Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 10:10: 0 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./SbI3Cl8.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 46 35 9 2234 1472 212 Max 47 36 10 2241 1498 220 Sum 3357 2565 707 161059 106751 15591 bravais-lattice index = 14 lattice parameter (alat) = 13.2791 a.u. unit-cell volume = 2533.6468 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 82.00 number of Kohn-Sham states= 98 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.279105 celldm(2)= 1.003273 celldm(3)= 1.098904 celldm(4)= 0.028445 celldm(5)= 0.124814 celldm(6)= 0.146428 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.146908 0.992459 0.000000 ) a(3) = ( 0.137158 0.011296 1.090252 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.148024 -0.124271 ) b(2) = ( 0.000000 1.007598 -0.010440 ) b(3) = ( 0.000000 0.000000 0.917219 ) PseudoPot. # 1 for Cl read from file: /users/gautes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 Pseudo is Ultrasoft + core correction, Zval = 5.0 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 I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cl 7.00 35.45300 Cl( 1.00) Sb 5.00 121.76000 Sb( 1.00) I 7.00 126.90450 I( 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= 199 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.5000000 -0.0740119 -0.0621353), wk = 0.0050251 k( 2) = ( 0.4782609 -0.0707940 -0.0594337), wk = 0.0050251 k( 3) = ( 0.4565217 -0.0675761 -0.0567322), wk = 0.0050251 k( 4) = ( 0.4347826 -0.0643582 -0.0540307), wk = 0.0050251 k( 5) = ( 0.4130435 -0.0611403 -0.0513291), wk = 0.0050251 k( 6) = ( 0.3913044 -0.0579224 -0.0486276), wk = 0.0050251 k( 7) = ( 0.3695652 -0.0547045 -0.0459261), wk = 0.0050251 k( 8) = ( 0.3478261 -0.0514866 -0.0432245), wk = 0.0050251 k( 9) = ( 0.3260870 -0.0482686 -0.0405230), wk = 0.0050251 k( 10) = ( 0.3043478 -0.0450507 -0.0378215), wk = 0.0050251 k( 11) = ( 0.2826087 -0.0418328 -0.0351199), wk = 0.0050251 k( 12) = ( 0.2608696 -0.0386149 -0.0324184), wk = 0.0050251 k( 13) = ( 0.2391304 -0.0353970 -0.0297169), wk = 0.0050251 k( 14) = ( 0.2173913 -0.0321791 -0.0270153), wk = 0.0050251 k( 15) = ( 0.1956522 -0.0289612 -0.0243138), wk = 0.0050251 k( 16) = ( 0.1739130 -0.0257433 -0.0216123), wk = 0.0050251 k( 17) = ( 0.1521739 -0.0225254 -0.0189107), wk = 0.0050251 k( 18) = ( 0.1304348 -0.0193075 -0.0162092), wk = 0.0050251 k( 19) = ( 0.1086957 -0.0160895 -0.0135077), wk = 0.0050251 k( 20) = ( 0.0869565 -0.0128716 -0.0108061), wk = 0.0050251 k( 21) = ( 0.0652174 -0.0096537 -0.0081046), wk = 0.0050251 k( 22) = ( 0.0434783 -0.0064358 -0.0054031), wk = 0.0050251 k( 23) = ( 0.0217391 -0.0032179 -0.0027015), wk = 0.0050251 k( 24) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 25) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 26) = ( 0.0000000 0.0219043 -0.0002270), wk = 0.0050251 k( 27) = ( 0.0000000 0.0438086 -0.0004539), wk = 0.0050251 k( 28) = ( 0.0000000 0.0657129 -0.0006809), wk = 0.0050251 k( 29) = ( 0.0000000 0.0876172 -0.0009078), wk = 0.0050251 k( 30) = ( 0.0000000 0.1095215 -0.0011348), wk = 0.0050251 k( 31) = ( 0.0000000 0.1314259 -0.0013617), wk = 0.0050251 k( 32) = ( 0.0000000 0.1533302 -0.0015887), wk = 0.0050251 k( 33) = ( 0.0000000 0.1752345 -0.0018156), wk = 0.0050251 k( 34) = ( 0.0000000 0.1971388 -0.0020426), wk = 0.0050251 k( 35) = ( 0.0000000 0.2190431 -0.0022695), wk = 0.0050251 k( 36) = ( 0.0000000 0.2409474 -0.0024965), wk = 0.0050251 k( 37) = ( 0.0000000 0.2628517 -0.0027234), wk = 0.0050251 k( 38) = ( 0.0000000 0.2847560 -0.0029504), wk = 0.0050251 k( 39) = ( 0.0000000 0.3066603 -0.0031773), wk = 0.0050251 k( 40) = ( 0.0000000 0.3285646 -0.0034043), wk = 0.0050251 k( 41) = ( 0.0000000 0.3504689 -0.0036313), wk = 0.0050251 k( 42) = ( 0.0000000 0.3723733 -0.0038582), wk = 0.0050251 k( 43) = ( 0.0000000 0.3942776 -0.0040852), wk = 0.0050251 k( 44) = ( 0.0000000 0.4161819 -0.0043121), wk = 0.0050251 k( 45) = ( 0.0000000 0.4380862 -0.0045391), wk = 0.0050251 k( 46) = ( 0.0000000 0.4599905 -0.0047660), wk = 0.0050251 k( 47) = ( 0.0000000 0.4818948 -0.0049930), wk = 0.0050251 k( 48) = ( 0.0000000 0.5037991 -0.0052199), wk = 0.0050251 k( 49) = ( 0.5000000 0.4297872 -0.0673552), wk = 0.0050251 k( 50) = ( 0.4833333 0.4154609 -0.0651100), wk = 0.0050251 k( 51) = ( 0.4666667 0.4011347 -0.0628648), wk = 0.0050251 k( 52) = ( 0.4500000 0.3868085 -0.0606197), wk = 0.0050251 k( 53) = ( 0.4333333 0.3724822 -0.0583745), wk = 0.0050251 k( 54) = ( 0.4166667 0.3581560 -0.0561293), wk = 0.0050251 k( 55) = ( 0.4000000 0.3438297 -0.0538842), wk = 0.0050251 k( 56) = ( 0.3833333 0.3295035 -0.0516390), wk = 0.0050251 k( 57) = ( 0.3666667 0.3151773 -0.0493938), wk = 0.0050251 k( 58) = ( 0.3500000 0.3008510 -0.0471486), wk = 0.0050251 k( 59) = ( 0.3333333 0.2865248 -0.0449035), wk = 0.0050251 k( 60) = ( 0.3166667 0.2721985 -0.0426583), wk = 0.0050251 k( 61) = ( 0.3000000 0.2578723 -0.0404131), wk = 0.0050251 k( 62) = ( 0.2833333 0.2435461 -0.0381679), wk = 0.0050251 k( 63) = ( 0.2666667 0.2292198 -0.0359228), wk = 0.0050251 k( 64) = ( 0.2500000 0.2148936 -0.0336776), wk = 0.0050251 k( 65) = ( 0.2333333 0.2005673 -0.0314324), wk = 0.0050251 k( 66) = ( 0.2166667 0.1862411 -0.0291872), wk = 0.0050251 k( 67) = ( 0.2000000 0.1719149 -0.0269421), wk = 0.0050251 k( 68) = ( 0.1833333 