -12.9810 -12.7675 -12.7675 -12.6621 -12.6621 -12.4567 -12.4567 -12.2812 -12.2812 -11.4525 -11.4525 -10.6010 -10.6010 -10.5703 -10.5703 -9.9765 -9.9765 -9.9714 -9.9714 -1.6492 -1.6492 -0.1192 -0.1192 1.0201 1.0201 1.0791 1.0791 1.6281 1.6281 1.9533 1.9533 1.9560 1.9560 3.6431 3.6431 4.6384 4.6384 4.6703 4.6703 4.7529 4.7529 5.0852 5.0852 5.0878 5.0878 5.4973 5.4973 5.5153 5.5153 5.5747 5.5747 6.0153 6.0153 6.0299 6.0299 10.6630 10.6630 13.2084 13.2084 13.6965 13.6965 13.9695 13.9695 13.9735 13.9735 14.3135 14.3135 15.5925 15.5925 k = 0.1167 0.0511 0.0333 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1595 -14.1595 -14.1342 -14.1342 -13.1449 -13.1449 -13.1259 -13.1259 -12.9650 -12.9650 -12.7679 -12.7679 -12.6822 -12.6822 -12.4625 -12.4625 -12.2843 -12.2843 -11.4449 -11.4449 -10.5906 -10.5906 -10.5586 -10.5586 -9.9860 -9.9860 -9.9800 -9.9800 -1.6460 -1.6460 -0.1249 -0.1249 1.0228 1.0228 1.0820 1.0820 1.6104 1.6104 1.9473 1.9473 1.9501 1.9501 3.6668 3.6668 4.6636 4.6636 4.6958 4.6958 4.7455 4.7455 5.0644 5.0644 5.0671 5.0671 5.4914 5.4914 5.5090 5.5090 5.5877 5.5877 6.0212 6.0212 6.0357 6.0357 10.6483 10.6483 13.2031 13.2031 13.7059 13.7059 13.9748 13.9748 13.9800 13.9800 14.2992 14.2992 15.6390 15.6390 k = 0.1000 0.0438 0.0286 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1594 -14.1594 -14.1340 -14.1340 -13.1439 -13.1439 -13.1255 -13.1255 -12.9484 -12.9484 -12.7686 -12.7686 -12.7022 -12.7022 -12.4675 -12.4675 -12.2870 -12.2870 -11.4383 -11.4383 -10.5811 -10.5811 -10.5479 -10.5479 -9.9948 -9.9948 -9.9879 -9.9879 -1.6431 -1.6431 -0.1300 -0.1300 1.0253 1.0253 1.0847 1.0847 1.5951 1.5951 1.9418 1.9418 1.9448 1.9448 3.6874 3.6874 4.6886 4.6886 4.7214 4.7214 4.7392 4.7392 5.0432 5.0432 5.0457 5.0457 5.4862 5.4862 5.5036 5.5036 5.5992 5.5992 6.0263 6.0263 6.0408 6.0408 10.6350 10.6350 13.1993 13.1993 13.7130 13.7130 13.9795 13.9795 13.9857 13.9857 14.2875 14.2875 15.6818 15.6818 k = 0.0833 0.0365 0.0238 ( 4124 PWs) bands (ev): -31.1653 -31.1653 -14.1592 -14.1592 -14.1338 -14.1338 -13.1431 -13.1431 -13.1252 -13.1252 -12.9313 -12.9313 -12.7700 -12.7700 -12.7215 -12.7215 -12.4716 -12.4716 -12.2894 -12.2894 -11.4326 -11.4326 -10.5726 -10.5726 -10.5384 -10.5384 -10.0027 -10.0027 -9.9949 -9.9949 -1.6405 -1.6405 -0.1345 -0.1345 1.0275 1.0275 1.0870 1.0870 1.5821 1.5821 1.9371 1.9371 1.9403 1.9403 3.7049 3.7049 4.7128 4.7128 4.7341 4.7341 4.7468 4.7468 5.0219 5.0219 5.0239 5.0239 5.4819 5.4819 5.4990 5.4990 5.6093 5.6093 6.0307 6.0307 6.0452 6.0452 10.6234 10.6234 13.1968 13.1968 13.7181 13.7181 13.9836 13.9836 13.9907 13.9907 14.2785 14.2785 15.7203 15.7203 k = 0.0667 0.0292 0.0190 ( 4130 PWs) bands (ev): -31.1653 -31.1653 -14.1591 -14.1591 -14.1337 -14.1337 -13.1424 -13.1424 -13.1249 -13.1249 -12.9138 -12.9138 -12.7732 -12.7732 -12.7388 -12.7388 -12.4750 -12.4750 -12.2914 -12.2914 -11.4279 -11.4279 -10.5654 -10.5654 -10.5303 -10.5303 -10.0095 -10.0095 -10.0009 -10.0009 -1.6384 -1.6384 -0.1383 -0.1383 1.0293 1.0293 1.0890 1.0890 1.5715 1.5715 1.9332 1.9332 1.9365 1.9365 3.7192 3.7192 4.7273 4.7273 4.7386 4.7386 4.7717 4.7717 5.0009 5.0009 5.0018 5.0018 5.4783 5.4783 5.4953 5.4953 5.6176 5.6176 6.0343 6.0343 6.0489 6.0489 10.6135 10.6135 13.1952 13.1952 13.7215 13.7215 13.9870 13.9870 13.9948 13.9948 14.2719 14.2719 15.7538 15.7539 k = 0.0500 0.0219 0.0143 ( 4133 PWs) bands (ev): -31.1653 -31.1653 -14.1590 -14.1590 -14.1336 -14.1336 -13.1419 -13.1419 -13.1247 -13.1247 -12.8961 -12.8961 -12.7810 -12.7810 -12.7511 -12.7511 -12.4776 -12.4776 -12.2929 -12.2929 -11.4243 -11.4243 -10.5597 -10.5597 -10.5237 -10.5237 -10.0149 -10.0149 -10.0058 -10.0058 -1.6367 -1.6367 -0.1413 -0.1413 1.0307 1.0307 1.0905 1.0905 1.5633 1.5633 1.9301 1.9301 1.9335 1.9335 3.7304 3.7304 4.7248 4.7248 4.7593 4.7593 4.7956 4.7956 4.9801 4.9801 4.9812 4.9812 5.4756 5.4756 5.4924 5.4924 5.6242 5.6242 6.0372 6.0372 6.0517 6.0517 10.6057 10.6057 13.1943 13.1943 13.7235 13.7235 13.9897 13.9897 13.9980 13.9980 14.2673 14.2673 15.7820 15.7820 k = 0.0333 0.0146 0.0095 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1589 -14.1589 -14.1335 -14.1335 -13.1415 -13.1415 -13.1245 -13.1245 -12.8786 -12.8786 -12.7944 -12.7944 -12.7568 -12.7568 -12.4794 -12.4794 -12.2940 -12.2940 -11.4217 -11.4217 -10.5555 -10.5555 -10.5189 -10.5189 -10.0190 -10.0190 -10.0094 -10.0094 -1.6354 -1.6354 -0.1435 -0.1435 1.0318 1.0318 1.0917 1.0917 1.5574 1.5574 1.9279 1.9279 1.9314 1.9314 3.7385 3.7385 4.7224 4.7224 4.7778 4.7778 4.8172 4.8172 4.9600 4.9600 4.9640 4.9640 5.4737 5.4737 5.4903 5.4903 5.6290 5.6290 6.0392 6.0392 6.0538 6.0538 10.6000 10.6000 13.1939 13.1939 13.7246 13.7246 13.9917 13.9917 14.0004 14.0004 14.2642 14.2642 15.8043 15.8043 k = 0.0167 0.0073 0.0048 ( 4133 PWs) bands (ev): -31.1653 -31.1653 -14.1589 -14.1589 -14.1335 -14.1335 -13.1413 -13.1413 -13.1244 -13.1244 -12.8628 -12.8628 -12.8092 -12.8092 -12.7589 -12.7589 -12.4805 -12.4805 -12.2947 -12.2947 -11.4201 -11.4201 -10.5529 -10.5529 -10.5160 -10.5160 -10.0215 -10.0215 -10.0115 -10.0115 -1.6347 -1.6347 -0.1448 -0.1448 1.0324 1.0324 1.0923 1.0923 1.5539 1.5539 1.9265 1.9265 1.9301 1.9301 3.7433 3.7433 4.7210 4.7210 4.7909 4.7909 4.8341 4.8341 4.9441 4.9441 4.9517 4.9517 5.4725 5.4725 5.4891 5.4891 5.6319 5.6319 6.0404 6.0404 6.0550 6.0550 10.5965 10.5965 13.1937 13.1937 13.7251 13.7251 13.9928 13.9928 14.0018 14.0018 14.2626 14.2626 15.8202 15.8203 k = 0.0000 0.0000 0.0000 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1588 -14.1588 -14.1334 -14.1334 -13.1412 -13.1412 -13.1244 -13.1244 -12.8547 -12.8547 -12.8172 -12.8172 -12.7595 -12.7595 -12.4809 -12.4809 -12.2950 -12.2950 -11.4195 -11.4195 -10.5520 -10.5520 -10.5150 -10.5150 -10.0223 -10.0223 -10.0123 -10.0123 -1.6344 -1.6344 -0.1452 -0.1452 1.0326 1.0326 1.0926 1.0926 1.5527 1.5527 1.9261 1.9261 1.9296 1.9296 3.7449 3.7449 4.7205 4.7205 4.7958 4.7958 4.8410 4.8410 4.9376 4.9376 4.9471 4.9471 5.4721 5.4721 5.4887 5.4887 5.6329 5.6329 6.0409 6.0409 6.0554 6.0554 10.5954 10.5954 13.1937 13.1937 13.7253 13.7253 13.9932 13.9932 14.0023 14.0023 14.2621 14.2621 15.8391 15.8392 k = 0.0000 0.0000 0.0000 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1588 -14.1588 -14.1334 -14.1334 -13.1412 -13.1412 -13.1244 -13.1244 -12.8547 -12.8547 -12.8172 -12.8172 -12.7595 -12.7595 -12.4809 -12.4809 -12.2950 -12.2950 -11.4195 -11.4195 -10.5520 -10.5520 -10.5150 -10.5150 -10.0223 -10.0223 -10.0123 -10.0123 -1.6344 -1.6344 -0.1452 -0.1452 1.0326 1.0326 1.0926 1.0926 1.5527 1.5527 1.9261 1.9261 1.9296 1.9296 3.7449 3.7449 4.7205 4.7205 4.7958 4.7958 4.8410 4.8410 4.9376 4.9376 4.9471 4.9471 5.4721 5.4721 5.4887 5.4887 5.6329 5.6329 6.0409 6.0409 6.0554 6.0554 10.5954 10.5954 13.1937 13.1937 13.7253 13.7253 13.9932 13.9932 14.0023 14.0023 14.2621 14.2621 15.8392 15.8392 k = 0.0076-0.0070-0.0158 ( 4131 PWs) bands (ev): -31.1653 -31.1653 -14.1589 -14.1589 -14.1336 -14.1336 -13.1413 -13.1413 -13.1247 -13.1247 -12.8553 -12.8553 -12.8160 -12.8160 -12.7593 -12.7593 -12.4802 -12.4802 -12.2945 -12.2945 -11.4196 -11.4196 -10.5530 -10.5530 -10.5160 -10.5160 -10.0222 -10.0222 -10.0121 -10.0121 -1.6335 -1.6335 -0.1444 -0.1444 1.0324 1.0324 1.0924 1.0924 1.5539 1.5539 1.9263 1.9263 1.9301 1.9301 3.7444 3.7444 4.7199 4.7199 4.7933 4.7933 4.8377 4.8377 4.9395 4.9395 4.9498 4.9498 5.4688 5.4688 5.4860 5.4860 5.6383 5.6383 6.0398 6.0398 6.0545 6.0545 10.5980 10.5980 13.1932 13.1932 13.7257 13.7257 13.9936 13.9936 14.0028 14.0028 14.2618 14.2618 15.8025 15.8025 k = 0.0152-0.0140-0.0316 ( 4133 PWs) bands (ev): -31.1653 -31.1653 -14.1592 -14.1592 -14.1339 -14.1339 -13.1417 -13.1417 -13.1254 -13.1254 -12.8571 -12.8571 -12.8127 -12.8127 -12.7589 -12.7589 -12.4783 -12.4783 -12.2933 -12.2933 -11.4198 -11.4198 -10.5559 -10.5559 -10.5190 -10.5190 -10.0221 -10.0221 -10.0111 -10.0111 -1.6306 -1.6306 -0.1418 -0.1418 1.0318 1.0318 1.0921 1.0921 1.5576 1.5576 1.9260 1.9260 1.9324 1.9324 3.7430 3.7430 4.7175 4.7175 4.7862 4.7862 4.8296 4.8296 4.9438 4.9438 4.9578 4.9578 5.4572 5.4572 5.4816 5.4816 5.6527 5.6527 6.0365 6.0365 6.0519 6.0519 10.6058 10.6058 13.1915 13.1915 13.7270 13.7270 13.9939 13.9939 14.0049 14.0049 14.2613 14.2613 15.7738 15.7738 k = 0.0227-0.0209-0.0474 ( 4129 PWs) bands (ev): -31.1653 -31.1653 -14.1597 -14.1597 -14.1345 -14.1345 -13.1424 -13.1424 -13.1266 -13.1266 -12.8596 -12.8596 -12.8077 -12.8077 -12.7580 -12.7580 -12.4751 -12.4751 -12.2912 -12.2912 -11.4201 -11.4201 -10.5608 -10.5608 -10.5239 -10.5239 -10.0227 -10.0227 -10.0089 -10.0089 -1.6259 -1.6259 -0.1376 -0.1376 1.0304 1.0304 1.0919 1.0919 1.5636 1.5636 1.9246 1.9246 1.9371 1.9371 3.7406 3.7406 4.7122 4.7122 4.7743 4.7743 4.8208 4.8208 4.9483 4.9483 4.9704 4.9704 5.4381 5.4381 5.4780 5.4780 5.6725 5.6725 6.0300 6.0300 6.0488 6.0488 10.6188 10.6188 13.1889 13.1889 13.7291 13.7291 13.9932 13.9932 14.0097 14.0097 14.2604 14.2604 15.7465 15.7465 k = 0.0303-0.0279-0.0632 ( 4135 PWs) bands (ev): -31.1653 -31.1653 -14.1603 -14.1603 -14.1353 -14.1353 -13.1434 -13.1434 -13.1282 -13.1282 -12.8625 -12.8625 -12.8018 -12.8018 -12.7565 -12.7565 -12.4708 -12.4708 -12.2882 -12.2882 -11.4205 -11.4205 -10.5676 -10.5676 -10.5305 -10.5305 -10.0244 -10.0244 -10.0051 -10.0051 -1.6192 -1.6192 -0.1317 -0.1317 1.0277 1.0277 1.0927 1.0927 1.5719 1.5719 1.9225 1.9225 1.9439 1.9439 3.7372 3.7372 4.7023 4.7023 4.7567 4.7567 4.8163 4.8163 4.9517 4.9517 4.9863 4.9863 5.4152 5.4152 5.4743 5.4743 5.6953 5.6953 6.0201 6.0201 6.0455 6.0455 10.6367 10.6367 13.1853 13.1853 13.7321 13.7321 13.9913 13.9913 14.0171 14.0171 14.2591 14.2591 15.7205 15.7206 k = 0.0379-0.0349-0.0791 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1612 -14.1612 -14.1363 -14.1363 -13.1448 -13.1448 -13.1299 -13.1299 -12.8654 -12.8654 -12.7955 -12.7955 -12.7540 -12.7540 -12.4654 -12.4654 -12.2842 -12.2842 -11.4211 -11.4211 -10.5764 -10.5764 -10.5385 -10.5385 -10.0272 -10.0272 -10.0001 -10.0001 -1.6107 -1.6107 -0.1241 -0.1241 1.0230 1.0230 1.0950 1.0950 1.5825 1.5825 1.9197 1.9197 1.9526 1.9526 3.7329 3.7329 4.6870 4.6870 4.7341 4.7341 4.8177 4.8177 4.9534 4.9534 5.0047 5.0047 5.3904 5.3904 5.4701 5.4701 5.7196 5.7196 6.0070 6.0070 6.0421 6.0421 10.6594 10.6594 13.1809 13.1809 13.7358 13.7358 13.9884 13.9884 14.0268 14.0268 14.2574 14.2574 15.6960 15.6960 k = 0.0455-0.0419-0.0949 ( 4127 PWs) bands (ev): -31.1653 -31.1653 -14.1624 -14.1624 -14.1374 -14.1374 -13.1467 -13.1467 -13.1317 -13.1317 -12.8682 -12.8682 -12.7894 -12.7894 -12.7500 -12.7500 -12.4593 -12.4593 -12.2792 -12.2792 -11.4220 -11.4220 -10.5871 -10.5871 -10.5477 -10.5477 -10.0308 -10.0308 -9.9941 -9.9941 -1.6004 -1.6004 -0.1149 -0.1149 1.0163 1.0163 1.0992 1.0992 1.5953 1.5953 1.9162 1.9162 1.9632 1.9632 3.7276 3.7276 4.6662 4.6662 4.7082 4.7082 4.8240 4.8240 4.9529 4.9529 5.0248 5.0248 5.3649 5.3649 5.4651 5.4651 5.7446 5.7446 5.9915 5.9915 6.0385 6.0385 10.6866 10.6866 13.1759 13.1759 13.7404 13.7404 13.9848 13.9848 14.0383 14.0383 14.2555 14.2555 15.6727 15.6727 k = 0.0530-0.0489-0.1107 ( 4123 PWs) bands (ev): -31.1652 -31.1652 -14.1638 -14.1638 -14.1385 -14.1385 -13.1491 -13.1491 -13.1335 -13.1335 -12.8709 -12.8709 -12.7844 -12.7844 -12.7439 -12.7439 -12.4525 -12.4525 -12.2732 -12.2732 -11.4230 -11.4230 -10.5997 -10.5997 -10.5578 -10.5578 -10.0352 -10.0352 -9.9874 -9.9874 -1.5883 -1.5883 -0.1042 -0.1042 1.0074 1.0074 1.1055 1.1055 1.6101 1.6101 1.9122 1.9122 1.9756 1.9756 3.7212 3.7212 4.6397 4.6397 4.6811 4.6811 4.8334 4.8334 4.9504 4.9504 5.0463 5.0463 5.3393 5.3393 5.4593 5.4593 5.7696 5.7696 5.9739 5.9739 6.0345 6.0345 10.7179 10.7179 13.1703 13.1703 13.7458 13.7458 13.9806 13.9806 14.0514 14.0514 14.2532 14.2532 15.6505 15.6506 k = 0.0606-0.0558-0.1265 ( 4125 PWs) bands (ev): -31.1652 -31.1652 -14.1654 -14.1654 -14.1398 -14.1398 -13.1520 -13.1520 -13.1352 -13.1352 -12.8733 -12.8733 -12.7806 -12.7806 -12.7356 -12.7356 -12.4452 -12.4452 -12.2660 -12.2660 -11.4244 -11.4244 -10.6141 -10.6141 -10.5685 -10.5685 -10.0404 -10.0404 -9.9802 -9.9802 -1.5744 -1.5744 -0.0919 -0.0919 0.9966 0.9966 1.1138 1.1138 1.6268 1.6268 1.9076 1.9076 1.9896 1.9896 3.7137 3.7137 4.6076 4.6076 4.6540 4.6540 4.8442 4.8442 4.9464 4.9464 5.0691 5.0691 5.3141 5.3141 5.4527 5.4527 5.7943 5.7943 5.9552 5.9552 6.0302 6.0302 10.7532 10.7532 13.1642 13.1642 13.7520 13.7520 13.9757 13.9757 14.0656 14.0656 14.2506 14.2506 15.6292 15.6292 k = 0.0682-0.0628-0.1423 ( 4126 PWs) bands (ev): -31.1652 -31.1652 -14.1674 -14.1674 -14.1411 -14.1411 -13.1552 -13.1552 -13.1368 -13.1368 -12.8753 -12.8753 -12.7780 -12.7780 -12.7253 -12.7253 -12.4377 -12.4377 -12.2576 -12.2576 -11.4261 -11.4261 -10.6302 -10.6302 -10.5796 -10.5796 -10.0463 -10.0463 -9.9727 -9.9727 -1.5588 -1.5588 -0.0781 -0.0781 0.9842 0.9842 1.1240 1.1240 1.6453 1.6453 1.9026 1.9026 2.0052 2.0052 3.7050 