0.1575886 -0.0246969), wk = 0.0050251 k( 69) = ( 0.1666667 0.1432624 -0.0224517), wk = 0.0050251 k( 70) = ( 0.1500000 0.1289362 -0.0202066), wk = 0.0050251 k( 71) = ( 0.1333333 0.1146099 -0.0179614), wk = 0.0050251 k( 72) = ( 0.1166667 0.1002837 -0.0157162), wk = 0.0050251 k( 73) = ( 0.1000000 0.0859574 -0.0134710), wk = 0.0050251 k( 74) = ( 0.0833333 0.0716312 -0.0112259), wk = 0.0050251 k( 75) = ( 0.0666667 0.0573050 -0.0089807), wk = 0.0050251 k( 76) = ( 0.0500000 0.0429787 -0.0067355), wk = 0.0050251 k( 77) = ( 0.0333333 0.0286525 -0.0044903), wk = 0.0050251 k( 78) = ( 0.0166667 0.0143262 -0.0022452), wk = 0.0050251 k( 79) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 80) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 81) = ( 0.0000000 0.0000000 0.0218385), wk = 0.0050251 k( 82) = ( 0.0000000 0.0000000 0.0436771), wk = 0.0050251 k( 83) = ( 0.0000000 0.0000000 0.0655156), wk = 0.0050251 k( 84) = ( 0.0000000 0.0000000 0.0873542), wk = 0.0050251 k( 85) = ( 0.0000000 0.0000000 0.1091927), wk = 0.0050251 k( 86) = ( 0.0000000 0.0000000 0.1310312), wk = 0.0050251 k( 87) = ( 0.0000000 0.0000000 0.1528698), wk = 0.0050251 k( 88) = ( 0.0000000 0.0000000 0.1747083), wk = 0.0050251 k( 89) = ( 0.0000000 0.0000000 0.1965469), wk = 0.0050251 k( 90) = ( 0.0000000 0.0000000 0.2183854), wk = 0.0050251 k( 91) = ( 0.0000000 0.0000000 0.2402240), wk = 0.0050251 k( 92) = ( 0.0000000 0.0000000 0.2620625), wk = 0.0050251 k( 93) = ( 0.0000000 0.0000000 0.2839010), wk = 0.0050251 k( 94) = ( 0.0000000 0.0000000 0.3057396), wk = 0.0050251 k( 95) = ( 0.0000000 0.0000000 0.3275781), wk = 0.0050251 k( 96) = ( 0.0000000 0.0000000 0.3494167), wk = 0.0050251 k( 97) = ( 0.0000000 0.0000000 0.3712552), wk = 0.0050251 k( 98) = ( 0.0000000 0.0000000 0.3930937), wk = 0.0050251 k( 99) = ( 0.0000000 0.0000000 0.4149323), wk = 0.0050251 k( 100) = ( 0.0000000 0.0000000 0.4367708), wk = 0.0050251 k( 101) = ( 0.0000000 0.0000000 0.4586094), wk = 0.0050251 k( 102) = ( 0.5000000 -0.0740119 0.3964741), wk = 0.0050251 k( 103) = ( 0.4827586 -0.0714598 0.3828026), wk = 0.0050251 k( 104) = ( 0.4655172 -0.0689077 0.3691311), wk = 0.0050251 k( 105) = ( 0.4482759 -0.0663555 0.3554595), wk = 0.0050251 k( 106) = ( 0.4310345 -0.0638034 0.3417880), wk = 0.0050251 k( 107) = ( 0.4137931 -0.0612512 0.3281165), wk = 0.0050251 k( 108) = ( 0.3965517 -0.0586991 0.3144450), wk = 0.0050251 k( 109) = ( 0.3793103 -0.0561470 0.3007735), wk = 0.0050251 k( 110) = ( 0.3620690 -0.0535948 0.2871019), wk = 0.0050251 k( 111) = ( 0.3448276 -0.0510427 0.2734304), wk = 0.0050251 k( 112) = ( 0.3275862 -0.0484906 0.2597589), wk = 0.0050251 k( 113) = ( 0.3103448 -0.0459384 0.2460874), wk = 0.0050251 k( 114) = ( 0.2931034 -0.0433863 0.2324159), wk = 0.0050251 k( 115) = ( 0.2758621 -0.0408342 0.2187443), wk = 0.0050251 k( 116) = ( 0.2586207 -0.0382820 0.2050728), wk = 0.0050251 k( 117) = ( 0.2413793 -0.0357299 0.1914013), wk = 0.0050251 k( 118) = ( 0.2241379 -0.0331778 0.1777298), wk = 0.0050251 k( 119) = ( 0.2068966 -0.0306256 0.1640582), wk = 0.0050251 k( 120) = ( 0.1896552 -0.0280735 0.1503867), wk = 0.0050251 k( 121) = ( 0.1724138 -0.0255214 0.1367152), wk = 0.0050251 k( 122) = ( 0.1551724 -0.0229692 0.1230437), wk = 0.0050251 k( 123) = ( 0.1379310 -0.0204171 0.1093722), wk = 0.0050251 k( 124) = ( 0.1206897 -0.0178649 0.0957007), wk = 0.0050251 k( 125) = ( 0.1034483 -0.0153128 0.0820291), wk = 0.0050251 k( 126) = ( 0.0862069 -0.0127607 0.0683576), wk = 0.0050251 k( 127) = ( 0.0689655 -0.0102085 0.0546861), wk = 0.0050251 k( 128) = ( 0.0517241 -0.0076564 0.0410146), wk = 0.0050251 k( 129) = ( 0.0344828 -0.0051043 0.0273430), wk = 0.0050251 k( 130) = ( 0.0172414 -0.0025521 0.0136715), wk = 0.0050251 k( 131) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 133) = ( 0.0000000 0.0162516 0.0146255), wk = 0.0050251 k( 134) = ( 0.0000000 0.0325032 0.0292509), wk = 0.0050251 k( 135) = ( 0.0000000 0.0487548 0.0438764), wk = 0.0050251 k( 136) = ( 0.0000000 0.0650063 0.0585019), wk = 0.0050251 k( 137) = ( 0.0000000 0.0812579 0.0731273), wk = 0.0050251 k( 138) = ( 0.0000000 0.0975095 0.0877528), wk = 0.0050251 k( 139) = ( 0.0000000 0.1137611 0.1023783), wk = 0.0050251 k( 140) = ( 0.0000000 0.1300127 0.1170037), wk = 0.0050251 k( 141) = ( 0.0000000 0.1462643 0.1316292), wk = 0.0050251 k( 142) = ( 0.0000000 0.1625158 0.1462547), wk = 0.0050251 k( 143) = ( 0.0000000 0.1787674 0.1608801), wk = 0.0050251 k( 144) = ( 0.0000000 0.1950190 0.1755056), wk = 0.0050251 k( 145) = ( 0.0000000 0.2112706 0.1901311), wk = 0.0050251 k( 146) = ( 0.0000000 0.2275222 0.2047565), wk = 0.0050251 k( 147) = ( 0.0000000 0.2437738 0.2193820), wk = 0.0050251 k( 148) = ( 0.0000000 0.2600253 0.2340075), wk = 0.0050251 k( 149) = ( 0.0000000 0.2762769 0.2486329), wk = 0.0050251 k( 150) = ( 0.0000000 0.2925285 0.2632584), wk = 0.0050251 k( 151) = ( 0.0000000 0.3087801 0.2778838), wk = 0.0050251 k( 152) = ( 0.0000000 0.3250317 0.2925093), wk = 0.0050251 k( 153) = ( 0.0000000 0.3412833 0.3071348), wk = 0.0050251 k( 154) = ( 0.0000000 0.3575348 0.3217602), wk = 0.0050251 k( 155) = ( 0.0000000 0.3737864 0.3363857), wk = 0.0050251 k( 156) = ( 0.0000000 0.3900380 0.3510112), wk = 0.0050251 k( 157) = ( 0.0000000 0.4062896 0.3656366), wk = 0.0050251 k( 158) = ( 0.0000000 0.4225412 0.3802621), wk = 0.0050251 k( 159) = ( 0.0000000 0.4387928 0.3948876), wk = 0.0050251 k( 160) = ( 0.0000000 0.4550443 0.4095130), wk = 0.0050251 k( 161) = ( 0.0000000 0.4712959 0.4241385), wk = 0.0050251 k( 162) = ( 0.0000000 0.4875475 0.4387640), wk = 0.0050251 k( 163) = ( 0.0000000 0.5037991 0.4533894), wk = 0.0050251 k( 164) = ( 0.5000000 0.4297872 0.3912542), wk = 0.0050251 k( 165) = ( 0.4857143 0.4175075 0.3800755), wk = 0.0050251 k( 166) = ( 0.4714286 0.4052279 0.3688968), wk = 0.0050251 k( 167) = ( 0.4571429 0.3929483 0.3577181), wk = 0.0050251 k( 168) = ( 0.4428571 0.3806686 0.3465394), wk = 0.0050251 k( 169) = ( 0.4285714 0.3683890 0.3353607), wk = 0.0050251 k( 170) = ( 0.4142857 0.3561094 0.3241820), wk = 0.0050251 k( 171) = ( 0.4000000 0.3438297 0.3130033), wk = 0.0050251 k( 172) = ( 0.3857143 0.3315501 0.3018247), wk = 0.0050251 k( 173) = ( 0.3714286 0.3192705 0.2906460), wk = 0.0050251 k( 174) = ( 0.3571429 0.3069908 0.2794673), wk = 0.0050251 k( 175) = ( 0.3428571 0.2947112 0.2682886), wk = 0.0050251 k( 176) = ( 0.3285714 0.2824316 0.2571099), wk = 0.0050251 k( 177) = ( 0.3142857 0.2701519 0.2459312), wk = 0.0050251 k( 178) = ( 0.3000000 0.2578723 0.2347525), wk = 0.0050251 k( 179) = ( 0.2857143 0.2455927 0.2235738), wk = 0.0050251 k( 180) = ( 0.2714286 0.2333130 0.2123951), wk = 0.0050251 k( 181) = ( 0.2571429 0.2210334 0.2012164), wk = 0.0050251 k( 182) = ( 0.2428571 0.2087538 0.1900377), wk = 0.0050251 k( 183) = ( 0.2285714 0.1964741 0.1788591), wk = 0.0050251 k( 184) = ( 0.2142857 0.1841945 0.1676804), wk = 0.0050251 k( 185) = ( 0.2000000 0.1719149 0.1565017), wk = 0.0050251 k( 186) = ( 0.1857143 0.1596352 0.1453230), wk = 0.0050251 k( 187) = ( 0.1714286 0.1473556 0.1341443), wk = 0.0050251 k( 188) = ( 0.1571429 0.1350760 0.1229656), wk = 0.0050251 k( 189) = ( 0.1428571 0.1227963 0.1117869), wk = 0.0050251 k( 190) = ( 0.1285714 0.1105167 0.1006082), wk = 0.0050251 k( 191) = ( 0.1142857 0.0982371 0.0894295), wk = 0.0050251 k( 192) = ( 0.1000000 0.0859574 0.0782508), wk = 0.0050251 k( 193) = ( 0.0857143 0.0736778 0.0670721), wk = 0.0050251 k( 194) = ( 0.0714286 0.0613982 0.0558935), wk = 0.0050251 k( 195) = ( 0.0571429 0.0491185 0.0447148), wk = 0.0050251 k( 196) = ( 0.0428571 0.0368389 0.0335361), wk = 0.0050251 k( 197) = ( 0.0285714 0.0245593 0.0223574), wk = 0.0050251 k( 198) = ( 0.0142857 0.0122796 0.0111787), wk = 0.0050251 k( 199) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 cryst. coord. k( 1) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0050251 k( 2) = ( 0.4782609 0.0000000 -0.0000000), wk = 0.0050251 k( 3) = ( 0.4565217 0.0000000 -0.0000000), wk = 0.0050251 k( 4) = ( 0.4347826 0.0000000 -0.0000000), wk = 0.0050251 k( 5) = ( 0.4130435 0.0000000 -0.0000000), wk = 0.0050251 k( 6) = ( 0.3913044 0.0000000 -0.0000000), wk = 0.0050251 k( 7) = ( 0.3695652 0.0000000 -0.0000000), wk = 0.0050251 k( 8) = ( 0.3478261 0.0000000 -0.0000000), wk = 0.0050251 k( 9) = ( 0.3260870 0.0000000 -0.0000000), wk = 0.0050251 k( 10) = ( 0.3043478 0.0000000 -0.0000000), wk = 0.0050251 k( 11) = ( 0.2826087 0.0000000 -0.0000000), wk = 0.0050251 k( 12) = ( 0.2608696 -0.0000000 -0.0000000), wk = 0.0050251 k( 13) = ( 0.2391304 0.0000000 -0.0000000), wk = 0.0050251 k( 14) = ( 0.2173913 -0.0000000 -0.0000000), wk = 0.0050251 k( 15) = ( 0.1956522 0.0000000 -0.0000000), wk = 0.0050251 k( 16) = ( 0.1739130 0.0000000 -0.0000000), wk = 0.0050251 k( 17) = ( 0.1521739 0.0000000 -0.0000000), wk = 0.0050251 k( 18) = ( 0.1304348 0.0000000 -0.0000000), wk = 0.0050251 k( 19) = ( 0.1086957 -0.0000000 -0.0000000), wk = 0.0050251 k( 20) = ( 0.0869565 0.0000000 -0.0000000), wk = 0.0050251 k( 21) = ( 0.0652174 0.0000000 -0.0000000), wk = 0.0050251 k( 22) = ( 0.0434783 0.0000000 -0.0000000), wk = 0.0050251 k( 23) = ( 0.0217391 0.0000000 -0.0000000), wk = 0.0050251 k( 24) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 25) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 26) = ( 0.0000000 0.0217391 -0.0000000), wk = 0.0050251 k( 27) = ( 0.0000000 0.0434783 -0.0000000), wk = 0.0050251 k( 28) = ( 0.0000000 0.0652174 0.0000000), wk = 0.0050251 k( 29) = ( 0.0000000 0.0869565 -0.0000000), wk = 0.0050251 k( 30) = ( 0.0000000 0.1086957 -0.0000000), wk = 0.0050251 k( 31) = ( 0.0000000 0.1304348 0.0000000), wk = 0.0050251 k( 32) = ( 0.0000000 0.1521739 -0.0000000), wk = 0.0050251 k( 33) = ( 0.0000000 0.1739130 -0.0000000), wk = 0.0050251 k( 34) = ( 0.0000000 0.1956522 0.0000000), wk = 0.0050251 k( 35) = ( 0.0000000 0.2173913 -0.0000000), wk = 0.0050251 k( 36) = ( 0.0000000 0.2391304 0.0000000), wk = 0.0050251 k( 37) = ( 0.0000000 0.2608696 -0.0000000), wk = 0.0050251 k( 38) = ( 0.0000000 0.2826087 0.0000000), wk = 0.0050251 k( 39) = ( 0.0000000 0.3043478 0.0000000), wk = 0.0050251 k( 40) = ( 0.0000000 0.3260870 0.0000000), wk = 0.0050251 k( 41) = ( 0.0000000 0.3478261 -0.0000000), wk = 0.0050251 k( 42) = ( 0.0000000 0.3695652 -0.0000000), wk = 0.0050251 k( 43) = ( 0.0000000 0.3913044 -0.0000000), wk = 0.0050251 k( 44) = ( 0.0000000 0.4130435 -0.0000000), wk = 0.0050251 k( 45) = ( 0.0000000 0.4347826 0.0000000), wk = 0.0050251 k( 46) = ( 0.0000000 0.4565217 -0.0000000), wk = 0.0050251 k( 47) = ( 0.0000000 0.4782609 -0.0000000), wk = 0.0050251 k( 48) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0050251 k( 49) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0050251 