3.7050 4.5710 4.5710 4.6266 4.6266 4.8540 4.8540 4.9421 4.9421 5.0931 5.0931 5.2895 5.2895 5.4453 5.4453 5.8179 5.8179 5.9362 5.9362 6.0257 6.0257 10.7920 10.7920 13.1579 13.1579 13.7590 13.7590 13.9702 13.9702 14.0808 14.0808 14.2478 14.2478 15.6082 15.6082 k = 0.0758-0.0698-0.1581 ( 4128 PWs) bands (ev): -31.1652 -31.1652 -14.1697 -14.1697 -14.1424 -14.1424 -13.1587 -13.1587 -13.1385 -13.1385 -12.8768 -12.8768 -12.7763 -12.7763 -12.7134 -12.7134 -12.4299 -12.4299 -12.2480 -12.2480 -11.4283 -11.4283 -10.6479 -10.6479 -10.5909 -10.5909 -10.0530 -10.0530 -9.9651 -9.9651 -1.5415 -1.5415 -0.0630 -0.0630 0.9705 0.9705 1.1360 1.1360 1.6654 1.6654 1.8972 1.8972 2.0223 2.0223 3.6950 3.6950 4.5309 4.5309 4.5987 4.5987 4.8599 4.8599 4.9400 4.9400 5.1182 5.1182 5.2657 5.2657 5.4372 5.4372 5.8382 5.8382 5.9193 5.9193 6.0209 6.0209 10.8339 10.8339 13.1515 13.1515 13.7669 13.7669 13.9642 13.9642 14.0965 14.0965 14.2446 14.2446 15.5873 15.5873 k = 0.0834-0.0768-0.1739 ( 4126 PWs) bands (ev): -31.1652 -31.1652 -14.1722 -14.1722 -14.1436 -14.1436 -13.1624 -13.1624 -13.1401 -13.1401 -12.8778 -12.8778 -12.7751 -12.7751 -12.7004 -12.7004 -12.4222 -12.4222 -12.2371 -12.2371 -11.4308 -11.4308 -10.6671 -10.6671 -10.6022 -10.6022 -10.0604 -10.0604 -9.9577 -9.9577 -1.5227 -1.5227 -0.0464 -0.0464 0.9558 0.9558 1.1497 1.1497 1.6867 1.6867 1.8916 1.8916 2.0408 2.0408 3.6836 3.6836 4.4882 4.4882 4.5696 4.5696 4.8585 4.8585 4.9430 4.9430 5.1444 5.1444 5.2431 5.2431 5.4284 5.4284 5.8495 5.8495 5.9107 5.9107 6.0162 6.0162 10.8786 10.8786 13.1451 13.1451 13.7756 13.7756 13.9578 13.9578 14.1125 14.1125 14.2413 14.2413 15.5656 15.5656 k = 0.0909-0.0838-0.1897 ( 4130 PWs) bands (ev): -31.1651 -31.1651 -14.1750 -14.1750 -14.1449 -14.1449 -13.1662 -13.1662 -13.1419 -13.1419 -12.8783 -12.8783 -12.7742 -12.7742 -12.6865 -12.6865 -12.4145 -12.4145 -12.2249 -12.2249 -11.4340 -11.4340 -10.6876 -10.6876 -10.6133 -10.6133 -10.0685 -10.0685 -9.9504 -9.9504 -1.5023 -1.5023 -0.0286 -0.0286 0.9403 0.9403 1.1649 1.1649 1.7089 1.7089 1.8862 1.8862 2.0605 2.0605 3.6705 3.6705 4.4436 4.4436 4.5393 4.5393 4.8489 4.8489 4.9515 4.9515 5.1713 5.1713 5.2218 5.2218 5.4191 5.4191 5.8441 5.8441 5.9178 5.9178 6.0118 6.0118 10.9257 10.9257 13.1388 13.1388 13.7853 13.7853 13.9510 13.9510 14.1284 14.1284 14.2377 14.2377 15.5426 15.5426 k = 0.0985-0.0908-0.2056 ( 4134 PWs) bands (ev): -31.1651 -31.1651 -14.1780 -14.1780 -14.1461 -14.1461 -13.1701 -13.1701 -13.1438 -13.1438 -12.8782 -12.8782 -12.7736 -12.7736 -12.6722 -12.6722 -12.4069 -12.4069 -12.2115 -12.2115 -11.4376 -11.4376 -10.7092 -10.7092 -10.6241 -10.6241 -10.0773 -10.0773 -9.9435 -9.9435 -1.4805 -1.4805 -0.0095 -0.0095 0.9242 0.9242 1.1817 1.1817 1.7314 1.7314 1.8814 1.8814 2.0813 2.0813 3.6555 3.6555 4.3979 4.3979 4.5076 4.5076 4.8331 4.8331 4.9633 4.9633 5.1918 5.1918 5.2090 5.2090 5.4095 5.4095 5.8282 5.8282 5.9343 5.9343 6.0085 6.0085 10.9749 10.9749 13.1327 13.1327 13.7958 13.7958 13.9440 13.9440 14.1439 14.1439 14.2338 14.2338 15.5174 15.5174 k = 0.1061-0.0977-0.2214 ( 4132 PWs) bands (ev): -31.1651 -31.1651 -14.1811 -14.1811 -14.1474 -14.1474 -13.1739 -13.1739 -13.1458 -13.1458 -12.8774 -12.8774 -12.7731 -12.7731 -12.6575 -12.6575 -12.3994 -12.3994 -12.1968 -12.1968 -11.4419 -11.4419 -10.7320 -10.7320 -10.6343 -10.6343 -10.0867 -10.0867 -9.9370 -9.9370 -1.4573 -1.4573 0.0107 0.0107 0.9078 0.9078 1.1998 1.1998 1.7530 1.7530 1.8783 1.8783 2.1030 2.1030 3.6382 3.6382 4.3516 4.3516 4.4746 4.4746 4.8131 4.8131 4.9762 4.9762 5.1778 5.1778 5.2324 5.2324 5.3997 5.3997 5.8092 5.8092 5.9514 5.9514 6.0079 6.0079 11.0256 11.0256 13.1270 13.1270 13.8071 13.8071 13.9368 13.9368 14.1589 14.1589 14.2298 14.2298 15.4892 15.4892 k = 0.1137-0.1047-0.2372 ( 4144 PWs) bands (ev): -31.1650 -31.1650 -14.1844 -14.1844 -14.1486 -14.1486 -13.1776 -13.1776 -13.1480 -13.1480 -12.8759 -12.8759 -12.7726 -12.7726 -12.6426 -12.6426 -12.3920 -12.3920 -12.1811 -12.1811 -11.4468 -11.4468 -10.7556 -10.7556 -10.6438 -10.6438 -10.0967 -10.0967 -9.9311 -9.9311 -1.4328 -1.4328 0.0320 0.0320 0.8912 0.8912 1.2193 1.2193 1.7718 1.7718 1.8788 1.8788 2.1256 2.1256 3.6183 3.6183 4.3054 4.3054 4.4404 4.4404 4.7902 4.7902 4.9889 4.9889 5.1591 5.1591 5.2619 5.2619 5.3902 5.3902 5.7896 5.7896 5.9634 5.9634 6.0135 6.0135 11.0776 11.0776 13.1217 13.1217 13.8190 13.8190 13.9296 13.9296 14.1730 14.1730 14.2256 14.2256 15.4574 15.4574 k = 0.1212-0.1117-0.2530 ( 4154 PWs) bands (ev): -31.1650 -31.1650 -14.1878 -14.1878 -14.1499 -14.1499 -13.1812 -13.1812 -13.1502 -13.1502 -12.8738 -12.8738 -12.7722 -12.7722 -12.6278 -12.6278 -12.3847 -12.3847 -12.1643 -12.1643 -11.4523 -11.4523 -10.7801 -10.7801 -10.6525 -10.6525 -10.1073 -10.1073 -9.9258 -9.9258 -1.4071 -1.4071 0.0544 0.0544 0.8745 0.8745 1.2401 1.2401 1.7849 1.7849 1.8856 1.8856 2.1487 2.1487 3.5954 3.5954 4.2597 4.2597 4.4055 4.4055 4.7652 4.7652 5.0004 5.0004 5.1408 5.1408 5.2919 5.2919 5.3816 5.3816 5.7702 5.7702 5.9677 5.9677 6.0271 6.0271 11.1306 11.1306 13.1169 13.1169 13.8311 13.8311 13.9230 13.9230 14.1861 14.1861 14.2213 14.2213 15.4217 15.4217 k = 0.1288-0.1187-0.2688 ( 4160 PWs) bands (ev): -31.1650 -31.1650 -14.1913 -14.1913 -14.1513 -14.1513 -13.1847 -13.1847 -13.1525 -13.1525 -12.8711 -12.8711 -12.7718 -12.7718 -12.6133 -12.6133 -12.3774 -12.3774 -12.1465 -12.1465 -11.4586 -11.4586 -10.8053 -10.8053 -10.6603 -10.6603 -10.1183 -10.1183 -9.9212 -9.9212 -1.3803 -1.3803 0.0777 0.0777 0.8580 0.8580 1.2619 1.2619 1.7902 1.7902 1.9006 1.9006 2.1723 2.1723 3.5690 3.5690 4.2153 4.2153 4.3701 4.3701 4.7384 4.7384 5.0100 5.0100 5.1231 5.1231 5.3208 5.3208 5.3753 5.3753 5.7515 5.7515 5.9673 5.9673 6.0458 6.0458 11.1841 11.1841 13.1127 13.1127 13.8425 13.8425 13.9179 13.9179 14.1977 14.1977 14.2173 14.2173 15.3824 15.3824 k = 0.1364-0.1257-0.2846 ( 4164 PWs) bands (ev): -31.1650 -31.1650 -14.1947 -14.1947 -14.1526 -14.1526 -13.1881 -13.1881 -13.1549 -13.1549 -12.8677 -12.8677 -12.7714 -12.7714 -12.5991 -12.5991 -12.3700 -12.3700 -12.1279 -12.1279 -11.4655 -11.4655 -10.8310 -10.8310 -10.6672 -10.6672 -10.1298 -10.1298 -9.9173 -9.9173 -1.3525 -1.3525 0.1019 0.1019 0.8417 0.8417 1.2848 1.2848 1.7891 1.7891 1.9227 1.9227 2.1961 2.1961 3.5388 3.5388 4.1726 4.1726 4.3347 4.3347 4.7104 4.7104 5.0173 5.0173 5.1059 5.1059 5.3429 5.3429 5.3765 5.3765 5.7335 5.7335 5.9654 5.9654 6.0664 6.0664 11.2380 11.2380 13.1092 13.1092 13.8512 13.8512 13.9160 13.9160 14.2057 14.2057 14.2157 14.2157 15.3398 15.3398 k = 0.1440-0.1326-0.3004 ( 4162 PWs) bands (ev): -31.1649 -31.1649 -14.1981 -14.1981 -14.1540 -14.1540 -13.1913 -13.1913 -13.1573 -13.1573 -12.8637 -12.8637 -12.7710 -12.7710 -12.5854 -12.5854 -12.3625 -12.3625 -12.1086 -12.1086 -11.4730 -11.4730 -10.8571 -10.8571 -10.6730 -10.6730 -10.1416 -10.1416 -9.9143 -9.9143 -1.3237 -1.3237 0.1270 0.1270 0.8259 0.8259 1.3083 1.3083 1.7838 1.7838 1.9493 1.9493 2.2200 2.2200 3.5045 3.5045 4.1319 4.1319 4.3001 4.3001 4.6813 4.6813 5.0220 5.0220 5.0894 5.0894 5.3487 5.3487 5.3950 5.3950 5.7163 5.7163 5.9636 5.9636 6.0874 6.0874 11.2918 11.2918 13.1065 13.1065 13.8549 13.8549 13.9200 13.9200 14.2050 14.2050 14.2218 14.2218 15.2947 15.2947 k = 0.1516-0.1396-0.3162 ( 4158 PWs) bands (ev): -31.1649 -31.1649 -14.2014 -14.2014 -14.1555 -14.1555 -13.1944 -13.1944 -13.1598 -13.1598 -12.8592 -12.8592 -12.7705 -12.7705 -12.5724 -12.5724 -12.3548 -12.3548 -12.0886 -12.0886 -11.4811 -11.4811 -10.8836 -10.8836 -10.6778 -10.6778 -10.1537 -10.1537 -9.9120 -9.9120 -1.2942 -1.2942 0.1528 0.1528 0.8105 0.8105 1.3325 1.3325 1.7762 1.7762 1.9785 1.9785 2.2436 2.2436 3.4660 3.4660 4.0935 4.0935 4.2668 4.2668 4.6514 4.6514 5.0238 5.0238 5.0735 5.0735 5.3474 5.3474 5.4209 5.4209 5.6998 5.6998 5.9628 5.9628 6.1083 6.1083 11.3455 11.3455 13.1047 13.1047 13.8525 13.8525 13.9303 13.9303 14.2012 14.2012 14.2298 14.2298 15.2479 15.2479 k = 0.1591-0.1466-0.3320 ( 4156 PWs) bands (ev): -31.1649 -31.1649 -14.2046 -14.2046 -14.1571 -14.1571 -13.1973 -13.1973 -13.1622 -13.1622 -12.8542 -12.8542 -12.7700 -12.7700 -12.5602 -12.5602 -12.3470 -12.3470 -12.0682 -12.0682 -11.4896 -11.4896 -10.9102 -10.9102 -10.6815 -10.6815 -10.1659 -10.1659 -9.9107 -9.9107 -1.2640 -1.2640 0.1793 0.1793 0.7958 0.7958 1.3569 1.3569 1.7675 1.7675 2.0092 2.0092 2.2668 2.2668 3.4232 3.4232 4.0573 4.0573 4.2355 4.2355 4.6210 4.6210 5.0225 5.0225 5.0583 5.0583 5.3461 5.3461 5.4469 5.4469 5.6839 5.6839 5.9636 5.9636 6.1286 6.1286 11.3986 11.3986 13.1037 13.1037 13.8459 13.8459 13.9450 13.9450 14.1973 14.1973 14.2371 14.2371 15.2000 15.2000 k = 0.1667-0.1536-0.3479 ( 4154 PWs) bands (ev): -31.1648 -31.1648 -14.2076 -14.2076 -14.1587 -14.1587 -13.2000 -13.2000 -13.1646 -13.1646 -12.8488 -12.8488 -12.7694 -12.7694 -12.5489 -12.5489 -12.3389 -12.3389 -12.0472 -12.0472 -11.4986 -11.4986 -10.9369 -10.9369 -10.6843 -10.6843 -10.1781 -10.1781 -9.9102 -9.9102 -1.2333 -1.2333 0.2064 0.2064 0.7818 0.7818 1.3812 1.3812 1.7583 1.7583 2.0408 2.0408 2.2893 2.2893 3.3766 3.3766 4.0230 4.0230 4.2071 4.2071 4.5902 4.5902 5.0181 5.0181 5.0438 5.0438 5.3463 5.3463 5.4710 5.4710 5.6686 5.6686 5.9665 5.9665 6.1483 6.1483 11.4510 11.4510 13.1038 13.1038 13.8367 13.8367 13.9620 13.9620 14.1942 14.1942 14.2434 14.2434 15.1519 15.1519 k = 0.1743-0.1606-0.3637 ( 4160 PWs) bands (ev): -31.1648 -31.1648 -14.2105 -14.2105 -14.1604 -14.1604 -13.2025 -13.2025 -13.1669 -13.1669 -12.8430 -12.8430 -12.7688 -12.7688 -12.5386 -12.5386 -12.3307 -12.3307 -12.0260 -12.0260 -11.5080 -11.5080 -10.9634 -10.9634 -10.6861 -10.6861 -10.1903 -10.1903 -9.9106 -9.9106 -1.2022 -1.2022 0.2341 0.2341 0.7685 0.7685 1.4049 1.4049 1.7492 1.7492 2.0727 2.0727 2.3108 2.3108 3.3266 3.3266 3.9903 3.9903 4.1821 4.1821 4.5594 4.5594 5.0109 5.0109 5.0300 5.0300 5.3481 5.3481 5.4923 5.4923 5.6537 5.6537 5.9718 5.9718 6.1671 6.1671 11.5025 11.5025 13.1049 13.1049 13.8258 13.8258 13.9796 13.9796 14.1923 14.1923 14.2486 14.2486 15.1040 15.1040 k = 0.1819-0.1675-0.3795 ( 4160 PWs) bands (ev): -31.1648 -31.1648 -14.2132 -14.2132 -14.1621 -14.1621 -13.2049 -13.2049 -13.1692 -13.1692 -12.8368 -12.8368 -12.7680 -12.7680 -12.5294 -12.5294 -12.3225 -12.3225 -12.0045 -12.0045 -11.5175 -11.5175 -10.9897 -10.9897 -10.6872 -10.6872 -10.2023 -10.2023 -9.9119 -9.9119 -1.1708 -1.1708 0.2622 0.2622 0.7562 0.7562 1.4274 1.4274 1.7408 1.7408 2.1048 2.1048 2.3312 2.3312 3.2738 3.2738 3.9591 3.9591 4.1608 4.1608 4.5289 4.5289 5.0015 5.0015 5.0165 5.0165 5.3514 5.3514 5.5105 5.5105 5.6391 5.6391 5.9800 5.9800 6.1850 6.1850 11.5529 11.5529 13.1071 13.1071 13.8137 13.8137 13.9964 13.9964 14.1927 14.1927 14.2530 14.2530 15.0570 15.0570 k = 0.1894-0.1745-0.3953 ( 4168 PWs) bands (ev): -31.1647 -31.1647 -14.2156 -14.2156 -14.1640 -14.1640 -13.2071 -13.2071 -13.1714 -13.1714 -12.8305 -12.8305 -12.7671 -12.7671 -12.5213 -12.5213 -12.3142 -12.3142 -11.9829 -11.9829 -11.5271 -11.5271 -11.0155 -11.0155 -10.6875 -10.6875 -10.2140 -10.2140 -9.9142 -9.9142 -1.1393 -1.1393 0.2908 0.2908 0.7447 0.7447 1.4478 1.4478 1.7339 1.7339 2.1365 2.1365 2.3501 2.3501 3.2189 3.2189 3.9292 3.9292 4.1434 4.1434 4.4990 4.4990 4.9904 4.9904 5.0030 5.0030 5.3559 5.3559 5.5251 5.5251 5.6247 5.6247 5.9910 5.9910 6.2019 6.2019 11.6021 11.6021 13.1106 13.1106 13.8004 13.8004 14.0109 14.0109 14.1963 14.1963 14.2564 14.2564 15.0113 15.0113 k = 0.1970-0.1815-0.4111 ( 4164 PWs) bands (ev): -31.1647 -31.1647 -14.2178 -14.2178 -14.1659 -14.1659 -13.2092 -13.2092 -13.1734 -13.1734 -12.8241 -12.8241 -12.7660 -12.7660 -12.5143 -12.5143 -12.3061 -12.3061 -11.9611 -11.9611 -11.5367 -11.5367 -11.0407 -11.0407 -10.6873 -10.6873 -10.2252 -10.2252 -9.9173 -9.9173 -1.1078 -1.1078 0.3198 0.3198 0.7342 0.7342 1.4651 1.4651 1.7294 1.7294 2.1676 2.1676 2.3675 2.3675 3.1628 3.1628 3.9006 3.9006 4.1296 4.1296 4.4701 4.4701 4.9784 4.9784 4.9891 4.9891 5.3613 5.3613 5.5362 5.5362 5.6106 5.6106 6.0048 6.0048 6.2176 6.2176 11.6500 11.6500 13.1153 13.1153 13.7861 13.7861 14.0219 14.0219 14.2044 14.2044 14.2591 14.2591 14.9674 14.9674 k = 0.2046-0.1885-0.4269 ( 4162 PWs) bands (ev): -31.1647 -31.1647 -14.2197 -14.2197 -14.1679 -14.1679 -13.2110 -13.2110 -13.1753 -13.1753 -12.8177 -12.8177 -12.7647 -12.7647 -12.5084 -12.5084 -12.2983 -12.2983 -11.9394 -11.9394 -11.5461 -11.5461 -11.0651 -11.0651 -10.6866 -10.6866 -10.2357 -10.2357 -9.9214 -9.9214 -1.0766 -1.0766 0.3491 0.3491 0.7248 0.7248 1.4781 1.4781 1.7281 1.7281 2.1978 2.1978 2.3830 2.3830 3.1062 3.1062 3.8736 3.8736 4.1190 4.1190 4.4428 4.4428 4.9654 4.9654 4.9752 4.9752 5.3671 5.3671 5.5440 5.5440 5.5967 5.5967 6.0210 6.0210 6.2322 6.2322 11.6964 11.6964 13.1213 13.1213 13.7708 13.7708 14.0284 14.0284 14.2175 14.2175 14.2614 14.2614 14.9257 14.9257 k = 0.2122-0.1955-0.4427 ( 4156 PWs) bands (ev): -31.1646 -31.1646 -14.2214 -14.2214 -14.1699 -14.1699 -13.2127 -13.2127 -13.1771 -13.1771 -12.8114 -12.8114 -12.7631 -12.7631 -12.5035 -12.5035 -12.2909 -12.2909 -11.9177 -11.9177 -11.5553 -11.5553 -11.0886 -11.0886 -10.6858 -10.6858 -10.2454 -10.2454 -9.9263 -9.9263 -1.0458 -1.0458 0.3785 0.3785 0.7165 0.7165 1.4856 1.4856 1.7311 1.7311 2.2265 2.2265 2.3969 2.3969 3.0500 3.0500 3.8483 3.8483 4.1110 4.1110 4.4177 4.4177 4.9508 4.9508 4.9622 4.9622 5.3727 5.3727 5.5487 5.5487 5.5835 5.5835 6.0393 6.0393 6.2456 6.2456 11.7413 11.7413 13.1286 13.1286 13.7542 13.7542 14.0303 14.0303 14.2350 14.2350 14.2636 14.2636 14.8865 14.8865 k = 0.2198-0.2025-0.4585 ( 4152 PWs) bands (ev): -31.1646 -31.1646 -14.2227 -14.2227 -14.1720 -14.1720 -13.2141 -13.2141 -13.1788 -13.1788 -12.8055 -12.8055 -12.7611 -12.7611 -12.4996 -12.4996 -12.2843 -12.2843 -11.8961 -11.8961 -11.5641 -11.5641 -11.1108 -11.1108 -10.6849 -10.6849 -10.2541 -10.2541 -9.9320 -9.9320 -1.0156 -1.0156 0.4081 0.4081 0.7094 0.7094 1.4871 1.4871 1.7387 1.7387 2.2533 2.2533 2.4090 2.4090 2.9952 2.9952 3.8247 3.8247 4.1050 4.1050 4.3955 4.3955 4.9342 4.9342 4.9505 4.9505 5.3777 5.3777 5.5501 5.5501 5.5718 5.5718 6.0591 6.0591 6.2577 6.2577 11.7846 11.7846 13.1374 13.1374 13.7364 13.7364 14.0285 14.0285 14.2525 14.2525 14.2695 14.2695 14.8504 14.8504 k = 0.2273-0.2094-0.4744 ( 4158 PWs) bands (ev): -31.1646 -31.1646 -14.2237 -14.2237 -14.1741 -14.1741 -13.2154 -13.2154 -13.1803 -13.1803 -12.8000 -12.8000 -12.7585 -12.7585 -12.4967 -12.4967 -12.2785 -12.2785 -11.8748 -11.8748 -11.5725 -11.5725 -11.1317 -11.1317 -10.6841 -10.6841 -10.2618 -10.2618 -9.9386 -9.9386 -0.9861 -0.9861 0.4377 0.4377 0.7035 0.7035 1.4826 1.4826 1.7506 1.7506 2.2773 2.2773 2.4199 2.4199 2.9425 2.9425 3.8031 3.8031 4.1002 4.1002 4.3769 4.3769 4.9162 4.9162 4.9399 4.9399 5.3812 5.3812 5.5465 5.5465 5.5643 5.5643 6.0798 6.0798 6.2685 6.2685 11.8262 11.8262 13.1475 13.1475 13.7172 13.7172 14.0238 14.0238 14.2589 14.2589 14.2889 14.2889 14.8176 14.8176 k = 0.2349-0.2164-0.4902 ( 4158 PWs) bands (ev): -31.1646 -31.1646 -14.2244 -14.2244 -14.1763 -14.1763 -13.2165 -13.2165 -13.1817 -13.1817 -12.7952 -12.7952 -12.7554 -12.7554 -12.4947 -12.4947 -12.2737 -12.2737 -11.8538 -11.8538 -11.5805 -11.5805 -11.1510 -11.1510 -10.6836 -10.6836 -10.2681 -10.2681 -9.9459 -9.9459 -0.9577 -0.9577 0.4672 0.4672 0.6988 0.6988 1.4728 1.4728 1.7659 1.7659 2.2974 2.2974 2.4303 2.4303 2.8929 2.8929 3.7831 3.7831 4.0960 4.0960 4.3627 4.3627 4.8972 4.8972 4.9300 4.9300 5.3823 5.3823 5.5384 5.5384 5.5618 5.5618 6.1008 6.1008 6.2780 6.2780 11.8660 11.8660 13.1590 13.1590 13.6965 13.6965 14.0173 14.0173 14.2599 14.2599 14.3150 14.3150 14.7886 14.7886 k = 0.2425-0.2234-0.5060 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2248 -14.2248 -14.1786 -14.1786 -13.2175 -13.2175 -13.1829 -13.1829 -12.7911 -12.7911 -12.7516 -12.7516 -12.4934 -12.4934 -12.2700 -12.2700 -11.8332 -11.8332 -11.5880 -11.5880 -11.1685 -11.1685 -10.6834 -10.6834 -10.2732 -10.2732 -9.9540 -9.9540 -0.9305 -0.9305 0.4964 0.4964 0.6956 0.6956 1.4584 1.4584 1.7835 1.7835 2.3120 2.3120 2.4414 2.4414 2.8474 2.8474 3.7645 3.7645 4.0921 4.0921 4.3535 4.3535 4.8774 4.8774 4.9209 4.9209 5.3802 5.3802 5.5297 5.5297 5.5615 5.5615 6.1218 6.1218 6.2863 6.2863 11.9039 11.9039 13.1719 13.1719 13.6744 13.6744 14.0097 14.0097 14.2596 14.2596 14.3426 14.3426 14.7640 14.7640 k = 0.2501-0.2304-0.5218 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2248 -14.2248 -14.1808 -14.1808 -13.2182 -13.2182 -13.1840 -13.1840 -12.7878 -12.7878 -12.7472 -12.7472 -12.4929 -12.4929 -12.2675 -12.2675 -11.8132 -11.8132 -11.5951 -11.5951 -11.1840 -11.1840 -10.6837 -10.6837 -10.2769 -10.2769 -9.9626 -9.9626 -0.9047 -0.9047 0.5252 0.5252 0.6939 0.6939 1.4404 1.4404 1.8025 1.8025 2.3195 2.3195 2.4542 2.4542 2.8069 2.8069 3.7469 3.7469 4.0884 4.0884 4.3498 4.3498 4.8568 4.8568 4.9124 4.9124 5.3740 5.3740 5.5223 5.5223 5.5624 5.5624 6.1422 6.1422 6.2932 6.2932 11.9399 11.9399 13.1863 13.1863 13.6507 13.6507 14.0017 14.0017 14.2589 14.2589 14.3697 14.3697 14.7445 14.7445 k = 0.2576-0.2374-0.5376 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2245 -14.2245 -14.1831 -14.1831 -13.2187 -13.2187 -13.1850 -13.1850 -12.7852 -12.7852 -12.7424 -12.7424 -12.4931 -12.4931 -12.2662 -12.2662 -11.7938 -11.7938 -11.6015 -11.6015 -11.1974 -11.1974 -10.6846 -10.6846 -10.2792 -10.2792 -9.9719 -9.9719 -0.8805 -0.8805 0.5533 0.5533 0.6939 0.6939 1.4193 1.4193 1.8222 1.8222 2.3194 2.3194 2.4693 2.4693 2.7722 2.7722 3.7298 3.7298 4.0850 4.0850 4.3513 4.3513 4.8357 4.8357 4.9046 4.9046 5.3634 5.3634 5.5166 5.5166 5.5647 5.5647 6.1618 6.1618 6.2988 6.2988 11.9738 11.9738 13.2020 13.2020 13.6256 13.6256 13.9936 13.9936 14.2577 14.2577 14.3951 14.3951 14.7308 14.7308 k = 0.2652-0.2443-0.5534 ( 4164 PWs) bands (ev): -31.1645 -31.1645 -14.2239 -14.2239 -14.1854 -14.1854 -13.2191 -13.2191 -13.1858 -13.1858 -12.7831 -12.7831 -12.7375 -12.7375 -12.4940 -12.4940 -12.2663 -12.2663 -11.7754 -11.7754 -11.6073 -11.6073 -11.2085 -11.2085 -10.6859 -10.6859 -10.2801 -10.2801 -9.9815 -9.9815 -0.8582 -0.8582 0.5804 0.5804 0.6958 0.6958 1.3958 1.3958 1.8419 1.8419 2.3118 2.3118 2.4866 2.4866 2.7437 2.7437 3.7127 3.7127 4.0827 4.0827 4.3579 4.3579 4.8141 4.8141 4.8974 4.8974 5.3487 5.3487 5.5124 5.5124 5.5688 5.5688 6.1804 6.1804 6.3031 6.3031 12.0055 12.0055 13.2189 13.2189 13.5993 13.5993 13.9860 13.9860 14.2562 14.2562 14.4174 14.4174 14.7237 14.7237 k = 0.2728-0.2513-0.5692 ( 4164 PWs) bands (ev): -31.1645 -31.1645 -14.2230 -14.2230 -14.1877 -14.1877 -13.2193 -13.2193 -13.1865 -13.1865 -12.7815 -12.7815 -12.7325 -12.7325 -12.4954 -12.4954 -12.2675 -12.2675 -11.7583 -11.7583 -11.6122 -11.6122 -11.2173 -11.2173 -10.6877 -10.6877 -10.2799 -10.2799 -9.9915 -9.9915 -0.8380 -0.8380 0.6060 0.6060 0.6999 0.6999 1.3703 1.3703 1.8613 1.8613 2.2981 2.2981 2.5050 2.5050 2.7215 2.7215 3.6951 3.6951 4.0820 4.0820 4.3689 4.3689 4.7920 4.7920 4.8907 4.8907 5.3305 5.3305 5.5089 5.5089 5.5748 5.5748 6.1976 6.1976 6.3062 6.3062 12.0350 12.0350 13.2371 13.2371 13.5721 13.5721 13.9788 13.9788 14.2545 14.2545 14.4355 14.4355 14.7242 14.7242 k = 0.2804-0.2583-0.5850 ( 4168 PWs) bands (ev): -31.1645 -31.1645 -14.2217 -14.2217 -14.1900 -14.1900 -13.2193 -13.2193 -13.1870 -13.1870 -12.7802 -12.7802 -12.7278 -12.7278 -12.4973 -12.4973 -12.2699 -12.2699 -11.7430 -11.7430 -11.6158 -11.6158 -11.2237 -11.2237 -10.6899 -10.6899 -10.2788 -10.2788 -10.0016 -10.0016 -0.8201 -0.8201 0.6296 0.6296 0.7067 0.7067 1.3432 1.3432 1.8803 1.8803 2.2796 2.2796 2.5240 2.5240 2.7052 2.7052 3.6767 3.6767 4.0836 4.0836 4.3837 4.3837 4.7695 4.7695 4.8847 4.8847 5.3096 5.3096 5.5057 5.5057 5.5826 5.5826 6.2133 6.2133 6.3080 6.3080 12.0619 12.0619 13.2563 13.2563 13.5442 13.5442 13.9724 13.9724 14.2524 14.2524 14.4490 14.4490 14.7325 14.7325 k = 0.2880-0.2653-0.6008 ( 4168 PWs) bands (ev): -31.1645 -31.1645 -14.2202 -14.2202 -14.1923 -14.1923 -13.2191 -13.2191 -13.1874 -13.1874 -12.7792 -12.7792 -12.7235 -12.7235 -12.4995 -12.4995 -12.2733 -12.2733 -11.7302 -11.7302 -11.6175 -11.6175 -11.2277 -11.2277 -10.6923 -10.6923 -10.2769 -10.2769 -10.0117 -10.0117 -0.8047 -0.8047 0.6507 0.6507 0.7162 0.7162 1.3152 1.3152 1.8987 1.8987 2.2580 2.2580 2.5429 2.5429 2.6942 2.6942 3.6573 3.6573 4.0879 4.0879 4.4015 4.4015 4.7467 4.7467 4.8793 4.8793 5.2864 5.2864 5.5024 5.5024 5.5921 5.5921 6.2275 6.2275 6.3086 6.3086 12.0862 12.0862 13.2764 13.2764 13.5164 13.5164 13.9667 13.9667 14.2499 14.2499 14.4578 14.4578 14.7482 14.7482 k = 0.2955-0.2723-0.6167 ( 4168 PWs) bands (ev): -31.1645 -31.1645 -14.2184 -14.2184 -14.1945 -14.1945 -13.2187 -13.2187 -13.1876 -13.1876 -12.7784 -12.7784 -12.7198 -12.7198 -12.5021 -12.5021 -12.2777 -12.2777 -11.7208 -11.7208 -11.6166 -11.6166 -11.2294 -11.2294 -10.6948 -10.6948 -10.2747 -10.2747 -10.0214 -10.0214 -0.7918 -0.7918 0.6690 0.6690 0.7285 0.7285 1.2869 1.2869 1.9165 1.9165 2.2345 2.2345 2.5612 2.5612 2.6877 2.6877 3.6371 3.6371 4.0950 4.0950 4.4215 4.4215 4.7235 4.7235 4.8745 4.8745 5.2616 5.2616 5.4991 5.4991 5.6029 5.6029 6.2400 6.2400 6.3080 6.3080 12.1076 12.1076 13.2970 13.2970 13.4891 13.4891 13.9619 13.9619 14.2470 14.2470 14.4632 14.4632 14.7699 14.7699 k = 0.3031-0.2792-0.6325 ( 4164 PWs) bands (ev): -31.1644 -31.1644 -14.2164 -14.2164 -14.1966 -14.1966 -13.2182 -13.2182 -13.1877 -13.1877 -12.7777 -12.7777 -12.7169 -12.7169 -12.5048 -12.5048 -12.2829 -12.2829 -11.7152 -11.7152 -11.6125 -11.6125 -11.2289 -11.2289 -10.6973 -10.6973 -10.2725 -10.2725 -10.0305 -10.0305 -0.7817 -0.7817 0.6851 0.6851 0.7423 0.7423 1.2589 1.2589 1.9338 1.9338 2.2102 2.2102 2.5783 2.5783 2.6852 2.6852 3.6161 3.6161 4.1050 4.1050 4.4432 4.4432 4.7002 4.7002 4.8704 4.8704 5.2357 5.2357 5.4957 5.4957 5.6150 5.6150 6.2509 6.2509 6.3063 6.3063 12.1259 12.1259 13.3175 13.3175 13.4635 13.4635 13.9578 13.9578 14.2435 14.2435 14.4661 14.4661 14.7959 14.7959 k = 0.3107-0.2862-0.6483 ( 4166 PWs) bands (ev): -31.1644 -31.1644 -14.2143 -14.2143 -14.1985 -14.1985 -13.2176 -13.2176 -13.1876 -13.1876 -12.7772 -12.7772 -12.7149 -12.7149 -12.5076 -12.5076 -12.2887 -12.2887 -11.7134 -11.7134 -11.6056 -11.6056 -11.2263 -11.2263 -10.6995 -10.6995 -10.2710 -10.2710 -10.0386 -10.0386 -0.7744 -0.7744 0.7000 0.7000 0.7561 0.7561 1.2325 1.2325 1.9508 1.9508 2.1861 2.1861 2.5938 2.5938 2.6862 2.6862 3.5947 3.5947 4.1176 4.1176 4.4655 4.4655 4.6768 4.6768 4.8670 4.8670 5.2090 5.2090 5.4921 5.4921 5.6279 5.6279 6.2600 6.2600 6.3036 6.3036 12.1411 12.1411 13.3363 13.3363 13.4414 13.4414 13.9545 13.9545 14.2395 14.2395 14.4679 14.4679 14.8240 14.8240 k = 0.3183-0.2932-0.6641 ( 4166 PWs) bands (ev): -31.1644 -31.1644 -14.2123 -14.2123 -14.2000 -14.2000 -13.2168 -13.2168 -13.1874 -13.1874 -12.7768 -12.7768 -12.7140 -12.7140 -12.5105 -12.5105 -12.2949 -12.2949 -11.7145 -11.7145 -11.5967 -11.5967 -11.2217 -11.2217 -10.7013 -10.7013 -10.2706 -10.2706 -10.0454 -10.0454 -0.7699 -0.7699 0.7142 0.7142 0.7683 0.7683 1.2086 1.2086 1.9674 1.9674 2.1626 2.1626 2.6067 2.6067 2.6907 2.6907 3.5732 3.5732 4.1328 4.1328 4.4877 4.4877 4.6536 4.6536 4.8645 4.8645 5.1820 5.1820 5.4885 5.4885 5.6417 5.6417 6.2675 6.2675 6.2998 6.2998 12.1527 12.1527 13.3491 13.3491 13.4275 13.4275 13.9518 13.9518 14.2347 14.2347 14.4694 14.4694 14.8487 14.8487 k = 0.3258-0.3002-0.6799 ( 4168 PWs) bands (ev): -31.1644 -31.1644 -14.2110 -14.2110 -14.2006 -14.2006 -13.2159 -13.2159 -13.1869 -13.1869 -12.7765 -12.7765 -12.7143 -12.7143 -12.5131 -12.5131 -12.3015 -12.3015 -11.7175 -11.7175 -11.5868 -11.5868 -11.2153 -11.2153 -10.7026 -10.7026 -10.2718 -10.2718 -10.0503 -10.0503 -0.7682 -0.7682 0.7273 0.7273 0.7782 0.7782 1.1888 1.1888 1.9839 1.9839 2.1402 2.1402 2.6164 2.6164 2.6989 2.6989 3.5521 3.5521 4.1501 4.1501 4.5085 4.5085 4.6310 4.6310 4.8629 4.8629 5.1552 5.1552 5.4846 5.4846 5.6560 5.6560 6.2731 6.2731 6.2954 6.2954 12.1608 12.1608 13.3491 13.3491 13.4289 13.4289 13.9496 13.9496 14.2292 14.2292 14.4712 14.4712 14.8543 14.8543 k = 0.3334-0.3072-0.6957 ( 4172 PWs) bands (ev): -31.1644 -31.1644 -14.2108 -14.2108 -14.1997 -14.1997 -13.2149 -13.2149 -13.1863 -13.1863 -12.7762 -12.7762 -12.7159 -12.7159 -12.5156 -12.5156 -12.3082 -12.3082 -11.7217 -11.7217 -11.5767 -11.5767 -11.2070 -11.2070 -10.7034 -10.7034 -10.2750 -10.2750 -10.0532 -10.0532 -0.7693 -0.7693 0.7373 0.7373 0.7870 0.7870 1.1742 1.1742 2.0001 2.0001 2.1191 2.1191 2.6224 2.6224 2.7104 2.7104 3.5318 3.5318 4.1694 4.1694 4.5254 4.5254 4.6105 4.6105 4.8625 4.8625 5.1291 5.1291 5.4807 5.4807 5.6708 5.6708 6.2761 6.2761 6.2909 6.2909 12.1653 12.1653 13.3377 13.3377 13.4443 13.4443 13.9478 13.9478 14.2228 14.2228 14.4738 14.4738 14.8353 14.8353 k = 0.3410-0.3141-0.7115 ( 4174 PWs) bands (ev): -31.1644 -31.1644 -14.2118 -14.2118 -14.1974 -14.1974 -13.2139 -13.2139 -13.1854 -13.1854 -12.7761 -12.7761 -12.7188 -12.7188 -12.5178 -12.5178 -12.3150 -12.3150 -11.7264 -11.7264 -11.5672 -11.5672 -11.1971 -11.1971 -10.7034 -10.7034 -10.2806 -10.2806 -10.0537 -10.0537 -0.7729 -0.7729 0.7397 0.7397 0.7984 0.7984 1.1657 1.1657 2.0159 2.0159 2.0997 2.0997 2.6250 2.6250 2.7247 2.7247 3.5125 3.5125 4.1902 4.1902 4.5335 4.5335 4.5962 4.5962 4.8633 4.8633 5.1044 5.1044 5.4766 5.4766 5.6861 5.6861 6.2749 6.2749 6.2885 6.2885 12.1661 12.1661 13.3227 13.3227 13.4660 13.4660 13.9465 13.9465 14.2157 14.2157 14.4773 14.4773 14.8086 14.8086 k = 0.3486-0.3211-0.7273 ( 4170 PWs) bands (ev): -31.1644 -31.1644 -14.2134 -14.2134 -14.1944 -14.1944 -13.2128 -13.2128 -13.1842 -13.1842 -12.7761 -12.7761 -12.7230 -12.7230 -12.5198 -12.5198 -12.3215 -12.3215 -11.7312 -11.7312 -11.5586 -11.5586 -11.1856 -11.1856 -10.7028 -10.7028 -10.2885 -10.2885 -10.0521 -10.0521 -0.7790 -0.7790 0.7320 0.7320 0.8151 0.8151 1.1635 1.1635 2.0304 2.0304 2.0830 2.0830 2.6247 2.6247 2.7409 2.7409 3.4948 