k( 50) = ( 0.4833333 0.4833333 -0.0000000), wk = 0.0050251 k( 51) = ( 0.4666667 0.4666667 0.0000000), wk = 0.0050251 k( 52) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0050251 k( 53) = ( 0.4333333 0.4333333 -0.0000000), wk = 0.0050251 k( 54) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0050251 k( 55) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0050251 k( 56) = ( 0.3833333 0.3833333 -0.0000000), wk = 0.0050251 k( 57) = ( 0.3666667 0.3666667 -0.0000000), wk = 0.0050251 k( 58) = ( 0.3500000 0.3500000 0.0000000), wk = 0.0050251 k( 59) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0050251 k( 60) = ( 0.3166667 0.3166667 -0.0000000), wk = 0.0050251 k( 61) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0050251 k( 62) = ( 0.2833333 0.2833333 -0.0000000), wk = 0.0050251 k( 63) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0050251 k( 64) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0050251 k( 65) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0050251 k( 66) = ( 0.2166667 0.2166667 -0.0000000), wk = 0.0050251 k( 67) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0050251 k( 68) = ( 0.1833333 0.1833333 -0.0000000), wk = 0.0050251 k( 69) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0050251 k( 70) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0050251 k( 71) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0050251 k( 72) = ( 0.1166667 0.1166667 -0.0000000), wk = 0.0050251 k( 73) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0050251 k( 74) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0050251 k( 75) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0050251 k( 76) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0050251 k( 77) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0050251 k( 78) = ( 0.0166667 0.0166667 0.0000000), wk = 0.0050251 k( 79) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 80) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 81) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0050251 k( 82) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0050251 k( 83) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0050251 k( 84) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0050251 k( 85) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0050251 k( 86) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0050251 k( 87) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0050251 k( 88) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0050251 k( 89) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0050251 k( 90) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0050251 k( 91) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0050251 k( 92) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0050251 k( 93) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0050251 k( 94) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0050251 k( 95) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0050251 k( 96) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0050251 k( 97) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0050251 k( 98) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0050251 k( 99) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0050251 k( 100) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0050251 k( 101) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0050251 k( 102) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0050251 k( 103) = ( 0.4827586 -0.0000000 0.4827586), wk = 0.0050251 k( 104) = ( 0.4655172 -0.0000000 0.4655172), wk = 0.0050251 k( 105) = ( 0.4482759 0.0000000 0.4482759), wk = 0.0050251 k( 106) = ( 0.4310345 0.0000000 0.4310345), wk = 0.0050251 k( 107) = ( 0.4137931 0.0000000 0.4137931), wk = 0.0050251 k( 108) = ( 0.3965517 0.0000000 0.3965517), wk = 0.0050251 k( 109) = ( 0.3793103 0.0000000 0.3793103), wk = 0.0050251 k( 110) = ( 0.3620690 0.0000000 0.3620690), wk = 0.0050251 k( 111) = ( 0.3448276 0.0000000 0.3448276), wk = 0.0050251 k( 112) = ( 0.3275862 -0.0000000 0.3275862), wk = 0.0050251 k( 113) = ( 0.3103448 -0.0000000 0.3103448), wk = 0.0050251 k( 114) = ( 0.2931034 0.0000000 0.2931034), wk = 0.0050251 k( 115) = ( 0.2758621 0.0000000 0.2758621), wk = 0.0050251 k( 116) = ( 0.2586207 0.0000000 0.2586207), wk = 0.0050251 k( 117) = ( 0.2413793 -0.0000000 0.2413793), wk = 0.0050251 k( 118) = ( 0.2241379 0.0000000 0.2241379), wk = 0.0050251 k( 119) = ( 0.2068966 0.0000000 0.2068966), wk = 0.0050251 k( 120) = ( 0.1896552 0.0000000 0.1896552), wk = 0.0050251 k( 121) = ( 0.1724138 0.0000000 0.1724138), wk = 0.0050251 k( 122) = ( 0.1551724 -0.0000000 0.1551724), wk = 0.0050251 k( 123) = ( 0.1379310 -0.0000000 0.1379310), wk = 0.0050251 k( 124) = ( 0.1206897 0.0000000 0.1206897), wk = 0.0050251 k( 125) = ( 0.1034483 0.0000000 0.1034483), wk = 0.0050251 k( 126) = ( 0.0862069 0.0000000 0.0862069), wk = 0.0050251 k( 127) = ( 0.0689655 -0.0000000 0.0689655), wk = 0.0050251 k( 128) = ( 0.0517241 0.0000000 0.0517241), wk = 0.0050251 k( 129) = ( 0.0344828 -0.0000000 0.0344828), wk = 0.0050251 k( 130) = ( 0.0172414 -0.0000000 0.0172414), wk = 0.0050251 k( 131) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 132) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 k( 133) = ( 0.0000000 0.0161290 0.0161290), wk = 0.0050251 k( 134) = ( 0.0000000 