3.4948 4.2124 4.2124 4.5265 4.5265 4.5934 4.5934 4.8656 4.8656 5.0820 5.0820 5.4724 5.4724 5.7015 5.7015 6.2691 6.2691 6.2884 6.2884 12.1633 12.1633 13.3079 13.3079 13.4904 13.4904 13.9454 13.9454 14.2079 14.2079 14.4818 14.4818 14.7814 14.7814 k = 0.3562-0.3281-0.7432 ( 4170 PWs) bands (ev): -31.1644 -31.1644 -14.2151 -14.2151 -14.1909 -14.1909 -13.2118 -13.2118 -13.1827 -13.1827 -12.7764 -12.7764 -12.7284 -12.7284 -12.5215 -12.5215 -12.3279 -12.3279 -11.7358 -11.7358 -11.5513 -11.5513 -11.1725 -11.1725 -10.7014 -10.7014 -10.2988 -10.2988 -10.0483 -10.0483 -0.7872 -0.7872 0.7157 0.7157 0.8361 0.8361 1.1670 1.1670 2.0387 2.0387 2.0736 2.0736 2.6219 2.6219 2.7583 2.7583 3.4789 3.4789 4.2354 4.2354 4.5078 4.5078 4.5975 4.5975 4.8691 4.8691 5.0628 5.0628 5.4680 5.4680 5.7172 5.7172 6.2609 6.2609 6.2886 6.2886 12.1571 12.1571 13.2946 13.2946 13.5160 13.5160 13.9445 13.9445 14.1994 14.1994 14.4873 14.4873 14.7554 14.7554 k = 0.6438-0.1089-0.6003 ( 4170 PWs) bands (ev): -31.1644 -31.1644 -14.2152 -14.2152 -14.1909 -14.1909 -13.2118 -13.2118 -13.1827 -13.1827 -12.7764 -12.7764 -12.7284 -12.7284 -12.5215 -12.5215 -12.3279 -12.3279 -11.7357 -11.7357 -11.5514 -11.5514 -11.1725 -11.1725 -10.7014 -10.7014 -10.2989 -10.2989 -10.0482 -10.0482 -0.7872 -0.7872 0.7157 0.7157 0.8362 0.8362 1.1669 1.1669 2.0386 2.0386 2.0736 2.0736 2.6219 2.6219 2.7584 2.7584 3.4789 3.4789 4.2354 4.2354 4.5078 4.5078 4.5975 4.5975 4.8691 4.8691 5.0628 5.0628 5.4680 5.4680 5.7172 5.7172 6.2609 6.2609 6.2886 6.2886 12.1571 12.1571 13.2946 13.2946 13.5160 13.5160 13.9445 13.9445 14.1994 14.1994 14.4872 14.4872 14.7554 14.7554 k = 0.6363-0.0916-0.6003 ( 4172 PWs) bands (ev): -31.1644 -31.1644 -14.2170 -14.2170 -14.1872 -14.1872 -13.2108 -13.2108 -13.1809 -13.1809 -12.7769 -12.7769 -12.7348 -12.7348 -12.5230 -12.5230 -12.3339 -12.3339 -11.7400 -11.7400 -11.5455 -11.5455 -11.1581 -11.1581 -10.6994 -10.6994 -10.3113 -10.3113 -10.0428 -10.0428 -0.7974 -0.7974 0.6932 0.6932 0.8604 0.8604 1.1750 1.1750 2.0325 2.0325 2.0796 2.0796 2.6170 2.6170 2.7764 2.7764 3.4652 3.4652 4.2591 4.2591 4.4844 4.4844 4.6010 4.6010 4.8733 4.8733 5.0481 5.0481 5.4636 5.4636 5.7329 5.7329 6.2514 6.2514 6.2883 6.2883 12.1478 12.1478 13.2833 13.2833 13.5421 13.5421 13.9437 13.9437 14.1904 14.1904 14.4937 14.4937 14.7311 14.7311 k = 0.6287-0.0744-0.6003 ( 4174 PWs) bands (ev): -31.1644 -31.1644 -14.2189 -14.2189 -14.1833 -14.1833 -13.2098 -13.2098 -13.1788 -13.1788 -12.7778 -12.7778 -12.7419 -12.7419 -12.5244 -12.5244 -12.3394 -12.3394 -11.7438 -11.7438 -11.5411 -11.5411 -11.1423 -11.1423 -10.6966 -10.6966 -10.3254 -10.3254 -10.0359 -10.0359 -0.8092 -0.8092 0.6666 0.6666 0.8870 0.8870 1.1866 1.1866 2.0187 2.0187 2.0940 2.0940 2.6102 2.6102 2.7946 2.7946 3.4541 3.4541 4.2829 4.2829 4.4590 4.4590 4.6009 4.6009 4.8776 4.8776 5.0390 5.0390 5.4590 5.4590 5.7485 5.7485 6.2410 6.2410 6.2873 6.2873 12.1356 12.1356 13.2741 13.2741 13.5684 13.5684 13.9430 13.9430 14.1810 14.1810 14.5009 14.5009 14.7086 14.7086 k = 0.6211-0.0571-0.6003 ( 4178 PWs) bands (ev): -31.1644 -31.1644 -14.2207 -14.2207 -14.1793 -14.1793 -13.2089 -13.2089 -13.1764 -13.1764 -12.7797 -12.7797 -12.7492 -12.7492 -12.5257 -12.5257 -12.3443 -12.3443 -11.7471 -11.7471 -11.5382 -11.5382 -11.1253 -11.1253 -10.6934 -10.6934 -10.3409 -10.3409 -10.0280 -10.0280 -0.8224 -0.8224 0.6374 0.6374 0.9156 0.9156 1.2007 1.2007 2.0032 2.0032 2.1104 2.1104 2.6018 2.6018 2.8125 2.8125 3.4459 3.4459 4.3062 4.3062 4.4325 4.4325 4.5963 4.5963 4.8812 4.8812 5.0364 5.0364 5.4543 5.4543 5.7639 5.7639 6.2298 6.2298 6.2856 6.2856 12.1210 12.1210 13.2669 13.2669 13.5946 13.5946 13.9422 13.9422 14.1714 14.1714 14.5088 14.5088 14.6881 14.6881 k = 0.6136-0.0398-0.6003 ( 4178 PWs) bands (ev): -31.1645 -31.1645 -14.2225 -14.2225 -14.1753 -14.1753 -13.2081 -13.2081 -13.1736 -13.1736 -12.7830 -12.7830 -12.7558 -12.7558 -12.5270 -12.5270 -12.3487 -12.3487 -11.7498 -11.7498 -11.5368 -11.5368 -11.1072 -11.1072 -10.6896 -10.6896 -10.3577 -10.3577 -10.0195 -10.0195 -0.8366 -0.8366 0.6068 0.6068 0.9458 0.9458 1.2162 1.2162 1.9871 1.9871 2.1275 2.1275 2.5921 2.5921 2.8299 2.8299 3.4409 3.4409 4.3278 4.3278 4.4062 4.4062 4.5874 4.5874 4.8837 4.8837 5.0403 5.0403 5.4496 5.4496 5.7791 5.7791 6.2180 6.2180 6.2833 6.2833 12.1044 12.1044 13.2616 13.2616 13.6206 13.6206 13.9415 13.9415 14.1616 14.1616 14.5172 14.5172 14.6693 14.6693 k = 0.6060-0.0226-0.6003 ( 4176 PWs) bands (ev): -31.1645 -31.1645 -14.2242 -14.2242 -14.1713 -14.1713 -13.2074 -13.2074 -13.1704 -13.1704 -12.7887 -12.7887 -12.7607 -12.7607 -12.5284 -12.5284 -12.3524 -12.3524 -11.7519 -11.7519 -11.5366 -11.5366 -11.0883 -11.0883 -10.6856 -10.6856 -10.3754 -10.3754 -10.0105 -10.0105 -0.8516 -0.8516 0.5757 0.5757 0.9775 0.9775 1.2325 1.2325 1.9706 1.9706 2.1447 2.1447 2.5814 2.5814 2.8465 2.8465 3.4395 3.4395 4.3420 4.3420 4.3852 4.3852 4.5749 4.5749 4.8855 4.8855 5.0498 5.0498 5.4449 5.4449 5.7938 5.7938 6.2058 6.2058 6.2805 6.2805 12.0864 12.0864 13.2579 13.2579 13.6462 13.6462 13.9408 13.9408 14.1520 14.1520 14.5259 14.5259 14.6523 14.6523 k = 0.5984-0.0053-0.6003 ( 4166 PWs) bands (ev): -31.1645 -31.1645 -14.2258 -14.2258 -14.1674 -14.1674 -13.2068 -13.2068 -13.1669 -13.1669 -12.7968 -12.7968 -12.7637 -12.7637 -12.5299 -12.5299 -12.3555 -12.3555 -11.7535 -11.7535 -11.5376 -11.5376 -11.0685 -11.0685 -10.6813 -10.6813 -10.3937 -10.3937 -10.0013 -10.0013 -0.8669 -0.8669 0.5448 0.5448 1.0103 1.0103 1.2492 1.2492 1.9535 1.9535 2.1618 2.1618 2.5698 2.5698 2.8619 2.8619 3.4418 3.4418 4.3304 4.3304 4.3874 4.3874 4.5598 4.5598 4.8873 4.8873 5.0632 5.0632 5.4402 5.4402 5.8081 5.8081 6.1932 6.1932 6.2773 6.2773 12.0674 12.0674 13.2555 13.2555 13.6713 13.6713 13.9401 13.9401 14.1425 14.1425 14.5346 14.5346 14.6371 14.6371 k = 0.5909 0.0120-0.6003 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2274 -14.2274 -14.1635 -14.1635 -13.2063 -13.2063 -13.1632 -13.1632 -12.8065 -12.8065 -12.7655 -12.7655 -12.5316 -12.5316 -12.3580 -12.3580 -11.7544 -11.7544 -11.5396 -11.5396 -11.0482 -11.0482 -10.6770 -10.6770 -10.4125 -10.4125 -9.9922 -9.9922 -0.8824 -0.8824 0.5147 0.5147 1.0442 1.0442 1.2657 1.2657 1.9358 1.9358 2.1786 2.1786 2.5578 2.5578 2.8758 2.8758 3.4481 3.4481 4.3019 4.3019 4.4033 4.4033 4.5435 4.5435 4.8898 4.8898 5.0791 5.0791 5.4356 5.4356 5.8217 5.8217 6.1804 6.1804 6.2738 6.2738 12.0478 12.0478 13.2543 13.2543 13.6956 13.6956 13.9395 13.9395 14.1332 14.1332 14.5430 14.5430 14.6238 14.6238 k = 0.5833 0.0292-0.6003 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2288 -14.2288 -14.1598 -14.1598 -13.2058 -13.2058 -13.1592 -13.1592 -12.8171 -12.8171 -12.7664 -12.7664 -12.5333 -12.5333 -12.3599 -12.3599 -11.7548 -11.7548 -11.5424 -11.5424 -11.0274 -11.0274 -10.6728 -10.6728 -10.4315 -10.4315 -9.9833 -9.9833 -0.8978 -0.8978 0.4859 0.4859 1.0787 1.0787 1.2817 1.2817 1.9173 1.9173 2.1950 2.1950 2.5455 2.5455 2.8880 2.8880 3.4586 3.4586 4.2691 4.2691 4.4193 4.4193 4.5273 4.5273 4.8933 4.8933 5.0962 5.0962 5.4312 5.4312 5.8346 5.8346 6.1675 6.1675 6.2700 6.2700 12.0281 12.0281 13.2540 13.2540 13.7189 13.7189 13.9389 13.9389 14.1242 14.1242 14.5505 14.5505 14.6126 14.6126 k = 0.5757 0.0465-0.6003 ( 4168 PWs) bands (ev): -31.1645 -31.1645 -14.2302 -14.2302 -14.1562 -14.1562 -13.2054 -13.2054 -13.1550 -13.1550 -12.8282 -12.8282 -12.7670 -12.7670 -12.5353 -12.5353 -12.3613 -12.3613 -11.7548 -11.7548 -11.5459 -11.5459 -11.0064 -11.0064 -10.6689 -10.6689 -10.4505 -10.4505 -9.9748 -9.9748 -0.9127 -0.9127 0.4587 0.4587 1.1137 1.1137 1.2969 1.2969 1.8978 1.8978 2.2107 2.2107 2.5333 2.5333 2.8986 2.8986 3.4733 3.4733 4.2339 4.2339 4.4322 4.4322 4.5133 4.5133 4.8982 4.8982 5.1136 5.1136 5.4269 5.4269 5.8467 5.8467 6.1549 6.1549 6.2661 6.2661 12.0088 12.0088 13.2543 13.2543 13.7411 13.7411 13.9385 13.9385 14.1156 14.1156 14.5560 14.5560 14.6045 14.6045 k = 0.5681 0.0638-0.6003 ( 4162 PWs) bands (ev): -31.1645 -31.1645 -14.2314 -14.2314 -14.1528 -14.1528 -13.2051 -13.2051 -13.1507 -13.1507 -12.8392 -12.8392 -12.7673 -12.7673 -12.5372 -12.5372 -12.3623 -12.3623 -11.7543 -11.7543 -11.5498 -11.5498 -10.9853 -10.9853 -10.6654 -10.6654 -10.4693 -10.4693 -9.9668 -9.9668 -0.9269 -0.9269 0.4333 0.4333 1.1488 1.1488 1.3113 1.3113 1.8776 1.8776 2.2258 2.2258 2.5215 2.5215 2.9073 2.9073 3.4921 3.4921 4.1968 4.1968 4.4389 4.4389 4.5044 4.5044 4.9043 4.9043 5.1305 5.1305 5.4229 5.4229 5.8579 5.8579 6.1426 6.1426 6.2623 6.2623 11.9902 11.9902 13.2551 13.2551 13.7621 13.7621 13.9384 13.9384 14.1073 14.1073 14.5581 14.5581 14.6007 14.6007 k = 0.5606 0.0811-0.6003 ( 4162 PWs) bands (ev): -31.1645 -31.1645 -14.2325 -14.2325 -14.1497 -14.1497 -13.2048 -13.2048 -13.1464 -13.1464 -12.8499 -12.8499 -12.7675 -12.7675 -12.5391 -12.5391 -12.3629 -12.3629 -11.7535 -11.7535 -11.5540 -11.5540 -10.9643 -10.9643 -10.6627 -10.6627 -10.4875 -10.4875 -9.9593 -9.9593 -0.9403 -0.9403 0.4101 0.4101 1.1838 1.1838 1.3245 1.3245 1.8564 1.8564 2.2400 2.2400 2.5101 2.5101 2.9143 2.9143 3.5148 3.5148 4.1582 4.1582 4.4373 4.4373 4.5030 4.5030 4.9114 4.9114 5.1465 5.1465 5.4191 5.4191 5.8682 5.8682 6.1308 6.1308 6.2585 6.2585 11.9726 11.9726 13.2562 13.2562 13.7814 13.7814 13.9386 13.9386 14.0994 14.0994 14.5562 14.5562 14.6017 14.6017 k = 0.5530 0.0983-0.6003 ( 4156 PWs) bands (ev): -31.1645 -31.1645 -14.2335 -14.2335 -14.1469 -14.1469 -13.2045 -13.2045 -13.1420 -13.1420 -12.8602 -12.8602 -12.7675 -12.7675 -12.5410 -12.5410 -12.3632 -12.3632 -11.7525 -11.7525 -11.5583 -11.5583 -10.9436 -10.9436 -10.6610 -10.6610 -10.5047 -10.5047 -9.9525 -9.9525 -0.9525 -0.9525 0.3892 0.3892 1.2182 1.2182 1.3364 1.3364 1.8346 1.8346 2.2532 2.2532 2.4995 2.4995 2.9197 2.9197 3.5411 3.5411 4.1182 4.1182 4.4296 4.4296 4.5072 4.5072 4.9192 4.9192 5.1611 5.1611 5.4157 5.4157 5.8774 5.8774 6.1198 6.1198 6.2549 6.2549 11.9564 11.9564 13.2575 13.2575 13.7990 13.7990 13.9394 13.9394 14.0918 14.0918 14.5516 14.5516 14.6059 14.6059 k = 0.5454 0.1156-0.6003 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2344 -14.2344 -14.1444 -14.1444 -13.2043 -13.2043 -13.1379 -13.1379 -12.8697 -12.8697 -12.7676 -12.7676 -12.5427 -12.5427 -12.3633 -12.3633 -11.7512 -11.7512 -11.5624 -11.5624 -10.9236 -10.9236 -10.6604 -10.6604 -10.5206 -10.5206 -9.9465 -9.9465 -0.9635 -0.9635 0.3708 0.3708 1.2514 1.2514 1.3470 1.3470 1.8126 1.8126 2.2653 2.2653 2.4897 2.4897 2.9238 2.9238 3.5706 3.5706 4.0771 4.0771 4.4196 4.4196 4.5136 4.5136 4.9273 4.9273 5.1741 5.1741 5.4127 5.4127 5.8855 5.8855 6.1097 6.1097 6.2516 6.2516 11.9419 11.9419 13.2588 13.2588 13.8145 13.8145 13.9409 13.9409 14.0846 14.0846 14.5462 14.5462 14.6113 14.6113 k = 0.5379 0.1329-0.6003 ( 4160 PWs) bands (ev): -31.1645 -31.1645 -14.2352 -14.2352 -14.1422 -14.1422 -13.2041 -13.2041 -13.1340 -13.1340 -12.8783 -12.8783 -12.7676 -12.7676 -12.5443 -12.5443 -12.3633 -12.3633 -11.7500 -11.7500 -11.5663 -11.5663 -10.9046 -10.9046 -10.6613 -10.6613 -10.5346 -10.5346 -9.9413 -9.9413 -0.9731 -0.9731 0.3550 0.3550 1.2829 1.2829 1.3561 1.3561 1.7907 1.7907 2.2760 2.2760 2.4810 2.4810 2.9268 2.9268 3.6028 3.6028 4.0353 4.0353 4.4097 4.4097 4.5199 4.5199 4.9353 4.9353 5.1852 5.1852 5.4101 5.4101 5.8924 5.8924 6.1007 6.1007 6.2487 6.2487 11.9292 11.9292 13.2600 13.2600 13.8277 13.8277 13.9429 13.9429 14.0778 14.0778 14.5409 14.5409 14.6167 14.6167 k = 0.5303 0.1501-0.6003 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2358 -14.2358 -14.1403 -14.1403 -13.2040 -13.2040 -13.1305 -13.1305 -12.8857 -12.8857 -12.7676 -12.7676 -12.5457 -12.5457 -12.3631 -12.3631 -11.7487 -11.7487 -11.5697 -11.5697 -10.8871 -10.8871 -10.6637 -10.6637 -10.5463 -10.5463 -9.9370 -9.9370 -0.9811 -0.9811 0.3419 0.3419 1.3117 1.3117 1.3637 1.3637 1.7698 1.7698 2.2853 2.2853 2.4734 2.4734 2.9289 2.9289 3.6372 3.6372 3.9933 3.9933 4.4010 4.4010 4.5254 4.5254 4.9426 4.9426 5.1944 5.1944 5.4080 5.4080 5.8981 5.8981 6.0931 6.0931 6.2461 6.2461 11.9185 11.9185 13.2612 13.2612 13.8384 13.8384 13.9456 13.9456 14.0717 14.0717 14.5363 14.5363 14.6217 14.6217 k = 0.5227 0.1674-0.6003 ( 4154 PWs) bands (ev): -31.1645 -31.1645 -14.2363 -14.2363 -14.1389 -14.1389 -13.2039 -13.2039 -13.1276 -13.1276 -12.8917 -12.8917 -12.7676 -12.7676 -12.5468 -12.5468 -12.3630 -12.3630 -11.7476 -11.7476 -11.5726 -11.5726 -10.8718 -10.8718 -10.6673 -10.6673 -10.5553 -10.5553 -9.9336 -9.9336 -0.9874 -0.9874 0.3317 0.3317 1.3367 1.3367 1.3697 1.3697 1.7510 1.7510 2.2929 2.2929 2.4673 2.4673 2.9302 2.9302 3.6728 3.6728 3.9519 3.9519 4.3939 4.3939 4.5297 4.5297 4.9488 4.9488 5.2015 5.2015 5.4063 5.4063 5.9026 5.9026 6.0870 6.0870 6.2441 6.2441 11.9101 11.9101 13.2621 13.2621 13.8465 13.8465 13.9486 13.9486 14.0663 14.0663 14.5325 14.5325 14.6258 14.6258 k = 0.5151 0.1847-0.6003 ( 4156 PWs) bands (ev): -31.1645 -31.1645 -14.2366 -14.2366 -14.1379 -14.1379 -13.2038 -13.2038 -13.1253 -13.1253 -12.8962 -12.8962 -12.7675 -12.7675 -12.5476 -12.5476 -12.3629 -12.3629 -11.7468 -11.7468 -11.5747 -11.5747 -10.8596 -10.8596 -10.6712 -10.6712 -10.5615 -10.5615 -9.9311 -9.9311 -0.9920 -0.9920 0.3243 0.3243 1.3563 1.3563 1.3742 1.3742 1.7357 1.7357 2.2985 2.2985 2.4627 2.4627 2.9311 2.9311 3.7081 3.7081 3.9125 3.9125 4.3887 4.3887 4.5328 4.5328 4.9536 4.9536 5.2066 5.2066 5.4051 5.4051 5.9059 5.9059 6.0826 6.0826 6.2426 6.2426 11.9040 11.9040 13.2628 13.2628 13.8521 13.8521 13.9514 13.9514 14.0620 14.0620 14.5298 14.5298 14.6289 14.6289 k = 0.5076 0.2019-0.6003 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2368 -14.2368 -14.1372 -14.1372 -13.2038 -13.2038 -13.1240 -13.1240 -12.8989 -12.8989 -12.7675 -12.7675 -12.5481 -12.5481 -12.3628 -12.3628 -11.7462 -11.7462 -11.5761 -11.5761 -10.8517 -10.8517 -10.6744 -10.6744 -10.5651 -10.5651 -9.9296 -9.9296 -0.9947 -0.9947 0.3199 0.3199 1.3686 1.3686 1.3773 1.3773 1.7256 1.7256 2.3020 2.3020 2.4598 2.4598 2.9315 2.9315 3.7389 3.7389 3.8793 3.8793 4.3855 4.3855 4.5347 4.5347 4.9566 4.9566 5.2097 5.2097 5.4044 5.4044 5.9078 5.9078 6.0798 6.0798 6.2417 6.2417 11.9003 11.9003 13.2632 13.2632 13.8554 13.8554 13.9534 13.9534 14.0593 14.0593 14.5281 14.5281 14.6308 14.6308 k = 0.5000 0.2192-0.6003 ( 4142 PWs) bands (ev): -31.1645 -31.1645 -14.2369 -14.2369 -14.1370 -14.1370 -13.2038 -13.2038 -13.1235 -13.1235 -12.8999 -12.8999 -12.7675 -12.7675 -12.5483 -12.5483 -12.3627 -12.3627 -11.7460 -11.7460 -11.5765 -11.5765 -10.8489 -10.8489 -10.6756 -10.6756 -10.5662 -10.5662 -9.9291 -9.9291 -0.9957 -0.9957 0.3184 0.3184 1.3724 1.3724 1.3788 1.3788 1.7220 1.7220 2.3032 2.3032 2.4589 2.4589 2.9317 2.9317 3.7533 3.7533 3.8640 3.8640 4.3845 4.3845 4.5353 4.5353 4.9576 4.9576 5.2107 5.2107 5.4042 5.4042 5.9085 5.9085 6.0789 6.0789 6.2414 6.2414 11.8991 11.8991 13.2634 13.2634 13.8565 13.8565 13.9542 13.9542 14.0583 14.0583 14.5276 14.5276 14.6315 14.6315 k = 0.5000 0.2192-0.6003 ( 4142 PWs) bands (ev): -31.1645 -31.1645 -14.2369 -14.2369 -14.1370 -14.1370 -13.2038 -13.2038 -13.1235 -13.1235 -12.8999 -12.8999 -12.7675 -12.7675 -12.5483 -12.5483 -12.3627 -12.3627 -11.7460 -11.7460 -11.5765 -11.5765 -10.8489 -10.8489 -10.6756 -10.6756 -10.5662 -10.5662 -9.9291 -9.9291 -0.9957 -0.9957 0.3184 0.3184 1.3724 1.3724 1.3788 1.3788 1.7220 1.7220 2.3032 2.3032 2.4589 2.4589 2.9317 2.9317 3.7533 3.7533 3.8640 3.8640 4.3845 4.3845 4.5353 4.5353 4.9576 4.9576 5.2107 5.2107 5.4042 5.4042 5.9085 5.9085 6.0789 6.0789 6.2414 6.2414 11.8991 11.8991 13.2634 13.2634 13.8565 13.8565 13.9542 13.9542 14.0583 14.0583 14.5276 14.5276 14.6315 14.6315 k = 0.5120 0.2245-0.5884 ( 4144 PWs) bands (ev): -31.1645 -31.1645 -14.2369 -14.2369 -14.1370 -14.1370 -13.2039 -13.2039 -13.1236 -13.1236 -12.8993 -12.8993 -12.7675 -12.7675 -12.5483 -12.5483 -12.3631 -12.3631 -11.7472 -11.7472 -11.5748 -11.5748 -10.8509 -10.8509 -10.6746 -10.6746 -10.5659 -10.5659 -9.9288 -9.9288 -0.9959 -0.9959 0.3183 0.3183 1.3610 1.3610 1.3906 1.3906 1.7217 1.7217 2.3030 2.3030 2.4593 2.4593 2.9310 2.9310 3.7534 3.7534 3.8638 3.8638 4.3829 4.3829 4.5381 4.5381 4.9578 4.9578 5.2112 5.2112 5.4045 5.4045 5.9079 5.9079 6.0778 6.0778 6.2421 6.2421 11.8992 11.8992 13.2637 13.2637 13.8527 13.8527 13.9539 13.9539 14.0617 14.0617 14.5179 14.5179 14.6424 14.6424 k = 0.5240 0.2297-0.5765 ( 4146 PWs) bands (ev): -31.1645 -31.1645 -14.2370 -14.2370 -14.1371 -14.1371 -13.2044 -13.2044 -13.1237 -13.1237 -12.8975 -12.8975 -12.7675 -12.7675 -12.5485 -12.5485 -12.3640 -12.3640 -11.7504 -11.7504 -11.5697 -11.5697 -10.8567 -10.8567 -10.6721 -10.6721 -10.5649 -10.5649 -9.9280 -9.9280 -0.9966 -0.9966 0.3180 0.3180 1.3472 1.3472 1.4053 1.4053 1.7208 1.7208 2.3023 2.3023 2.4605 2.4605 2.9289 2.9289 3.7534 3.7534 3.8630 3.8630 4.3784 4.3784 4.5461 4.5461 4.9582 4.9582 5.2128 5.2128 5.4054 5.4054 5.9063 5.9063 6.0746 6.0746 6.2441 6.2441 11.8997 11.8997 13.2648 13.2648 13.8422 13.8422 13.9531 13.9531 14.0710 14.0710 14.4961 14.4961 14.6678 14.6678 k = 0.5360 0.2350-0.5646 ( 4146 PWs) bands (ev): -31.1645 -31.1645 -14.2371 -14.2371 -14.1373 -14.1373 -13.2051 -13.2051 -13.1240 -13.1240 -12.8945 -12.8945 -12.7676 -12.7676 -12.5488 -12.5488 -12.3656 -12.3656 -11.7555 -11.7555 -11.5617 -11.5617 -10.8659 -10.8659 -10.6686 -10.6686 -10.5628 -10.5628 -9.9265 -9.9265 -0.9978 -0.9978 0.3175 0.3175 1.3337 1.3337 1.4203 1.4203 1.7192 1.7192 2.3012 2.3012 2.4624 2.4624 2.9254 2.9254 3.7536 3.7536 3.8618 3.8618 4.3720 4.3720 4.5583 4.5583 4.9589 4.9589 5.2153 5.2153 5.4070 5.4070 5.9036 5.9036 6.0695 6.0695 6.2473 6.2473 11.9005 11.9005 13.2665 13.2665 13.8266 13.8266 13.9516 13.9516 14.0849 14.0849 14.4705 14.4705 14.6993 14.6993 k = 0.5479 0.2402-0.5527 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2373 -14.2373 -14.1375 -14.1375 -13.2061 -13.2061 -13.1245 -13.1245 -12.8904 -12.8904 -12.7676 -12.7676 -12.5494 -12.5494 -12.3676 -12.3676 -11.7620 -11.7620 -11.5512 -11.5512 -10.8777 -10.8777 -10.6652 -10.6652 -10.5595 -10.5595 -9.9246 -9.9246 -0.9994 -0.9994 0.3168 0.3168 1.3207 1.3207 1.4354 1.4354 1.7170 1.7170 2.2999 2.2999 2.4650 2.4650 2.9206 2.9206 3.7541 3.7541 3.8600 3.8600 4.3648 4.3648 4.5736 4.5736 4.9599 4.9599 5.2188 5.2188 5.4092 5.4092 5.8998 5.8998 6.0629 6.0629 6.2512 6.2512 11.9016 11.9016 13.2688 13.2688 13.8076 13.8076 13.9493 13.9493 14.1017 14.1017 14.4445 14.4445 14.7333 14.7333 k = 0.5599 0.2455-0.5408 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2375 -14.2375 -14.1377 -14.1377 -13.2073 -13.2073 -13.1250 -13.1250 -12.8853 -12.8853 -12.7676 -12.7676 -12.5501 -12.5501 -12.3700 -12.3700 -11.7695 -11.7695 -11.5386 -11.5386 -10.8915 -10.8915 -10.6627 -10.6627 -10.5545 -10.5545 -9.9221 -9.9221 -1.0016 -1.0016 0.3159 0.3159 1.3081 1.3081 1.4505 1.4505 1.7142 1.7142 2.2985 2.2985 2.4680 2.4680 2.9145 2.9145 3.7548 3.7548 3.8577 3.8577 4.3576 4.3576 4.5909 4.5909 4.9612 4.9612 5.2232 5.2232 5.4120 5.4120 5.8949 5.8949 6.0552 6.0552 6.2557 6.2557 11.9029 11.9029 13.2716 13.2716 13.7864 13.7864 13.9463 13.9463 14.1203 14.1203 14.4196 14.4196 14.7684 14.7684 k = 0.5719 0.2507-0.5289 ( 4151 PWs) bands (ev): -31.1645 -31.1645 -14.2378 -14.2378 -14.1380 -14.1380 -13.2087 -13.2087 -13.1256 -13.1256 -12.8792 -12.8792 -12.7676 -12.7676 -12.5511 -12.5511 -12.3726 -12.3726 -11.7778 -11.7778 -11.5244 -11.5244 -10.9070 -10.9070 -10.6617 -10.6617 -10.5478 -10.5478 -9.9193 -9.9193 -1.0041 -1.0041 0.3148 0.3148 1.2960 1.2960 1.4655 1.4655 1.7108 1.7108 2.2972 2.2972 2.4714 2.4714 2.9070 2.9070 3.7561 3.7561 3.8549 3.8549 4.3510 4.3510 4.6097 4.6097 4.9628 4.9628 5.2285 5.2285 5.4153 5.4153 5.8889 5.8889 6.0467 6.0467 6.2602 6.2602 11.9043 11.9043 13.2747 13.2747 13.7641 13.7641 13.9427 13.9427 14.1396 14.1396 14.3963 14.3963 14.8036 14.8036 k = 0.5839 0.2560-0.5170 ( 4153 PWs) bands (ev): -31.1645 -31.1645 -14.2380 -14.2380 -14.1384 -14.1384 -13.2103 -13.2103 -13.1263 -13.1263 -12.8723 -12.8723 -12.7675 -12.7675 -12.5525 -12.5525 -12.3753 -12.3753 -11.7866 -11.7866 -11.5088 -11.5088 -10.9236 -10.9236 -10.6624 -10.6624 -10.5392 -10.5392 -9.9160 -9.9160 -1.0072 -1.0072 0.3134 0.3134 1.2845 1.2845 1.4802 1.4802 1.7067 1.7067 2.2962 2.2962 2.4750 2.4750 2.8983 2.8983 3.7580 3.7580 3.8517 3.8517 4.3454 4.3454 4.6293 4.6293 4.9647 4.9647 5.2345 5.2345 5.4193 5.4193 5.8820 5.8820 6.0378 6.0378 6.2648 6.2648 11.9057 11.9057 13.2780 13.2780 13.7413 13.7413 13.9385 13.9385 14.1589 14.1589 14.3751 14.3751 14.8381 14.8381 k = 0.5959 0.2613-0.5051 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2383 -14.2383 -14.1388 -14.1388 -13.2120 -13.2120 -13.1271 -13.1271 -12.8646 -12.8646 -12.7674 -12.7674 -12.5543 -12.5543 -12.3778 -12.3778 -11.7958 -11.7958 -11.4921 -11.4921 -10.9412 -10.9412 -10.6648 -10.6648 -10.5290 -10.5290 -9.9125 -9.9125 -1.0107 -1.0107 0.3119 0.3119 1.2733 1.2733 1.4946 1.4946 1.7021 1.7021 2.2955 2.2955 2.4788 2.4788 2.8885 2.8885 3.7607 3.7607 3.8480 3.8480 4.3410 4.3410 4.6494 4.6494 4.9670 4.9670 5.2412 5.2412 5.4238 5.4238 5.8740 5.8740 6.0287 6.0287 6.2690 6.2690 11.9071 11.9071 13.2814 13.2814 13.7188 13.7188 13.9338 13.9338 14.1775 14.1775 14.3567 14.3567 14.8712 14.8712 k = 0.6079 0.2665-0.4932 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2387 -14.2387 -14.1392 -14.1392 -13.2137 -13.2137 -13.1279 -13.1279 -12.8564 -12.8564 -12.7673 -12.7673 -12.5565 -12.5565 -12.3800 -12.3800 -11.8052 -11.8052 -11.4747 -11.4747 -10.9594 -10.9594 -10.6686 -10.6686 -10.5176 -10.5176 -9.9086 -9.9086 -1.0146 -1.0146 0.3101 0.3101 1.2627 1.2627 1.5083 1.5083 1.6969 1.6969 2.2953 2.2953 2.4826 2.4826 2.8777 2.8777 3.7643 3.7643 3.8439 3.8439 4.3379 4.3379 4.6697 4.6697 4.9696 4.9696 5.2484 5.2484 5.4289 5.4289 5.8650 5.8650 6.0198 6.0198 6.2727 6.2727 11.9083 11.9083 13.2845 13.2845 13.6970 13.6970 13.9285 13.9285 14.1944 14.1944 14.3417 14.3417 14.9022 14.9022 k = 0.6199 0.2718-0.4813 ( 4149 PWs) bands (ev): -31.1645 -31.1645 -14.2390 -14.2390 -14.1397 -14.1397 -13.2155 -13.2155 -13.1288 -13.1288 -12.8477 -12.8477 -12.7670 -12.7670 -12.5593 -12.5593 -12.3818 -12.3818 -11.8148 -11.8148 -11.4568 -11.4568 -10.9780 -10.9780 -10.6736 -10.6736 -10.5053 -10.5053 -9.9046 -9.9046 -1.0190 -1.0190 0.3081 0.3081 1.2525 1.2525 1.5214 1.5214 1.6911 1.6911 2.2957 2.2957 2.4864 2.4864 2.8660 2.8660 3.7688 3.7688 3.8396 3.8396 4.3362 4.3362 4.6899 4.6899 4.9725 4.9725 5.2562 5.2562 5.4344 5.4344 5.8551 5.8551 6.0112 6.0112 6.2759 6.2759 11.9092 11.9092 13.2870 13.2870 13.6765 13.6765 13.9229 13.9229 14.2083 14.2083 14.3312 14.3312 14.9301 14.9301 k = 0.6319 0.2770-0.4694 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2393 -14.2393 -14.1402 -14.1402 -13.2173 -13.2173 -13.1298 -13.1298 -12.8388 -12.8388 -12.7666 -12.7666 -12.5626 -12.5626 -12.3830 -12.3830 -11.8246 -11.8246 -11.4386 -11.4386 -10.9968 -10.9968 -10.6794 -10.6794 -10.4925 -10.4925 -9.9005 -9.9005 -1.0238 -1.0238 0.3059 0.3059 1.2427 1.2427 1.5337 1.5337 1.6847 1.6847 2.2967 2.2967 2.4902 2.4902 2.8536 2.8536 3.7744 3.7744 3.8351 3.8351 4.3359 4.3359 4.7098 4.7098 4.9758 4.9758 5.2643 5.2643 5.4402 5.4402 5.8443 5.8443 6.0032 6.0032 6.2784 6.2784 11.9096 11.9096 13.2887 13.2887 13.6579 13.6579 13.9171 13.9171 14.2175 14.2175 14.3268 14.3268 14.9541 14.9541 k = 0.6438 0.2823-0.4575 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2396 -14.2396 -14.1407 -14.1407 -13.2191 -13.2191 -13.1308 -13.1308 -12.8298 -12.8298 -12.7660 -12.7660 -12.5664 -12.5664 -12.3835 -12.3835 -11.8345 -11.8345 -11.4203 -11.4203 -11.0157 -11.0157 -10.6858 -10.6858 -10.4792 -10.4792 -9.8962 -9.8962 -1.0290 -1.0290 0.3035 0.3035 1.2333 1.2333 1.5449 1.5449 1.6779 1.6779 2.2983 2.2983 2.4940 2.4940 2.8409 2.8409 3.7809 3.7809 3.8306 3.8306 4.3370 4.3370 4.7293 4.7293 4.9794 4.9794 5.2727 5.2727 5.4464 5.4464 5.8327 5.8327 5.9959 5.9959 6.2801 6.2801 11.9095 11.9095 13.2893 13.2893 13.6415 13.6415 13.9110 13.9110 14.2206 14.2206 14.3293 14.3293 14.9735 14.9735 k = 0.6438 0.2823-0.4575 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2396 -14.2396 -14.1407 -14.1407 -13.2191 -13.2191 -13.1308 -13.1308 -12.8298 -12.8298 -12.7660 -12.7660 -12.5664 -12.5664 -12.3835 -12.3835 -11.8345 -11.8345 -11.4203 -11.4203 -11.0157 -11.0157 -10.6858 -10.6858 -10.4792 -10.4792 -9.8962 -9.8962 -1.0290 -1.0290 0.3035 0.3035 1.2333 1.2333 1.5449 1.5449 1.6779 1.6779 2.2983 2.2983 2.4940 2.4940 2.8409 2.8409 3.7809 3.7809 3.8306 3.8306 4.3370 4.3370 4.7293 4.7293 4.9794 4.9794 5.2727 5.2727 5.4464 5.4464 5.8327 5.8327 5.9959 5.9959 6.2801 6.2801 11.9095 11.9095 13.2893 13.2893 13.6415 13.6415 13.9110 13.9110 14.2206 14.2206 14.3293 14.3293 14.9735 14.9735 k = 0.6395 0.2804-0.4393 ( 4139 PWs) bands (ev): -31.1646 -31.1646 -14.2381 -14.2381 -14.1407 -14.1407 -13.2184 -13.2184 -13.1307 -13.1307 -12.8306 -12.8306 -12.7658 -12.7658 -12.5743 -12.5743 -12.3865 -12.3865 -11.8380 -11.8380 -11.3974 -11.3974 -11.0488 -11.0488 -10.6826 -10.6826 -10.4524 -10.4524 -9.8977 -9.8977 -1.0481 -1.0481 0.3120 0.3120 1.2023 1.2023 1.5655 1.5655 1.6652 1.6652 2.3074 2.3074 2.4972 2.4972 2.8289 2.8289 3.7701 3.7701 3.8505 3.8505 4.3601 4.3601 4.7423 4.7423 4.9874 4.9874 5.2761 5.2761 5.4526 5.4526 5.8264 5.8264 5.9820 5.9820 6.2687 6.2687 11.8910 11.8910 13.3095 13.3095 13.6219 13.6219 13.9042 13.9042 14.2303 14.2303 14.3321 14.3321 14.9970 14.9970 k = 0.6351 0.2785-0.4211 ( 4136 PWs) bands (ev): -31.1646 -31.1646 -14.2363 -14.2363 -14.1407 -14.1407 -13.2175 -13.2175 -13.1308 -13.1308 -12.8327 -12.8327 -12.7656 -12.7656 -12.5822 -12.5822 -12.3883 -12.3883 -11.8403 -11.8403 -11.3779 -11.3779 -11.0789 -11.0789 -10.6801 -10.6801 -10.4251 -10.4251 -9.8987 -9.8987 -1.0694 -1.0694 0.3199 0.3199 1.1719 1.1719 1.5833 1.5833 1.6506 1.6506 2.3171 2.3171 