0.0322581 0.0322581), wk = 0.0050251 k( 135) = ( 0.0000000 0.0483871 0.0483871), wk = 0.0050251 k( 136) = ( 0.0000000 0.0645161 0.0645161), wk = 0.0050251 k( 137) = ( 0.0000000 0.0806452 0.0806452), wk = 0.0050251 k( 138) = ( 0.0000000 0.0967742 0.0967742), wk = 0.0050251 k( 139) = ( 0.0000000 0.1129032 0.1129032), wk = 0.0050251 k( 140) = ( 0.0000000 0.1290323 0.1290323), wk = 0.0050251 k( 141) = ( 0.0000000 0.1451613 0.1451613), wk = 0.0050251 k( 142) = ( 0.0000000 0.1612903 0.1612903), wk = 0.0050251 k( 143) = ( 0.0000000 0.1774194 0.1774194), wk = 0.0050251 k( 144) = ( 0.0000000 0.1935484 0.1935484), wk = 0.0050251 k( 145) = ( 0.0000000 0.2096774 0.2096774), wk = 0.0050251 k( 146) = ( 0.0000000 0.2258064 0.2258065), wk = 0.0050251 k( 147) = ( 0.0000000 0.2419355 0.2419355), wk = 0.0050251 k( 148) = ( 0.0000000 0.2580645 0.2580645), wk = 0.0050251 k( 149) = ( 0.0000000 0.2741936 0.2741936), wk = 0.0050251 k( 150) = ( 0.0000000 0.2903226 0.2903226), wk = 0.0050251 k( 151) = ( 0.0000000 0.3064516 0.3064516), wk = 0.0050251 k( 152) = ( 0.0000000 0.3225807 0.3225807), wk = 0.0050251 k( 153) = ( 0.0000000 0.3387097 0.3387097), wk = 0.0050251 k( 154) = ( 0.0000000 0.3548387 0.3548387), wk = 0.0050251 k( 155) = ( 0.0000000 0.3709677 0.3709677), wk = 0.0050251 k( 156) = ( 0.0000000 0.3870968 0.3870968), wk = 0.0050251 k( 157) = ( 0.0000000 0.4032258 0.4032258), wk = 0.0050251 k( 158) = ( 0.0000000 0.4193548 0.4193548), wk = 0.0050251 k( 159) = ( 0.0000000 0.4354839 0.4354839), wk = 0.0050251 k( 160) = ( 0.0000000 0.4516129 0.4516129), wk = 0.0050251 k( 161) = ( 0.0000000 0.4677419 0.4677419), wk = 0.0050251 k( 162) = ( 0.0000000 0.4838710 0.4838710), wk = 0.0050251 k( 163) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0050251 k( 164) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0050251 k( 165) = ( 0.4857143 0.4857143 0.4857143), wk = 0.0050251 k( 166) = ( 0.4714286 0.4714286 0.4714286), wk = 0.0050251 k( 167) = ( 0.4571429 0.4571429 0.4571429), wk = 0.0050251 k( 168) = ( 0.4428571 0.4428571 0.4428571), wk = 0.0050251 k( 169) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0050251 k( 170) = ( 0.4142857 0.4142857 0.4142857), wk = 0.0050251 k( 171) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0050251 k( 172) = ( 0.3857143 0.3857143 0.3857143), wk = 0.0050251 k( 173) = ( 0.3714286 0.3714286 0.3714286), wk = 0.0050251 k( 174) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0050251 k( 175) = ( 0.3428571 0.3428571 0.3428571), wk = 0.0050251 k( 176) = ( 0.3285714 0.3285714 0.3285714), wk = 0.0050251 k( 177) = ( 0.3142857 0.3142857 0.3142857), wk = 0.0050251 k( 178) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0050251 k( 179) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0050251 k( 180) = ( 0.2714286 0.2714286 0.2714286), wk = 0.0050251 k( 181) = ( 0.2571429 0.2571429 0.2571429), wk = 0.0050251 k( 182) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0050251 k( 183) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0050251 k( 184) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0050251 k( 185) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0050251 k( 186) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0050251 k( 187) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0050251 k( 188) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0050251 k( 189) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0050251 k( 190) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0050251 k( 191) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0050251 k( 192) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0050251 k( 193) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0050251 k( 194) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0050251 k( 195) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0050251 k( 196) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0050251 k( 197) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0050251 k( 198) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0050251 k( 199) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0050251 Dense grid: 161059 G-vectors FFT dimensions: ( 72, 72, 75) Smooth grid: 106751 G-vectors FFT dimensions: ( 60, 60, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.59 Mb ( 396, 98) NL pseudopotentials 1.23 Mb ( 198, 408) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2235) G-vector shells 0.02 Mb ( 2200) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.37 Mb ( 396, 392) Each subspace H/S matrix 0.06 Mb ( 65, 65) Each matrix 1.22 Mb ( 408, 2, 98) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./SbI3Cl8.