2.4994 2.4994 2.8192 2.8192 3.7597 3.7597 3.8727 3.8727 4.3857 4.3857 4.7564 4.7564 4.9964 4.9964 5.2810 5.2810 5.4596 5.4596 5.8190 5.8190 5.9677 5.9677 6.2550 6.2550 11.8687 11.8687 13.3301 13.3301 13.6041 13.6041 13.8973 13.8973 14.2403 14.2403 14.3353 14.3353 15.0195 15.0195 k = 0.6308 0.2765-0.4029 ( 4138 PWs) bands (ev): -31.1646 -31.1646 -14.2343 -14.2343 -14.1407 -14.1407 -13.2164 -13.2164 -13.1309 -13.1309 -12.8365 -12.8365 -12.7656 -12.7656 -12.5897 -12.5897 -12.3890 -12.3890 -11.8415 -11.8415 -11.3638 -11.3638 -11.1041 -11.1041 -10.6781 -10.6781 -10.3973 -10.3973 -9.8994 -9.8994 -1.0927 -1.0927 0.3268 0.3268 1.1426 1.1426 1.5970 1.5970 1.6360 1.6360 2.3264 2.3264 2.5007 2.5007 2.8124 2.8124 3.7505 3.7505 3.8965 3.8965 4.4138 4.4138 4.7713 4.7713 5.0065 5.0065 5.2871 5.2871 5.4674 5.4674 5.8101 5.8101 5.9531 5.9531 6.2391 6.2391 11.8426 11.8426 13.3509 13.3509 13.5883 13.5883 13.8905 13.8905 14.2503 14.2503 14.3387 14.3387 15.0411 15.0411 k = 0.6264 0.2746-0.3847 ( 4136 PWs) bands (ev): -31.1646 -31.1646 -14.2320 -14.2320 -14.1408 -14.1408 -13.2151 -13.2151 -13.1311 -13.1311 -12.8421 -12.8421 -12.7656 -12.7656 -12.5962 -12.5962 -12.3887 -12.3887 -11.8418 -11.8418 -11.3579 -11.3579 -11.1216 -11.1216 -10.6768 -10.6768 -10.3693 -10.3693 -9.8997 -9.8997 -1.1177 -1.1177 0.3324 0.3324 1.1145 1.1145 1.5980 1.5980 1.6307 1.6307 2.3342 2.3342 2.5007 2.5007 2.8091 2.8091 3.7430 3.7430 3.9213 3.9213 4.4441 4.4441 4.7870 4.7870 5.0176 5.0176 5.2944 5.2944 5.4759 5.4759 5.7997 5.7997 5.9386 5.9386 6.2212 6.2212 11.8133 11.8133 13.3713 13.3713 13.5746 13.5746 13.8838 13.8838 14.2598 14.2598 14.3422 14.3422 15.0624 15.0624 k = 0.6221 0.2727-0.3665 ( 4137 PWs) bands (ev): -31.1646 -31.1646 -14.2295 -14.2295 -14.1409 -14.1409 -13.2137 -13.2137 -13.1314 -13.1314 -12.8497 -12.8497 -12.7658 -12.7658 -12.6016 -12.6016 -12.3873 -12.3873 -11.8411 -11.8411 -11.3624 -11.3624 -11.1292 -11.1292 -10.6761 -10.6761 -10.3412 -10.3412 -9.8995 -9.8995 -1.1441 -1.1441 0.3363 0.3363 1.0880 1.0880 1.5818 1.5818 1.6398 1.6398 2.3398 2.3398 2.4996 2.4996 2.8093 2.8093 3.7376 3.7376 3.9466 3.9466 4.4763 4.4763 4.8035 4.8035 5.0299 5.0299 5.3028 5.3028 5.4850 5.4850 5.7878 5.7878 5.9247 5.9247 6.2016 6.2016 11.7809 11.7809 13.3908 13.3908 13.5635 13.5635 13.8771 13.8771 14.2685 14.2685 14.3459 14.3459 15.0835 15.0835 k = 0.6177 0.2708-0.3483 ( 4140 PWs) bands (ev): -31.1647 -31.1647 -14.2268 -14.2268 -14.1410 -14.1410 -13.2121 -13.2121 -13.1317 -13.1317 -12.8592 -12.8592 -12.7660 -12.7660 -12.6054 -12.6054 -12.3851 -12.3851 -11.8395 -11.8395 -11.3775 -11.3775 -11.1267 -11.1267 -10.6760 -10.6760 -10.3131 -10.3131 -9.8989 -9.8989 -1.1717 -1.1717 0.3382 0.3382 1.0634 1.0634 1.5596 1.5596 1.6527 1.6527 2.3428 2.3428 2.4972 2.4972 2.8129 2.8129 3.7347 3.7347 3.9720 3.9720 4.5102 4.5102 4.8207 4.8207 5.0432 5.0432 5.3122 5.3122 5.4945 5.4945 5.7743 5.7743 5.9113 5.9113 6.1803 6.1803 11.7458 11.7458 13.4085 13.4085 13.5552 13.5552 13.8705 13.8705 14.2758 14.2758 14.3497 14.3497 15.1048 15.1048 k = 0.6133 0.2689-0.3301 ( 4140 PWs) bands (ev): -31.1647 -31.1647 -14.2240 -14.2240 -14.1412 -14.1412 -13.2103 -13.2103 -13.1322 -13.1322 -12.8706 -12.8706 -12.7663 -12.7663 -12.6076 -12.6076 -12.3821 -12.3821 -11.8373 -11.8373 -11.4010 -11.4010 -11.1163 -11.1163 -10.6765 -10.6765 -10.2850 -10.2850 -9.8978 -9.8978 -1.2003 -1.2003 0.3377 0.3377 1.0411 1.0411 1.5350 1.5350 1.6663 1.6663 2.3430 2.3430 2.4936 2.4936 2.8194 2.8194 3.7346 3.7346 3.9973 3.9973 4.5454 4.5454 4.8386 4.8386 5.0578 5.0578 5.3225 5.3225 5.5040 5.5040 5.7596 5.7596 5.8985 5.8985 6.1576 6.1576 11.7085 11.7085 13.4235 13.4235 13.5506 13.5506 13.8641 13.8641 14.2814 14.2814 14.3534 14.3534 15.1266 15.1266 k = 0.6090 0.2670-0.3119 ( 4144 PWs) bands (ev): -31.1647 -31.1647 -14.2209 -14.2209 -14.1414 -14.1414 -13.2084 -13.2084 -13.1327 -13.1327 -12.8837 -12.8837 -12.7666 -12.7666 -12.6083 -12.6083 -12.3785 -12.3785 -11.8343 -11.8343 -11.4301 -11.4301 -11.1008 -11.1008 -10.6777 -10.6777 -10.2570 -10.2570 -9.8962 -9.8962 -1.2296 -1.2296 0.3348 0.3348 1.0212 1.0212 1.5088 1.5088 1.6803 1.6803 2.3405 2.3405 2.4893 2.4893 2.8277 2.8277 3.7377 3.7377 4.0220 4.0220 4.5817 4.5817 4.8573 4.8573 5.0735 5.0735 5.3335 5.3335 5.5131 5.5131 5.7444 5.7444 5.8863 5.8863 6.1340 6.1340 11.6692 11.6692 13.4345 13.4345 13.5504 13.5504 13.8580 13.8580 14.2850 14.2850 14.3571 14.3571 15.1491 15.1491 k = 0.6046 0.2651-0.2938 ( 4142 PWs) bands (ev): -31.1647 -31.1647 -14.2177 -14.2177 -14.1417 -14.1417 -13.2063 -13.2063 -13.1333 -13.1333 -12.8982 -12.8982 -12.7669 -12.7669 -12.6074 -12.6074 -12.3743 -12.3743 -11.8307 -11.8307 -11.4626 -11.4626 -11.0824 -11.0824 -10.6795 -10.6795 -10.2293 -10.2293 -9.8942 -9.8942 -1.2593 -1.2593 0.3292 0.3292 1.0039 1.0039 1.4815 1.4815 1.6948 1.6948 2.3354 2.3354 2.4845 2.4845 2.8367 2.8367 3.7444 3.7444 4.0461 4.0461 4.6185 4.6185 4.8768 4.8768 5.0903 5.0903 5.3452 5.3452 5.5210 5.5210 5.7293 5.7293 5.8745 5.8745 6.1097 6.1097 11.6284 11.6284 13.4408 13.4408 13.5551 13.5551 13.8521 13.8521 14.2865 14.2865 14.3603 14.3603 15.1723 15.1723 k = 0.6003 0.2632-0.2756 ( 4135 PWs) bands (ev): -31.1648 -31.1648 -14.2144 -14.2144 -14.1420 -14.1420 -13.2041 -13.2041 -13.1340 -13.1340 -12.9137 -12.9137 -12.7672 -12.7672 -12.6052 -12.6052 -12.3697 -12.3697 -11.8267 -11.8267 -11.4970 -11.4970 -11.0624 -11.0624 -10.6820 -10.6820 -10.2018 -10.2018 -9.8917 -9.8917 -1.2893 -1.2893 0.3210 0.3210 0.9893 0.9893 1.4533 1.4533 1.7097 1.7097 2.3279 2.3279 2.4798 2.4798 2.8455 2.8455 3.7548 3.7548 4.0692 4.0692 4.6556 4.6556 4.8972 4.8972 5.1083 5.1083 5.3572 5.3572 5.5268 5.5268 5.7157 5.7157 5.8626 5.8626 6.0851 6.0851 11.5864 11.5864 13.4427 13.4427 13.5642 13.5642 13.8465 13.8465 14.2859 14.2859 14.3629 14.3629 15.1960 15.1960 k = 0.5959 0.2613-0.2574 ( 4131 PWs) bands (ev): -31.1648 -31.1648 -14.2109 -14.2109 -14.1423 -14.1423 -13.2017 -13.2017 -13.1347 -13.1347 -12.9299 -12.9299 -12.7674 -12.7674 -12.6019 -12.6019 -12.3647 -12.3647 -11.8222 -11.8222 -11.5325 -11.5325 -11.0419 -11.0419 -10.6851 -10.6851 -10.1747 -10.1747 -9.8889 -9.8889 -1.3194 -1.3194 0.3102 0.3102 0.9774 0.9774 1.4245 1.4245 1.7253 1.7253 2.3183 2.3183 2.4753 2.4753 2.8531 2.8531 3.7690 3.7690 4.0913 4.0913 4.6925 4.6925 4.9186 4.9186 5.1274 5.1274 5.3694 5.3694 5.5295 5.5295 5.7050 5.7050 5.8503 5.8503 6.0608 6.0608 11.5435 11.5435 13.4412 13.4412 13.5766 13.5766 13.8414 13.8414 14.2831 14.2831 14.3644 14.3644 15.2193 15.2193 k = 0.5915 0.2593-0.2392 ( 4128 PWs) bands (ev): -31.1648 -31.1648 -14.2074 -14.2074 -14.1426 -14.1426 -13.1992 -13.1992 -13.1355 -13.1355 -12.9466 -12.9466 -12.7676 -12.7676 -12.5975 -12.5975 -12.3594 -12.3594 -11.8175 -11.8175 -11.5683 -11.5683 -11.0213 -11.0213 -10.6887 -10.6887 -10.1480 -10.1480 -9.8856 -9.8856 -1.3493 -1.3493 0.2969 0.2969 0.9680 0.9680 1.3952 1.3952 1.7415 1.7415 2.3071 2.3071 2.4713 2.4713 2.8588 2.8588 3.7870 3.7870 4.1122 4.1122 4.7286 4.7286 4.9409 4.9409 5.1476 5.1476 5.3815 5.3815 5.5279 5.5279 5.6984 5.6984 5.8373 5.8373 6.0372 6.0372 11.5002 11.5002 13.4373 13.4373 13.5909 13.5909 13.8367 13.8367 14.2784 14.2784 14.3645 14.3645 15.2406 15.2406 k = 0.5872 0.2574-0.2210 ( 4132 PWs) bands (ev): -31.1648 -31.1648 -14.2038 -14.2038 -14.1429 -14.1429 -13.1967 -13.1967 -13.1363 -13.1363 -12.9636 -12.9636 -12.7677 -12.7677 -12.5923 -12.5923 -12.3540 -12.3540 -11.8128 -11.8128 -11.6040 -11.6040 -11.0010 -11.0010 -10.6930 -10.6930 -10.1218 -10.1218 -9.8820 -9.8820 -1.3788 -1.3788 0.2815 0.2815 0.9610 0.9610 1.3657 1.3657 1.7584 1.7584 2.2944 2.2944 2.4678 2.4678 2.8623 2.8623 3.8086 3.8086 4.1319 4.1319 4.7636 4.7636 4.9641 4.9641 5.1687 5.1687 5.3927 5.3927 5.5221 5.5221 5.6968 5.6968 5.8233 5.8233 6.0148 6.0148 11.4567 11.4567 13.4320 13.4320 13.6062 13.6062 13.8324 13.8324 14.2719 14.2719 14.3631 14.3631 15.2551 15.2551 k = 0.5828 0.2555-0.2028 ( 4132 PWs) bands (ev): -31.1649 -31.1649 -14.2003 -14.2003 -14.1432 -14.1432 -13.1940 -13.1940 -13.1371 -13.1371 -12.9804 -12.9804 -12.7679 -12.7679 -12.5863 -12.5863 -12.3483 -12.3483 -11.8084 -11.8084 -11.6388 -11.6388 -10.9812 -10.9812 -10.6977 -10.6977 -10.0962 -10.0962 -9.8782 -9.8782 -1.4079 -1.4079 0.2642 0.2642 0.9561 0.9561 1.3363 1.3363 1.7761 1.7761 2.2807 2.2807 2.4649 2.4649 2.8631 2.8631 3.8334 3.8334 4.1503 4.1503 4.7972 4.7972 4.9881 4.9881 5.1908 5.1908 5.4021 5.4021 5.5134 5.5134 5.6997 5.6997 5.8080 5.8080 5.9940 5.9940 11.4134 11.4134 13.4257 13.4257 13.6218 13.6218 13.8287 13.8287 14.2637 14.2637 14.3601 14.3601 15.2546 15.2546 k = 0.5785 0.2536-0.1846 ( 4132 PWs) bands (ev): -31.1649 -31.1649 -14.1967 -14.1967 -14.1435 -14.1435 -13.1914 -13.1914 -13.1380 -13.1380 -12.9970 -12.9970 -12.7680 -12.7680 -12.5797 -12.5797 -12.3426 -12.3426 -11.8052 -11.8052 -11.6720 -11.6720 -10.9621 -10.9621 -10.7029 -10.7029 -10.0712 -10.0712 -9.8741 -9.8741 -1.4362 -1.4362 0.2455 0.2455 0.9531 0.9531 1.3070 1.3070 1.7946 1.7946 2.2663 2.2663 2.4625 2.4625 2.8615 2.8615 3.8611 3.8611 4.1676 4.1676 4.8291 4.8291 5.0126 5.0126 5.2136 5.2136 5.4078 5.4078 5.5049 5.5049 5.7062 5.7062 5.7915 5.7915 5.9753 5.9753 11.3704 11.3704 13.4187 13.4187 13.6375 13.6375 13.8256 13.8256 14.2540 14.2540 14.3552 14.3552 15.2376 15.2376 k = 0.5741 0.2517-0.1664 ( 4138 PWs) bands (ev): -31.1649 -31.1649 -14.1932 -14.1932 -14.1438 -14.1438 -13.1887 -13.1887 -13.1389 -13.1389 -13.0132 -13.0132 -12.7680 -12.7680 -12.5726 -12.5726 -12.3367 -12.3367 -11.8046 -11.8046 -11.7018 -11.7018 -10.9438 -10.9438 -10.7085 -10.7085 -10.0470 -10.0470 -9.8698 -9.8698 -1.4638 -1.4638 0.2256 0.2256 0.9517 0.9517 1.2782 1.2782 1.8137 1.8137 2.2515 2.2515 2.4605 2.4605 2.8574 2.8574 3.8912 3.8912 4.1837 4.1837 4.8591 4.8591 5.0373 5.0373 5.2367 5.2367 5.4070 5.4070 5.5005 5.5005 5.7150 5.7150 5.7742 5.7742 5.9586 5.9586 11.3282 11.3282 13.4113 13.4113 13.6530 13.6530 13.8231 13.8231 14.2428 14.2428 14.3487 14.3487 15.2121 15.2121 k = 0.5697 0.2498-0.1482 ( 4136 PWs) bands (ev): -31.1650 -31.1650 -14.1897 -14.1897 -14.1440 -14.1440 -13.1862 -13.1862 -13.1397 -13.1397 -13.0287 -13.0287 -12.7681 -12.7681 -12.5650 -12.5650 -12.3309 -12.3309 -11.8100 -11.8100 -11.7250 -11.7250 -10.9265 -10.9265 -10.7145 -10.7145 -10.0235 -10.0235 -9.8654 -9.8654 -1.4904 -1.4904 0.2051 0.2051 0.9516 0.9516 1.2500 1.2500 1.8335 1.8335 2.2365 2.2365 2.4589 2.4589 2.8510 2.8510 3.9231 3.9231 4.1986 4.1986 4.8872 4.8872 5.0616 5.0616 5.2594 5.2594 5.3988 5.3988 5.5025 5.5025 5.7250 5.7250 5.7566 5.7566 5.9440 5.9440 11.2870 11.2870 13.4035 13.4035 13.6682 13.6682 13.8211 13.8211 14.2304 14.2304 14.3406 14.3406 15.1836 15.1836 k = 0.5654 0.2479-0.1300 ( 4134 PWs) bands (ev): -31.1650 -31.1650 -14.1864 -14.1864 -14.1442 -14.1442 -13.1838 -13.1838 -13.1405 -13.1405 -13.0435 -13.0435 -12.7681 -12.7681 -12.5569 -12.5569 -12.3250 -12.3250 -11.8251 -11.8251 -11.7376 -11.7376 -10.9100 -10.9100 -10.7207 -10.7207 -10.0009 -10.0009 -9.8609 -9.8609 -1.5159 -1.5159 0.1842 0.1842 0.9524 0.9524 1.2225 1.2225 1.8538 1.8538 2.2216 2.2216 2.4575 2.4575 2.8426 2.8426 3.9564 3.9564 4.2125 4.2125 4.9137 4.9137 5.0850 5.0850 5.2806 5.2806 5.3850 5.3850 5.5102 5.5102 5.7323 5.7323 5.7427 5.7427 5.9311 5.9311 11.2469 11.2469 13.3955 13.3955 13.6830 13.6830 13.8199 13.8199 14.2168 14.2168 14.3309 14.3309 15.1545 15.1545 k = 0.5610 0.2460-0.1118 ( 4142 PWs) bands (ev): -31.1650 -31.1650 -14.1832 -14.1832 -14.1443 -14.1443 -13.1816 -13.1816 -13.1412 -13.1412 -13.0574 -13.0574 -12.7681 -12.7681 -12.5485 -12.5485 -12.3191 -12.3191 -11.8490 -11.8490 -11.7408 -11.7408 -10.8946 -10.8946 -10.7271 -10.7271 -9.9793 -9.9793 -9.8565 -9.8565 -1.5402 -1.5402 0.1632 0.1632 0.9540 0.9540 1.1961 1.1961 1.8746 1.8746 2.2068 2.2068 2.4564 2.4564 2.8326 2.8326 3.9905 3.9905 4.2255 4.2255 4.9385 4.9385 5.1071 5.1071 5.2982 5.2982 5.3699 5.3699 5.5216 5.5216 5.7207 5.7207 5.7492 5.7492 5.9198 5.9198 11.2083 11.2083 13.3874 13.3874 13.6974 13.6974 13.8192 13.8192 14.2022 14.2022 14.3199 14.3199 15.1257 15.1257 k = 0.5567 0.2441-0.0936 ( 4142 PWs) bands (ev): -31.1651 -31.1651 -14.1802 -14.1802 -14.1443 -14.1443 -13.1798 -13.1798 -13.1419 -13.1419 -13.0703 -13.0703 -12.7681 -12.7681 -12.5398 -12.5398 -12.3132 -12.3132 -11.8772 -11.8772 -11.7388 -11.7388 -10.8802 -10.8802 -10.7336 -10.7336 -9.9588 -9.9588 -9.8520 -9.8520 -1.5632 -1.5632 0.1426 0.1426 0.9561 0.9561 1.1709 1.1709 1.8957 1.8957 2.1925 2.1925 2.4554 2.4554 2.8211 2.8211 4.0248 4.0248 4.2374 4.2374 4.9618 4.9618 5.1272 5.1272 5.3073 5.3073 5.3590 5.3590 5.5354 5.5354 5.7071 5.7071 5.7599 5.7599 5.9097 5.9097 11.1714 11.1714 13.3793 13.3793 13.7113 13.7113 13.8192 13.8192 14.1869 14.1869 14.3077 14.3077 15.0980 15.0980 k = 0.5523 0.2421-0.0755 ( 4140 PWs) bands (ev): -31.1651 -31.1651 -14.1775 -14.1775 -14.1443 -14.1443 -13.1784 -13.1784 -13.1423 -13.1423 -13.0821 -13.0821 -12.7681 -12.7681 -12.5309 -12.5309 -12.3073 -12.3073 -11.9070 -11.9070 -11.7344 -11.7344 -10.8668 -10.8668 -10.7402 -10.7402 -9.9394 -9.9394 -9.8477 -9.8477 -1.5849 -1.5849 0.1225 0.1225 0.9586 0.9586 1.1470 1.1470 1.9170 1.9170 2.1787 2.1787 2.4544 2.4544 2.8085 2.8085 4.0589 4.0589 4.2485 4.2485 4.9838 4.9838 5.1449 5.1449 5.3032 5.3032 5.3576 5.3576 5.5512 5.5512 5.6962 5.6962 5.7704 5.7704 5.9005 5.9005 11.1363 11.1363 13.3712 13.3712 13.7248 13.7248 13.8198 13.8198 14.1710 14.1710 14.2947 14.2947 15.0718 15.0718 k = 0.5479 0.2402-0.0573 ( 4139 PWs) bands (ev): -31.1651 -31.1651 -14.1750 -14.1750 -14.1441 -14.1441 -13.1777 -13.1777 -13.1425 -13.1425 -13.0926 -13.0926 -12.7681 -12.7681 -12.5217 -12.5217 -12.3013 -12.3013 -11.9370 -11.9370 -11.7290 -11.7290 -10.8545 -10.8545 -10.7466 -10.7466 -9.9211 -9.9211 -9.8436 -9.8436 -1.6051 -1.6051 0.1031 0.1031 0.9611 0.9611 1.1246 1.1246 1.9383 1.9383 2.1656 2.1656 2.4536 2.4536 2.7952 2.7952 4.0924 4.0924 4.2588 4.2588 5.0044 5.0044 5.1593 5.1593 5.2910 5.2910 5.3608 5.3608 5.5688 5.5688 5.6888 5.6888 5.7804 5.7804 5.8920 5.8920 11.1033 11.1033 13.3634 13.3634 13.7378 13.7378 13.8209 13.8209 14.1546 14.1546 14.2810 14.2810 15.0473 15.0473 k = 0.5436 0.2383-0.0391 ( 4141 PWs) bands (ev): -31.1651 -31.1651 -14.1727 -14.1727 -14.1438 -14.1438 -13.1778 -13.1778 -13.1423 -13.1423 -13.1018 -13.1018 -12.7681 -12.7681 -12.5126 -12.5126 -12.2952 -12.2952 -11.9667 -11.9667 -11.7232 -11.7232 -10.8433 -10.8433 -10.7529 -10.7529 -9.9042 -9.9042 -9.8396 -9.8396 -1.6237 -1.6237 0.0849 0.0849 0.9636 0.9636 1.1040 1.1040 1.9593 1.9593 2.1533 2.1533 2.4528 2.4528 2.7813 2.7813 4.1247 4.1247 4.2684 4.2684 5.0237 5.0237 5.1691 5.1691 5.2788 5.2788 5.3622 5.3622 5.5878 5.5878 5.6853 5.6853 5.7895 5.7895 5.8840 5.8840 11.0726 11.0726 13.3557 13.3557 13.7503 13.7503 13.8224 13.8224 14.1379 14.1379 14.2670 14.2670 15.0248 15.0248 k = 0.5392 0.2364-0.0209 ( 4135 PWs) bands (ev): -31.1652 -31.1652 -14.1708 -14.1708 -14.1434 -14.1434 -13.1787 -13.1787 -13.1419 -13.1419 -13.1096 -13.1096 -12.7680 -12.7680 -12.5034 -12.5034 -12.2889 -12.2889 -11.9956 -11.9956 -11.7173 -11.7173 -10.8332 -10.8332 -10.7588 -10.7588 -9.8886 -9.8886 -9.8359 -9.8359 -1.6408 -1.6408 0.0678 0.0678 0.9658 0.9658 1.0853 1.0853 1.9799 1.9799 2.1419 2.1419 2.4520 2.4520 2.7673 2.7673 4.1554 4.1554 4.2772 4.2772 5.0418 5.0418 5.1728 5.1728 5.2706 5.2706 5.3598 5.3598 5.6079 5.6079 5.6853 5.6853 5.7979 5.7979 5.8765 5.8765 11.0443 11.0443 13.3485 13.3485 13.7624 13.7624 13.8244 13.8244 14.1212 14.1212 14.2529 14.2529 15.0043 15.0043 k = 0.5349 0.2345-0.0027 ( 4141 PWs) bands (ev): -31.1652 -31.1652 -14.1692 -14.1692 -14.1429 -14.1429 -13.1804 -13.1804 -13.1412 -13.1412 -13.1159 -13.1159 -12.7680 -12.7680 -12.4944 -12.4944 -12.2823 -12.2823 -12.0236 -12.0236 -11.7117 -11.7117 -10.8242 -10.8242 -10.7644 -10.7644 -9.8745 -9.8745 -9.8325 -9.8325 -1.6561 -1.6561 0.0521 0.0521 0.9675 0.9675 1.0687 1.0687 1.9996 1.9996 2.1314 2.1314 2.4512 2.4512 2.7533 2.7533 4.1842 4.1842 4.2853 4.2853 5.0585 5.0585 5.1697 5.1697 5.2681 5.2681 5.3540 5.3540 5.6283 5.6283 5.6881 5.6881 5.8052 5.8052 5.8693 5.8693 11.0185 11.0185 13.3416 13.3416 13.7739 13.7739 13.8266 13.8266 14.1047 14.1047 14.2392 14.2392 14.9861 14.9861 k = 0.5305 0.2326 0.0155 ( 4150 PWs) bands (ev): -31.1652 -31.1652 -14.1678 -14.1678 -14.1423 -14.1423 -13.1827 -13.1827 -13.1402 -13.1402 -13.1210 -13.1210 -12.7680 -12.7680 -12.4857 -12.4857 -12.2753 -12.2753 -12.0505 -12.0505 -11.7063 -11.7063 -10.8163 -10.8163 -10.7696 -10.7696 -9.8619 -9.8619 -9.8293 -9.8293 -1.6698 -1.6698 0.0379 0.0379 0.9687 0.9687 1.0544 1.0544 2.0184 2.0184 2.1220 2.1220 2.4505 2.4505 2.7398 2.7398 4.2104 4.2104 4.2928 4.2928 5.0739 5.0739 5.1614 5.1614 5.2705 5.2705 5.3457 5.3457 5.6482 5.6482 5.6930 5.6930 5.8115 5.8115 5.8624 5.8624 10.9954 10.9954 13.3354 13.3354 13.7847 13.7847 13.8291 13.8291 14.0886 14.0886 14.2262 14.2262 14.9700 14.9700 k = 0.5262 0.2307 0.0337 ( 4160 PWs) bands (ev): -31.1652 -31.1652 -14.1668 -14.1668 -14.1417 -14.1417 -13.1854 -13.1854 -13.1392 -13.1392 -13.1249 -13.1249 -12.7679 -12.7679 -12.4775 -12.4775 -12.2678 -12.2678 -12.0761 -12.0761 -11.7015 -11.7015 -10.8096 -10.8096 -10.7741 -10.7741 -9.8509 -9.8509 -9.8265 -9.8265 -1.6818 -1.6818 0.0253 0.0253 0.9690 0.9690 1.0426 1.0426 2.0357 2.0357 2.1138 2.1138 2.4498 2.4498 2.7270 2.7270 4.2337 4.2337 4.2999 4.2999 5.0877 5.0877 5.1506 5.1506 5.2753 5.2753 5.3361 5.3361 5.6668 5.6668 5.6994 5.6994 5.8168 5.8168 5.8558 5.8558 10.9751 10.9751 13.3297 13.3297 13.7948 13.7948 13.8319 13.8319 14.0733 14.0733 14.2141 14.2141 14.9560 14.9560 k = 0.5218 0.2288 0.0519 ( 4157 PWs) bands (ev): -31.1652 -31.1652 -14.1659 -14.1659 -14.1411 -14.1411 -13.1881 -13.1881 -13.1381 -13.1381 -13.1279 -13.1279 -12.7679 -12.7679 -12.4699 -12.4699 -12.2595 -12.2595 -12.1004 -12.1004 -11.6972 -11.6972 -10.8041 -10.8041 -10.7778 -10.7778 -9.8415 -9.8415 -9.8241 -9.8241 -1.6919 -1.6919 0.0146 0.0146 0.9685 0.9685 1.0334 1.0334 2.0512 2.0512 2.1067 2.1067 2.4492 2.4492 2.7153 2.7153 4.2535 4.2535 4.3066 4.3066 5.1000 5.1000 5.1394 5.1394 5.2808 5.2808 5.3262 5.3262 5.6832 5.6832 5.7067 5.7067 5.8208 5.8208 5.8498 5.8498 10.9578 10.9578 13.3249 13.3249 13.8039 13.8039 13.8349 13.8349 14.0590 14.0590 14.2033 14.2033 14.9443 14.9443 k = 0.5174 0.2269 0.0701 ( 4157 PWs) bands (ev): -31.1652 -31.1652 -14.1653 -14.1653 -14.1405 -14.1405 -13.1907 -13.1907 -13.1371 -13.1371 -13.1301 -13.1301 -12.7679 -12.7679 -12.4633 -12.4633 -12.2503 -12.2503 -12.1232 -12.1232 -11.6935 -11.6935 -10.8000 -10.8000 -10.7807 -10.7807 -9.8339 -9.8339 -9.8219 -9.8219 -1.7003 -1.7003 0.0056 0.0056 0.9672 0.9672 1.0267 1.0267 2.0646 2.0646 2.1008 2.1008 2.4487 2.4487 2.7052 2.7052 4.2694 4.2694 4.3130 4.3130 5.1102 5.1102 5.1292 5.1292 5.2860 5.2860 5.3169 5.3169 5.6967 5.6967 5.7147 5.7147 5.8235 5.8235 5.8447 5.8447 10.9435 10.9435 13.3208 13.3208 13.8116 13.8116 13.8380 13.8380 14.0462 14.0462 14.1941 14.1941 14.9348 14.9348 k = 0.5131 0.2249 0.0883 ( 4161 PWs) bands (ev): -31.1652 -31.1652 -14.1649 -14.1649 -14.1400 -14.1400 -13.1930 -13.1930 -13.1363 -13.1363 -13.1316 -13.1316 -12.7678 -12.7678 -12.4578 -12.4578 -12.2400 -12.2400 -12.1444 -12.1444 -11.6906 -11.6906 -10.7973 -10.7973 -10.7824 -10.7824 -9.8281 -9.8281 -9.8200 -9.8200 -1.7068 -1.7068 -0.0014 -0.0014 0.9655 0.9655 1.0222 1.0222 2.0755 2.0755 2.0962 2.0962 2.4482 2.4482 2.6968 2.6968 4.2809 4.2809 4.3192 4.3192 5.1164 5.1164 5.1229 5.1229 5.2903 5.2903 5.3088 5.3088 5.7067 5.7067 5.7229 5.7229 5.8245 5.8245 5.8410 5.8410 10.9323 10.9323 13.3175 13.3175 13.8176 13.8176 13.8413 13.8413 14.0353 14.0353 14.1867 14.1867 14.9274 14.9274 k = 0.5087 0.2230 0.1065 ( 4175 PWs) bands (ev): -31.1653 -31.1653 -14.1646 -14.1646 -14.1397 -14.1397 -13.1947 -13.1947 -13.1357 -13.1357 -13.1327 -13.1327 -12.7678 -12.7678 -12.4538 -12.4538 -12.2286 -12.2286 -12.1639 -12.1639 -11.6885 -11.6885 -10.7960 -10.7960 -10.7831 -10.7831 -9.8243 -9.8243 -9.8183 -9.8183 -1.7114 -1.7114 -0.0065 -0.0065 0.9638 0.9638 1.0195 1.0195 2.0835 2.0835 2.0930 2.0930 2.4479 2.4479 2.6905 2.6905 4.2885 4.2885 4.3246 4.3246 5.1124 5.1124 5.1265 5.1265 5.2933 5.2933 5.3028 5.3028 5.7133 5.7133 5.7301 5.7301 5.8240 5.8240 5.8390 5.8390 10.9242 10.9242 13.3151 13.3151 13.8217 13.8217 13.8443 13.8443 14.0270 14.0270 14.1812 14.1812 14.9222 14.9222 k = 0.5044 0.2211 0.1246 ( 4175 PWs) bands (ev): -31.1653 -31.1653 -14.1644 -14.1644 -14.1394 -14.1394 -13.1957 -13.1957 -13.1354 -13.1354 -13.1332 -13.1332 -12.7678 -12.7678 -12.4512 -12.4512 -12.2163 -12.2163 -12.1811 -12.1811 -11.6872 -11.6872 -10.7955 -10.7955 -10.7831 -10.7831 -9.8223 -9.8223 -9.8170 -9.8170 -1.7142 -1.7142 -0.0095 -0.0095 0.9626 0.9626 1.0180 1.0180 2.0883 2.0883 2.0911 2.0911 2.4477 2.4477 2.6867 2.6867 4.2927 4.2927 4.3283 4.3283 5.1086 5.1086 5.1302 5.1302 5.2945 5.2945 5.2997 5.2997 5.7171 5.7171 5.7351 5.7351 5.8229 5.8229 5.8384 5.8384 10.9194 10.9194 13.3137 13.3137 13.8241 13.8241 13.8466 13.8466 14.0217 14.0217 14.1779 14.1779 14.9190 14.9190 k = 0.5000 0.2192 0.1428 ( 4180 PWs) bands (ev): -31.1653 -31.1653 -14.1643 -14.1643 -14.1394 -14.1394 -13.1961 -13.1961 -13.1353 -13.1353 -13.1334 -13.1334 -12.7678 -12.7678 -12.4504 -12.4504 -12.2076 -12.2076 -12.1916 -12.1916 -11.6868 -11.6868 -10.7955 -10.7955 -10.7831 -10.7831 -9.8217 -9.8217 -9.8165 -9.8165 -1.7152 -1.7152 -0.0105 -0.0105 0.9622 0.9622 1.0176 1.0176 2.0894 2.0894 2.0910 2.0910 2.4476 2.4476 2.6854 2.6854 4.2940 4.2940 4.3296 4.3296 5.1073 5.1073 5.1315 5.1315 5.2943 5.2943 5.2992 5.2992 5.7184 5.7184 5.7368 5.7368 5.8223 5.8223 5.8382 5.8382 10.9178 10.9178 13.3132 13.3132 13.8248 13.8248 13.8474 13.8474 14.0198 14.0198 14.1768 14.1768 14.9180 14.9180 k = 0.5000-0.4606-0.3002 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2607 -14.2607 -14.1554 -14.1554 -13.2536 -13.2536 -13.1523 -13.1523 -12.7786 -12.7786 -12.6965 -12.6965 -12.3879 -12.3879 -12.2294 -12.2294 -12.2152 -12.2152 -11.3323 -11.3323 -10.9324 -10.9324 -10.8783 -10.8783 -10.5636 -10.5636 -9.7806 -9.7806 -0.9005 -0.9005 0.0880 0.0880 1.3907 1.3907 1.4947 1.4947 1.6813 1.6813 2.2468 2.2468 2.4611 2.4611 2.8430 2.8430 3.4873 3.4873 4.1636 4.1636 4.1957 4.1957 4.9115 4.9115 4.9441 4.9441 5.3837 5.3837 5.3926 5.3926 5.7295 5.7295 6.0865 6.0865 6.3955 6.3955 12.0631 12.0631 12.9677 12.9677 13.8173 13.8173 13.8927 13.8927 14.1838 14.1838 14.3127 14.3127 14.7568 14.7568 k = 0.5137-0.4502-0.2934 ( 4158 PWs) bands (ev): -31.1645 -31.1645 -14.2606 -14.2606 -14.1553 -14.1553 -13.2535 -13.2535 -13.1522 -13.1522 -12.7786 -12.7786 -12.6966 -12.6966 -12.3896 -12.3896 -12.2406 -12.2406 -12.2023 -12.2023 -11.3328 -11.3328 -10.9324 -10.9324 -10.8779 -10.8779 -10.5633 -10.5633 -9.7810 -9.7810 -0.9010 -0.9010 0.0888 0.0888 1.3903 1.3903 1.4948 1.4948 1.6812 1.6812 2.2469 2.2469 2.4613 2.4613 2.8429 2.8429 3.4885 3.4885 4.1615 4.1615 4.1965 4.1965 4.9101 4.9101 4.9449 4.9449 5.3840 5.3840 5.3929 5.3929 5.7294 5.7294 6.0861 6.0861 6.3952 6.3952 12.0627 12.0627 12.9687 12.9687 13.8181 13.8181 13.8924 13.8924 14.1742 14.1742 14.3224 14.3224 14.7570 14.7570 k = 0.5274-0.4398-0.2866 ( 4159 PWs) bands (ev): -31.1645 -31.1645 -14.2604 -14.2604 -14.1552 -14.1552 -13.2532 -13.2532 -13.1520 -13.1520 -12.7786 -12.7786 -12.6969 -12.6969 -12.3948 -12.3948 -12.2550 -12.2550 -12.1830 -12.1830 -11.3341 -11.3341 -10.9325 -10.9325 -10.8765 -10.8765 -10.5624 -10.5624 -9.7821 -9.7821 -0.9024 -0.9024 0.0913 0.0913 1.3892 1.3892 1.4953 1.4953 1.6810 1.6810 2.2473 2.2473 2.4617 2.4617 2.8423 2.8423 3.4920 3.4920 4.1558 4.1558 4.1987 4.1987 4.9064 4.9064 4.9471 4.9471 5.3847 5.3847 5.3938 5.3938 5.7291 5.7291 6.0849 6.0849 6.3944 6.3944 12.0614 12.0614 12.9716 12.9716 13.8207 13.8207 13.8915 13.8915 14.1513 14.1513 14.3453 14.3453 14.7576 14.7576 k = 0.5411-0.4293-0.2798 ( 4155 PWs) bands (ev): -31.1645 -31.1645 -14.2601 -14.2601 -14.1549 -14.1549 -13.2527 -13.2527 -13.1517 -13.1517 -12.7786 -12.7786 -12.6974 -12.6974 -12.4032 -12.4032 -12.2679 -12.2679 -12.1622 -12.1622 -11.3364 -11.3364 -10.9327 -10.9327 -10.8740 -10.8740 -10.5608 -10.5608 -9.7840 -9.7840 -0.9048 -0.9048 0.0954 0.0954 1.3873 1.3873 1.4961 1.4961 1.6806 1.6806 2.2479 2.2479 2.4625 2.4625 2.8415 2.8415 3.4978 3.4978 4.1472 4.1472 4.2016 4.2016 4.9011 4.9011 4.9499 4.9499 5.3852 5.3852 5.3958 5.3958 5.7287 5.7287 6.0829 6.0829 6.3930 6.3930 12.0593 12.0593 12.9764 12.9764 13.8249 13.8249 13.8897 13.8897 14.1235 14.1235 14.3734 14.3734 14.7587 14.7587 k = 0.5548-0.4189-0.2729 ( 4155 PWs) bands (ev): -31.1645 -31.1645 -14.2596 -14.2596 -14.1546 -14.1546 -13.2521 -13.2521 -13.1512 -13.1512 -12.7785 -12.7785 -12.6982 -12.6982 -12.4142 -12.4142 -12.2791 -12.2791 -12.1405 -12.1405 -11.3395 -11.3395 -10.9334 -10.9334 -10.8703 -10.8703 -10.5587 -10.5587 -9.7866 -9.7866 -0.9081 -0.9081 0.1011 0.1011 1.3846 1.3846 1.4972 1.4972 1.6801 1.6801 2.2488 2.2488 2.4636 2.4636 2.8404 2.8404 3.5059 3.5059 4.1361 4.1361 4.2048 4.2048 4.8947 4.8947 4.9528 4.9528 5.3852 5.3852 5.3991 5.3991 5.7284 5.7284 6.0802 6.0802 6.3910 6.3910 12.0564 12.0564 12.9830 12.9830 13.8304 13.8304 13.8869 13.8869 14.0953 14.0953 14.4021 14.4021 14.7604 14.7604 k = 0.5685-0.4084-0.2661 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2591 -14.2591 -14.1541 -14.1541 -13.2512 -13.2512 -13.1506 -13.1506 -12.7785 -12.7785 -12.6994 -12.6994 -12.4271 -12.4271 -12.2888 -12.2888 -12.1184 -12.1184 -11.3434 -11.3434 -10.9346 -10.9346 -10.8654 -10.8654 -10.5560 -10.5560 -9.7900 -9.7900 -0.9122 -0.9122 0.1082 0.1082 1.3811 1.3811 1.4987 1.4987 1.6795 1.6795 2.2500 2.2500 2.4649 2.4649 2.8390 2.8390 3.5161 3.5161 4.1228 4.1228 4.2083 4.2083 