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.8 secs Computing kpt #: 2 total cpu time spent up to now is 9.9 secs Computing kpt #: 3 total cpu time spent up to now is 12.4 secs Computing kpt #: 4 total cpu time spent up to now is 14.9 secs Computing kpt #: 5 total cpu time spent up to now is 17.2 secs Computing kpt #: 6 total cpu time spent up to now is 19.6 secs Computing kpt #: 7 total cpu time spent up to now is 22.0 secs Computing kpt #: 8 total cpu time spent up to now is 24.3 secs Computing kpt #: 9 total cpu time spent up to now is 26.7 secs Computing kpt #: 10 total cpu time spent up to now is 29.1 secs Computing kpt #: 11 total cpu time spent up to now is 31.4 secs Computing kpt #: 12 total cpu time spent up to now is 33.6 secs Computing kpt #: 13 total cpu time spent up to now is 35.9 secs Computing kpt #: 14 total cpu time spent up to now is 37.9 secs Computing kpt #: 15 total cpu time spent up to now is 40.0 secs Computing kpt #: 16 total cpu time spent up to now is 41.8 secs Computing kpt #: 17 total cpu time spent up to now is 43.9 secs Computing kpt #: 18 total cpu time spent up to now is 46.1 secs Computing kpt #: 19 total cpu time spent up to now is 48.5 secs Computing kpt #: 20 total cpu time spent up to now is 50.7 secs Computing kpt #: 21 total cpu time spent up to now is 52.7 secs Computing kpt #: 22 total cpu time spent up to now is 54.6 secs Computing kpt #: 23 total cpu time spent up to now is 56.6 secs Computing kpt #: 24 total cpu time spent up to now is 58.5 secs Computing kpt #: 25 total cpu time spent up to now is 60.5 secs Computing kpt #: 26 total cpu time spent up to now is 62.4 secs Computing kpt #: 27 total cpu time spent up to now is 64.3 secs Computing kpt #: 28 total cpu time spent up to now is 66.2 secs Computing kpt #: 29 total cpu time spent up to now is 68.2 secs Computing kpt #: 30 total cpu time spent up to now is 70.1 secs Computing kpt #: 31 total cpu time spent up to now is 72.0 secs Computing kpt #: 32 total cpu time spent up to now is 73.8 secs Computing kpt #: 33 total cpu time spent up to now is 75.7 secs Computing kpt #: 34 total cpu time spent up to now is 77.6 secs Computing kpt #: 35 total cpu time spent up to now is 79.6 secs Computing kpt #: 36 total cpu time spent up to now is 81.5 secs Computing kpt #: 37 total cpu time spent up to now is 83.8 secs Computing kpt #: 38 total cpu time spent up to now is 86.1 secs Computing kpt #: 39 total cpu time spent up to now is 88.4 secs Computing kpt #: 40 total cpu time spent up to now is 91.1 secs Computing kpt #: 41 total cpu time spent up to now is 93.5 secs Computing kpt #: 42 total cpu time spent up to now is 95.9 secs Computing kpt #: 43 total cpu time spent up to now is 98.6 secs Computing kpt #: 44 total cpu time spent up to now is 101.4 secs Computing kpt #: 45 total cpu time spent up to now is 104.0 secs Computing kpt #: 46 total cpu time spent up to now is 106.8 secs Computing kpt #: 47 total cpu time spent up to now is 109.6 secs Computing kpt #: 48 total cpu time spent up to now is 112.3 secs Computing kpt #: 49 total cpu time spent up to now is 115.1 secs Computing kpt #: 50 total cpu time spent up to now is 117.7 secs Computing kpt #: 51 total cpu time spent up to now is 120.3 secs Computing kpt #: 52 total cpu time spent up to now is 122.9 secs Computing kpt #: 53 total cpu time spent up to now is 125.6 secs Computing kpt #: 54 total cpu time spent up to now is 128.2 secs Computing kpt #: 55 total cpu time spent up to now is 130.9 secs Computing kpt #: 56 total cpu time spent up to now is 133.5 secs Computing kpt #: 57 total cpu time spent up to now is 136.2 secs Computing kpt #: 58 total cpu time spent up to now is 138.8 secs Computing kpt #: 59 total cpu time spent up to now is 141.5 secs Computing kpt #: 60 total cpu time spent up to now is 144.6 secs Computing kpt #: 61 total cpu time spent up to now is 147.2 secs Computing kpt #: 62 total cpu time spent up to now is 149.7 secs Computing kpt #: 63 total cpu time spent up to now is 152.3 secs Computing kpt #: 64 total cpu time spent up to now is 154.6 secs Computing kpt #: 65 total cpu time spent up to now is 156.8 secs Computing kpt #: 66 total cpu time spent up to now is 159.1 secs Computing kpt #: 67 total cpu time spent up to now is 161.4 secs Computing kpt #: 68 total cpu time spent up to now is 163.6 secs Computing kpt #: 69 total cpu time spent up to now is 165.6 secs Computing kpt #: 70 total cpu time spent up to now is 167.5 secs Computing kpt #: 71 total cpu time spent up to now is 169.6 secs Computing kpt #: 72 total cpu time spent up to now is 171.7 secs Computing kpt #: 73 total cpu time spent up to now is 173.7 secs Computing kpt #: 74 total cpu time spent up to now is 175.7 secs Computing kpt #: 75 total cpu time spent up to now is 177.6 secs Computing kpt #: 76 total cpu time spent up to now is 179.5 secs Computing kpt #: 77 total cpu time spent up to now is 181.5 secs Computing kpt #: 78 total cpu time spent up to now is 183.3 secs Computing kpt #: 79 total cpu time spent up to now is 185.2 secs Computing kpt #: 80 total cpu time spent up to now is 187.0 secs Computing kpt #: 81 total cpu time spent up to now is 189.0 secs Computing kpt #: 82 total cpu time spent up to now is 190.9 secs Computing kpt #: 83 total cpu time spent up to now is 192.8 secs Computing kpt #: 84 total cpu time spent up to now is 194.8 secs Computing kpt #: 85 total cpu time spent up to now is 196.8 secs Computing kpt #: 86 total cpu time spent up to now is 198.8 secs Computing kpt #: 87 total cpu time spent up to now is 200.9 secs Computing kpt #: 88 total cpu time spent up to now is 203.0 secs Computing kpt #: 89 total cpu time spent up to now is 204.9 secs Computing kpt #: 90 total cpu time spent up to now is 206.8 secs Computing kpt #: 91 total cpu time spent up to now is 208.8 secs Computing kpt #: 92 total cpu time spent up to now is 210.8 secs Computing kpt #: 93 total cpu time spent up to now is 213.0 secs Computing kpt #: 94 total cpu time spent up to now is 215.2 secs Computing kpt #: 95 total cpu time spent up to now is 217.6 secs Computing kpt #: 96 total cpu time spent up to now is 220.2 secs Computing kpt #: 97 total cpu time spent up to now is 222.7 secs Computing kpt #: 98 total cpu time spent up to now is 225.1 secs Computing kpt #: 99 total cpu time spent up to now is 227.6 secs Computing kpt #: 100 total cpu time spent up to now is 230.1 secs Computing kpt #: 101 total cpu time spent up to now is 232.7 secs Computing kpt #: 102 total cpu time spent up to now is 235.4 secs Computing kpt #: 103 total cpu time spent up to now is 238.2 secs Computing kpt #: 104 total cpu time spent up to now is 240.8 secs Computing kpt #: 105 total cpu time spent up to now is 243.4 secs Computing kpt #: 106 total cpu time spent up to now is 246.3 secs Computing kpt #: 107 total cpu time spent up to now is 248.8 secs Computing kpt #: 108 total cpu time spent up to now is 251.4 secs Computing kpt #: 109 total cpu time spent up to now is 254.0 secs Computing kpt #: 110 total cpu time spent up to now is 256.5 secs Computing kpt #: 111 total cpu time spent up to now is 259.0 secs Computing kpt #: 112 total cpu time spent up to now is 261.3 secs Computing kpt #: 113 total cpu time spent up to now is 263.6 secs Computing kpt #: 114 total cpu time spent up to now is 265.9 secs Computing kpt #: 115 total cpu time spent up to now is 268.1 secs Computing kpt #: 116 total cpu time spent up to now is 270.3 secs Computing kpt #: 117 total cpu time spent up to now is 272.6 secs Computing kpt #: 118 total cpu time spent up to now is 274.8 secs Computing kpt #: 119 total cpu time spent up to now is 277.1 secs Computing kpt #: 120 total cpu time spent up to now is 279.1 secs Computing kpt #: 121 total cpu time spent up to now is 281.1 secs Computing kpt #: 122 total cpu time spent up to now is 283.2 secs Computing kpt #: 123 total cpu time spent up to now is 285.2 secs Computing kpt #: 124 total cpu time spent up to now is 288.9 secs Computing kpt #: 125 total cpu time spent up to now is 290.8 secs Computing kpt #: 126 total cpu time spent up to now is 292.8 secs Computing kpt #: 127 total cpu time spent up to now is 294.7 secs Computing kpt #: 128 total cpu time spent up to now is 296.7 secs Computing kpt #: 129 total cpu time spent up to now is 298.6 secs Computing kpt #: 130 total cpu time spent up to now is 300.4 secs Computing kpt #: 131 total cpu time spent up to now is 302.3 secs Computing kpt #: 132 total cpu time spent up to now is 304.3 secs Computing kpt #: 133 total cpu time spent up to now is 306.2 secs Computing kpt #: 134 total cpu time spent up to now is 308.1 secs Computing kpt #: 135 total cpu time spent up to now is 310.0 secs Computing kpt #: 136 total cpu time spent up to now is 312.0 secs Computing kpt #: 137 total cpu time spent up to now is 313.9 secs Computing kpt #: 138 total cpu time spent up to now is 315.9 secs Computing kpt #: 139 total cpu time spent up to now is 317.8 secs Computing kpt #: 140 total cpu time spent up to now is 319.7 secs Computing kpt #: 141 total cpu time spent up to now is 321.6 secs Computing kpt #: 142 total cpu time spent up to now is 323.6 secs Computing kpt #: 143 total cpu time spent up to now is 325.5 secs Computing kpt #: 144 total cpu time spent up to now is 327.5 secs Computing kpt #: 145 total cpu time spent up to now is 329.5 secs Computing kpt #: 146 total cpu time spent up to now is 331.8 secs Computing kpt #: 147 total cpu time spent up to now is 334.1 secs Computing kpt #: 148 total cpu time spent up to now is 336.4 secs Computing kpt #: 149 total cpu time spent up to now is 338.7 secs Computing kpt #: 150 total cpu time spent up to now is 341.1 secs Computing kpt #: 151 total cpu time spent up to now is 343.8 secs Computing kpt #: 152 total cpu time spent up to now is 346.7 secs Computing kpt #: 153 total cpu time spent up to now is 349.8 secs Computing kpt #: 154 total cpu time spent up to now is 353.4 secs Computing kpt #: 155 total cpu time spent up to now is 356.8 secs Computing kpt #: 156 total cpu time spent up to now is 360.4 secs Computing kpt #: 157 total cpu time spent up to now is 363.5 secs Computing kpt #: 158 total cpu time spent up to now is 367.0 secs Computing kpt #: 159 total cpu time spent up to now is 370.0 secs Computing kpt #: 160 total cpu time spent up to now is 373.0 secs Computing kpt #: 161 total cpu time spent up to now is 376.2 secs Computing kpt #: 162 total cpu time spent up to now is 379.2 secs Computing kpt #: 163 total cpu time spent up to now is 384.6 secs Computing kpt #: 164 total cpu time spent up to now is 387.1 secs Computing kpt #: 165 total cpu time spent up to now is 389.6 secs Computing kpt #: 166 total cpu time spent up to now is 392.3 secs Computing kpt #: 167 total cpu time spent up to now is 394.7 secs Computing kpt #: 168 total cpu time spent up to now is 397.1 secs Computing kpt #: 169 total cpu time spent up to now is 399.4 secs Computing kpt #: 170 total cpu time spent up to now is 401.7 secs Computing kpt #: 171 total cpu time spent up to now is 404.1 secs Computing kpt #: 172 total cpu time spent up to now is 406.6 secs Computing kpt #: 173 total cpu time spent up to now is 409.2 secs Computing kpt #: 174 total cpu