4.8876 4.8876 4.9557 4.9557 5.3845 5.3845 5.4035 5.4035 5.7283 5.7283 6.0768 6.0768 6.3885 6.3885 12.0526 12.0526 12.9916 12.9916 13.8369 13.8369 13.8823 13.8823 14.0693 14.0693 14.4293 14.4293 14.7631 14.7631 k = 0.5822-0.3980-0.2593 ( 4147 PWs) bands (ev): -31.1645 -31.1645 -14.2584 -14.2584 -14.1536 -14.1536 -13.2502 -13.2502 -13.1499 -13.1499 -12.7784 -12.7784 -12.7009 -12.7009 -12.4414 -12.4414 -12.2974 -12.2974 -12.0960 -12.0960 -11.3479 -11.3479 -10.9365 -10.9365 -10.8590 -10.8590 -10.5528 -10.5528 -9.7940 -9.7940 -0.9171 -0.9171 0.1168 0.1168 1.3769 1.3769 1.5004 1.5004 1.6789 1.6789 2.2514 2.2514 2.4665 2.4665 2.8375 2.8375 3.5283 3.5283 4.1074 4.1074 4.2120 4.2120 4.8799 4.8799 4.9583 4.9583 5.3830 5.3830 5.4088 5.4088 5.7286 5.7286 6.0727 6.0727 6.3853 6.3853 12.0481 12.0481 13.0019 13.0019 13.8435 13.8435 13.8757 13.8757 14.0475 14.0475 14.4535 14.4535 14.7671 14.7671 k = 0.5959-0.3876-0.2525 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2576 -14.2576 -14.1529 -14.1529 -13.2490 -13.2490 -13.1491 -13.1491 -12.7784 -12.7784 -12.7029 -12.7029 -12.4562 -12.4562 -12.3053 -12.3053 -12.0735 -12.0735 -11.3529 -11.3529 -10.9391 -10.9391 -10.8514 -10.8514 -10.5491 -10.5491 -9.7986 -9.7986 -0.9226 -0.9226 0.1265 0.1265 1.3718 1.3718 1.5024 1.5024 1.6783 1.6783 2.2530 2.2530 2.4684 2.4684 2.8358 2.8358 3.5423 3.5423 4.0901 4.0901 4.2160 4.2160 4.8719 4.8719 4.9606 4.9606 5.3807 5.3807 5.4145 5.4145 5.7294 5.7294 6.0680 6.0680 6.3817 6.3817 12.0428 12.0428 13.0140 13.0140 13.8479 13.8479 13.8683 13.8683 14.0317 14.0317 14.4732 14.4732 14.7730 14.7730 k = 0.6096-0.3771-0.2457 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2566 -14.2566 -14.1522 -14.1522 -13.2477 -13.2477 -13.1482 -13.1482 -12.7784 -12.7784 -12.7055 -12.7055 -12.4711 -12.4711 -12.3126 -12.3126 -12.0511 -12.0511 -11.3584 -11.3584 -10.9424 -10.9424 -10.8425 -10.8425 -10.5451 -10.5451 -9.8039 -9.8039 -0.9288 -0.9288 0.1374 0.1374 1.3660 1.3660 1.5047 1.5047 1.6776 1.6776 2.2549 2.2549 2.4706 2.4706 2.8340 2.8340 3.5581 3.5581 4.0711 4.0711 4.2203 4.2203 4.8635 4.8635 4.9627 4.9627 5.3775 5.3775 5.4204 5.4204 5.7311 5.7311 6.0628 6.0628 6.3774 6.3774 12.0367 12.0367 13.0278 13.0278 13.8417 13.8417 13.8672 13.8672 14.0229 14.0229 14.4875 14.4875 14.7812 14.7812 k = 0.6233-0.3667-0.2389 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2556 -14.2556 -14.1514 -14.1514 -13.2462 -13.2462 -13.1472 -13.1472 -12.7785 -12.7785 -12.7089 -12.7089 -12.4856 -12.4856 -12.3197 -12.3197 -12.0290 -12.0290 -11.3643 -11.3643 -10.9465 -10.9465 -10.8325 -10.8325 -10.5406 -10.5406 -9.8097 -9.8097 -0.9355 -0.9355 0.1492 0.1492 1.3594 1.3594 1.5072 1.5072 1.6771 1.6771 2.2571 2.2571 2.4729 2.4729 2.8323 2.8323 3.5754 3.5754 4.0506 4.0506 4.2251 4.2251 4.8548 4.8548 4.9645 4.9645 5.3734 5.3734 5.4263 5.4263 5.7337 5.7337 6.0572 6.0572 6.3726 6.3726 12.0299 12.0299 13.0432 13.0432 13.8254 13.8254 13.8722 13.8722 14.0213 14.0213 14.4957 14.4957 14.7923 14.7923 k = 0.6370-0.3562-0.2321 ( 4147 PWs) bands (ev): -31.1645 -31.1645 -14.2545 -14.2545 -14.1506 -14.1506 -13.2445 -13.2445 -13.1460 -13.1460 -12.7787 -12.7787 -12.7130 -12.7130 -12.4993 -12.4993 -12.3266 -12.3266 -12.0073 -12.0073 -11.3703 -11.3703 -10.9511 -10.9511 -10.8216 -10.8216 -10.5358 -10.5358 -9.8161 -9.8161 -0.9427 -0.9427 0.1618 0.1618 1.3521 1.3521 1.5098 1.5098 1.6767 1.6767 2.2595 2.2595 2.4755 2.4755 2.8306 2.8306 3.5941 3.5941 4.0289 4.0289 4.2304 4.2304 4.8459 4.8459 4.9662 4.9662 5.3683 5.3683 5.4319 5.4319 5.7374 5.7374 6.0512 6.0512 6.3673 6.3673 12.0225 12.0225 13.0602 13.0602 13.8053 13.8053 13.8778 13.8778 14.0261 14.0261 14.4976 14.4976 14.8063 14.8063 k = 0.6507-0.3458-0.2253 ( 4144 PWs) bands (ev): -31.1645 -31.1645 -14.2534 -14.2534 -14.1497 -14.1497 -13.2427 -13.2427 -13.1448 -13.1448 -12.7790 -12.7790 -12.7181 -12.7181 -12.5118 -12.5118 -12.3333 -12.3333 -11.9862 -11.9862 -11.3764 -11.3764 -10.9563 -10.9563 -10.8099 -10.8099 -10.5308 -10.5308 -9.8228 -9.8228 -0.9502 -0.9502 0.1750 0.1750 1.3440 1.3440 1.5125 1.5125 1.6764 1.6764 2.2621 2.2621 2.4781 2.4781 2.8291 2.8291 3.6140 3.6140 4.0061 4.0061 4.2363 4.2363 4.8368 4.8368 4.9676 4.9676 5.3621 5.3621 5.4371 5.4371 5.7423 5.7423 6.0451 6.0451 6.3614 6.3614 12.0144 12.0144 13.0786 13.0786 13.7836 13.7836 13.8829 13.8829 14.0361 14.0361 14.4936 14.4936 14.8228 14.8228 k = 0.6644-0.3354-0.2185 ( 4144 PWs) bands (ev): -31.1645 -31.1645 -14.2521 -14.2521 -14.1488 -14.1488 -13.2407 -13.2407 -13.1435 -13.1435 -12.7795 -12.7795 -12.7240 -12.7240 -12.5230 -12.5230 -12.3398 -12.3398 -11.9657 -11.9657 -11.3824 -11.3824 -10.9619 -10.9619 -10.7976 -10.7976 -10.5256 -10.5256 -9.8300 -9.8300 -0.9580 -0.9580 0.1887 0.1887 1.3353 1.3353 1.5154 1.5154 1.6763 1.6763 2.2649 2.2649 2.4809 2.4809 2.8278 2.8278 3.6348 3.6348 3.9825 3.9825 4.2428 4.2428 4.8275 4.8275 4.9689 4.9689 5.3549 5.3549 5.4417 5.4417 5.7483 5.7483 6.0388 6.0388 6.3550 6.3550 12.0057 12.0057 13.0984 13.0984 13.7616 13.7616 13.8872 13.8872 14.0502 14.0502 14.4844 14.4844 14.8414 14.8414 k = 0.6781-0.3249-0.2117 ( 4153 PWs) bands (ev): -31.1645 -31.1645 -14.2508 -14.2508 -14.1478 -14.1478 -13.2386 -13.2386 -13.1421 -13.1421 -12.7803 -12.7803 -12.7307 -12.7307 -12.5327 -12.5327 -12.3462 -12.3462 -11.9462 -11.9462 -11.3883 -11.3883 -10.9679 -10.9679 -10.7849 -10.7849 -10.5203 -10.5203 -9.8374 -9.8374 -0.9660 -0.9660 0.2026 0.2026 1.3259 1.3259 1.5183 1.5183 1.6763 1.6763 2.2679 2.2679 2.4836 2.4836 2.8268 2.8268 3.6564 3.6564 3.9584 3.9584 4.2499 4.2499 4.8179 4.8179 4.9702 4.9702 5.3469 5.3469 5.4455 5.4455 5.7554 5.7554 6.0325 6.0325 6.3481 6.3481 11.9965 11.9965 13.1193 13.1193 13.7401 13.7401 13.8909 13.8909 14.0674 14.0674 14.4710 14.4710 14.8612 14.8612 k = 0.6918-0.3145-0.2049 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2494 -14.2494 -14.1469 -14.1469 -13.2364 -13.2364 -13.1407 -13.1407 -12.7816 -12.7816 -12.7380 -12.7380 -12.5409 -12.5409 -12.3523 -12.3523 -11.9276 -11.9276 -11.3938 -11.3938 -10.9742 -10.9742 -10.7719 -10.7719 -10.5149 -10.5149 -9.8451 -9.8451 -0.9742 -0.9742 0.2167 0.2167 1.3159 1.3159 1.5213 1.5213 1.6765 1.6765 2.2711 2.2711 2.4864 2.4864 2.8263 2.8263 3.6785 3.6785 3.9340 3.9340 4.2578 4.2578 4.8081 4.8081 4.9713 4.9713 5.3381 5.3381 5.4486 5.4486 5.7636 5.7636 6.0264 6.0264 6.3407 6.3407 11.9868 11.9868 13.1411 13.1411 13.7196 13.7196 13.8942 13.8942 14.0868 14.0868 14.4542 14.4542 14.8815 14.8815 k = 0.7055-0.3041-0.1981 ( 4150 PWs) bands (ev): -31.1645 -31.1645 -14.2480 -14.2480 -14.1459 -14.1459 -13.2341 -13.2341 -13.1393 -13.1393 -12.7839 -12.7839 -12.7453 -12.7453 -12.5477 -12.5477 -12.3581 -12.3581 -11.9102 -11.9102 -11.3990 -11.3990 -10.9806 -10.9806 -10.7587 -10.7587 -10.5094 -10.5094 -9.8529 -9.8529 -0.9823 -0.9823 0.2306 0.2306 1.3054 1.3054 1.5244 1.5244 1.6768 1.6768 2.2745 2.2745 2.4889 2.4889 2.8262 2.8262 3.7009 3.7009 3.9098 3.9098 4.2665 4.2665 4.7980 4.7980 4.9725 4.9725 5.3287 5.3287 5.4508 5.4508 5.7725 5.7725 6.0205 6.0205 6.3330 6.3330 11.9767 11.9767 13.1637 13.1637 13.7006 13.7006 13.8971 13.8971 14.1077 14.1077 14.4352 14.4352 14.9016 14.9016 k = 0.7192-0.2936-0.1913 ( 4156 PWs) bands (ev): -31.1645 -31.1645 -14.2466 -14.2466 -14.1450 -14.1450 -13.2317 -13.2317 -13.1378 -13.1378 -12.7875 -12.7875 -12.7520 -12.7520 -12.5531 -12.5531 -12.3636 -12.3636 -11.8940 -11.8940 -11.4037 -11.4037 -10.9871 -10.9871 -10.7456 -10.7456 -10.5040 -10.5040 -9.8607 -9.8607 -0.9905 -0.9905 0.2443 0.2443 1.2943 1.2943 1.5275 1.5275 1.6772 1.6772 2.2781 2.2781 2.4912 2.4912 2.8267 2.8267 3.7233 3.7233 3.8859 3.8859 4.2761 4.2761 4.7875 4.7875 4.9736 4.9736 5.3190 5.3190 5.4521 5.4521 5.7821 5.7821 6.0149 6.0149 6.3248 6.3248 11.9661 11.9661 13.1866 13.1866 13.6833 13.6833 13.8998 13.8998 14.1295 14.1295 14.4146 14.4146 14.9208 14.9208 k = 0.7329-0.2832-0.1845 ( 4152 PWs) bands (ev): -31.1645 -31.1645 -14.2452 -14.2452 -14.1440 -14.1440 -13.2293 -13.2293 -13.1363 -13.1363 -12.7931 -12.7931 -12.7574 -12.7574 -12.5574 -12.5574 -12.3686 -12.3686 -11.8792 -11.8792 -11.4078 -11.4078 -10.9936 -10.9936 -10.7327 -10.7327 -10.4987 -10.4987 -9.8684 -9.8684 -0.9985 -0.9985 0.2576 0.2576 1.2829 1.2829 1.5306 1.5306 1.6776 1.6776 2.2819 2.2819 2.4931 2.4931 2.8279 2.8279 3.7455 3.7455 3.8628 3.8628 4.2865 4.2865 4.7766 4.7766 4.9747 4.9747 5.3091 5.3091 5.4526 5.4526 5.7922 5.7922 6.0099 6.0099 6.3163 6.3163 11.9552 11.9552 13.2096 13.2096 13.6684 13.6684 13.9023 13.9023 14.1516 14.1516 14.3935 14.3935 14.9383 14.9383 k = 0.7466-0.2727-0.1777 ( 4148 PWs) bands (ev): -31.1645 -31.1645 -14.2438 -14.2438 -14.1431 -14.1431 -13.2268 -13.2268 -13.1348 -13.1348 -12.8007 -12.8007 -12.7612 -12.7612 -12.5607 -12.5607 -12.3732 -12.3732 -11.8658 -11.8658 -11.4115 -11.4115 -10.9998 -10.9998 -10.7201 -10.7201 -10.4934 -10.4934 -9.8760 -9.8760 -1.0065 -1.0065 0.2703 0.2703 1.2710 1.2710 1.5340 1.5340 1.6779 1.6779 2.2858 2.2858 2.4945 2.4945 2.8298 2.8298 3.7672 3.7672 3.8408 3.8408 4.2978 4.2978 4.7654 4.7654 4.9759 4.9759 5.2993 5.2993 5.4522 5.4522 5.8024 5.8024 6.0054 6.0054 6.3075 6.3075 11.9441 11.9441 13.2320 13.2320 13.6562 13.6562 13.9047 13.9047 14.1731 14.1731 14.3729 14.3729 14.9533 14.9533 k = 0.7603-0.2623-0.1709 ( 4148 PWs) bands (ev): -31.1645 -31.1645 -14.2423 -14.2423 -14.1423 -14.1423 -13.2242 -13.2242 -13.1334 -13.1334 -12.8097 -12.8097 -12.7636 -12.7636 -12.5631 -12.5631 -12.3772 -12.3772 -11.8539 -11.8539 -11.4148 -11.4148 -11.0057 -11.0057 -10.7081 -10.7081 -10.4884 -10.4884 -9.8833 -9.8833 -1.0143 -1.0143 0.2822 0.2822 1.2588 1.2588 1.5374 1.5374 1.6782 1.6782 2.2898 2.2898 2.4952 2.4952 2.8325 2.8325 3.7877 3.7877 3.8206 3.8206 4.3100 4.3100 4.7537 4.7537 4.9770 4.9770 5.2899 5.2899 5.4510 5.4510 5.8127 5.8127 6.0015 6.0015 6.2985 6.2985 11.9327 11.9327 13.2533 13.2533 13.6472 13.6472 13.9070 13.9070 14.1931 14.1931 14.3538 14.3538 14.9647 14.9647 k = 0.7740-0.2519-0.1641 ( 4143 PWs) bands (ev): -31.1645 -31.1645 -14.2409 -14.2409 -14.1415 -14.1415 -13.2217 -13.2217 -13.1321 -13.1321 -12.8196 -12.8196 -12.7650 -12.7650 -12.5650 -12.5650 -12.3806 -12.3806 -11.8435 -11.8435 -11.4176 -11.4176 -11.0109 -11.0109 -10.6966 -10.6966 -10.4836 -10.4836 -9.8901 -9.8901 -1.0218 -1.0218 0.2933 0.2933 1.2463 1.2463 1.5411 1.5411 1.6782 1.6782 2.2939 2.2939 2.4951 2.4951 2.8362 2.8362 3.7961 3.7961 3.8134 3.8134 4.3231 4.3231 4.7416 4.7416 4.9782 4.9782 5.2810 5.2810 5.4491 5.4491 5.8227 5.8227 5.9983 5.9983 6.2894 6.2894 11.9212 11.9212 13.2726 13.2726 13.6421 13.6421 13.9091 13.9091 14.2098 14.2098 14.3384 14.3384 14.9718 14.9718 k = 0.7877-0.2414-0.1573 ( 4145 PWs) bands (ev): -31.1645 -31.1645 -14.2396 -14.2396 -14.1408 -14.1408 -13.2191 -13.2191 -13.1308 -13.1308 -12.8298 -12.8298 -12.7660 -12.7660 -12.5664 -12.5664 -12.3835 -12.3835 -11.8345 -11.8345 -11.4204 -11.4204 -11.0154 -11.0154 -10.6860 -10.6860 -10.4790 -10.4790 -9.8964 -9.8964 -1.0291 -1.0291 0.3033 0.3033 1.2336 1.2336 1.5451 1.5451 1.6778 1.6778 2.2982 2.2982 2.4940 2.4940 2.8408 2.8408 3.7811 3.7811 3.8306 3.8306 4.3369 4.3369 4.7292 4.7292 4.9794 4.9794 5.2728 5.2728 5.4465 5.4465 5.8324 5.8324 5.9958 5.9958 6.2802 6.2802 11.9095 11.9095 13.2893 13.2893 13.6415 13.6415 13.9110 13.9110 14.2206 14.2206 14.3293 14.3293 14.9735 14.9735 Writing output data file CaSnxBO3x2.save init_run : 0.41s CPU 0.58s WALL ( 1 calls) electrons : 499.25s CPU 504.64s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 499.24s CPU 504.62s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.08s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.09s WALL ( 276 calls) cegterg : 475.86s CPU 480.67s WALL ( 747 calls) Called by sum_band: Called by *egterg: h_psi : 251.94s CPU 255.02s WALL ( 14029 calls) s_psi : 10.82s CPU 10.82s WALL ( 14029 calls) g_psi : 0.42s CPU 0.47s WALL ( 13006 calls) cdiaghg : 186.94s CPU 189.05s WALL ( 13282 calls) cegterg:over : 16.77s CPU 16.74s WALL ( 13006 calls) cegterg:upda : 15.44s CPU 15.34s WALL ( 13006 calls) cegterg:last : 6.65s CPU 6.75s WALL ( 1575 calls) cdiaghg:chol : 10.71s CPU 10.91s WALL ( 13282 calls) cdiaghg:inve : 7.91s CPU 8.06s WALL ( 13282 calls) cdiaghg:para : 14.07s CPU 14.04s WALL ( 26564 calls) Called by h_psi: h_psi:vloc : 224.82s CPU 227.67s WALL ( 14029 calls) h_psi:vnl : 26.55s CPU 26.76s WALL ( 14029 calls) add_vuspsi : 13.30s CPU 13.24s WALL ( 14029 calls) General routines calbec : 13.21s CPU 13.48s WALL ( 14029 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 209.38s CPU 212.42s WALL ( 1564628 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.25s WALL ( 552 calls) Parallel routines fft_scatter : 57.45s CPU 57.62s WALL ( 1564651 calls) PWSCF : 8m39.62s CPU 9m 0.96s WALL This run was terminated on: 13:56:54 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=