time spent up to now is 411.6 secs Computing kpt #: 175 total cpu time spent up to now is 414.0 secs Computing kpt #: 176 total cpu time spent up to now is 416.7 secs Computing kpt #: 177 total cpu time spent up to now is 419.4 secs Computing kpt #: 178 total cpu time spent up to now is 422.2 secs Computing kpt #: 179 total cpu time spent up to now is 424.8 secs Computing kpt #: 180 total cpu time spent up to now is 427.1 secs Computing kpt #: 181 total cpu time spent up to now is 429.3 secs Computing kpt #: 182 total cpu time spent up to now is 431.5 secs Computing kpt #: 183 total cpu time spent up to now is 433.8 secs Computing kpt #: 184 total cpu time spent up to now is 436.0 secs Computing kpt #: 185 total cpu time spent up to now is 438.0 secs Computing kpt #: 186 total cpu time spent up to now is 440.3 secs Computing kpt #: 187 total cpu time spent up to now is 442.3 secs Computing kpt #: 188 total cpu time spent up to now is 444.2 secs Computing kpt #: 189 total cpu time spent up to now is 446.3 secs Computing kpt #: 190 total cpu time spent up to now is 448.4 secs Computing kpt #: 191 total cpu time spent up to now is 450.4 secs Computing kpt #: 192 total cpu time spent up to now is 452.4 secs Computing kpt #: 193 total cpu time spent up to now is 454.3 secs Computing kpt #: 194 total cpu time spent up to now is 456.3 secs Computing kpt #: 195 total cpu time spent up to now is 458.3 secs Computing kpt #: 196 total cpu time spent up to now is 460.2 secs Computing kpt #: 197 total cpu time spent up to now is 462.0 secs Computing kpt #: 198 total cpu time spent up to now is 463.9 secs Computing kpt #: 199 total cpu time spent up to now is 465.8 secs ethr = 1.22E-08, avg # of iterations = 25.6 total cpu time spent up to now is 465.8 secs End of band structure calculation k = 0.5000-0.0740-0.0621 ( 13332 PWs) bands (ev): -13.6323 -13.6323 -13.2984 -13.2984 -13.0699 -13.0699 -12.5042 -12.5042 -12.2387 -12.2387 -12.2130 -12.2130 -12.0419 -12.0419 -11.7428 -11.7428 -10.4793 -10.4793 -9.8005 -9.8005 -8.8375 -8.8375 -6.6259 -6.6259 -3.2388 -3.2388 -2.8477 -2.8477 -2.7961 -2.7961 -2.6827 -2.6827 -2.4867 -2.4867 -2.2856 -2.2856 -1.4430 -1.4430 -1.1059 -1.1059 -0.9307 -0.9307 -0.6937 -0.6937 -0.5773 -0.5773 -0.2569 -0.2569 -0.2568 -0.2568 -0.1382 -0.1382 -0.1255 -0.1255 0.2388 0.2388 0.3050 0.3050 0.3683 0.3683 0.5324 0.5324 0.5446 0.5446 0.6087 0.6087 0.7239 0.7239 0.7638 0.7638 0.9000 0.9000 1.0090 1.0090 1.0601 1.0601 1.5082 1.5082 1.6235 1.6235 2.1592 2.1592 3.5195 3.5195 3.9186 3.9186 4.3180 4.3180 4.4125 4.4125 6.7699 6.7699 7.7039 7.7039 8.0587 8.0587 9.0419 9.0419 k = 0.4783-0.0708-0.0594 ( 13339 PWs) bands (ev): -13.6327 -13.6327 -13.2980 -13.2980 -13.0698 -13.0698 -12.5042 -12.5042 -12.2387 -12.2387 -12.2131 -12.2131 -12.0419 -12.0419 -11.7428 -11.7428 -10.4788 -10.4788 -9.8012 -9.8012 -8.8372 -8.8372 -6.6262 -6.6262 -3.2382 -3.2382 -2.8538 -2.8538 -2.7933 -2.7933 -2.6804 -2.6804 -2.4858 -2.4858 -2.2860 -2.2860 -1.4440 -1.4440 -1.1036 -1.1036 -0.9301 -0.9301 -0.6932 -0.6932 -0.5796 -0.5796 -0.2770 -0.2770 -0.2400 -0.2400 -0.1484 -0.1484 -0.1135 -0.1135 0.2352 0.2352 0.3078 0.3078 0.3698 0.3698 0.5259 0.5259 0.5502 0.5502 0.6090 0.6090 0.7227 0.7227 0.7652 0.7652 0.9012 0.9012 1.0063 1.0063 1.0635 1.0635 1.5071 1.5071 1.6247 1.6247 2.1594 2.1594 3.5192 3.5192 3.9188 3.9188 4.3157 4.3157 4.4139 4.4139 6.7706 6.7706 7.7032 7.7032 8.0569 8.0569 9.0401 9.0401 k = 0.4565-0.0676-0.0567 ( 13340 PWs) bands (ev): -13.6340 -13.6340 -13.2968 -13.2968 -13.0698 -13.0698 -12.5040 -12.5040 -12.2387 -12.2387 -12.2132 -12.2132 -12.0417 -12.0417 -11.7429 -11.7429 -10.4772 -10.4772 -9.8033 -9.8033 -8.8365 -8.8365 -6.6272 -6.6272 -3.2363 -3.2363 -2.8687 -2.8687 -2.7876 -2.7876 -2.6741 -2.6741 -2.4830 -2.4830 -2.2870 -2.2870 -1.4471 -1.4471 -1.0970 -1.0970 -0.9282 -0.9282 -0.6919 -0.6919 -0.5861 -0.5861 -0.2977 -0.2977 -0.2334 -0.2334 -0.1556 -0.1556 -0.0967 -0.0967 0.2259 0.2259 0.3145 0.3145 0.3745 0.3745 0.5160 0.5160 0.5576 0.5576 0.6101 0.6101 0.7194 0.7194 0.7694 0.7694 0.9046 0.9046 0.9999 0.9999 1.0720 1.0720 1.5041 1.5041 1.6284 1.6284 2.1597 2.1597 3.5182 3.5182 3.9194 3.9194 4.3091 4.3091 4.4176 4.4176 6.7728 6.7728 7.7009 7.7009 8.0518 8.0518 9.0344 9.0344 k = 0.4348-0.0644-0.0540 ( 13343 PWs) bands (ev): -13.6360 -13.6360 -13.2948 -13.2948 -13.0697 -13.0697 -12.5037 -12.5037 -12.2388 -12.2388 -12.2133 -12.2133 -12.0414 -12.0414 -11.7431 -11.7431 -10.4746 -10.4746 -9.8067 -9.8067 -8.8354 -8.8354 -6.6288 -6.6288 -3.2334 -3.2334 -2.8879 -2.8879 -2.7820 -2.7820 -2.6652 -2.6652 -2.4785 -2.4785 -2.2886 -2.2886 -1.4521 -1.4521 -1.0862 -1.0862 -0.9250 -0.9250 -0.6905 -0.6905 -0.5953 -0.5953 -0.3181 -0.3181 -0.2441 -0.2441 -0.1487 -0.1487 -0.0796 -0.0796 0.2133 0.2133 0.3218 0.3218 0.3826 0.3826 0.5067 0.5067 0.5623 0.5623 0.6126 0.6126 0.7144 0.7144 0.7761 0.7761 0.9096 0.9096 0.9928 0.9928 1.0829 1.0829 1.4995 1.4995 1.6342 1.6342 2.1603 2.1603 3.5166 3.5166 3.9205 3.9205 4.2994 4.2994 4.4228 4.4228 6.7763 6.7763 7.6972 7.6972 8.0435 8.0435 9.0241 9.0241 k = 0.4130-0.0611-0.0513 ( 13340 PWs) bands (ev): -13.6388 -13.6388 -13.2921 -13.2921 -13.0697 -13.0697 -12.5033 -12.5033 -12.2388 -12.2388 -12.2135 -12.2135 -12.0410 -12.0410 -11.7433 -11.7433 -10.4709 -10.4709 -9.8115 -9.8115 -8.8338 -8.8338 -6.6310 -6.6310 -3.2295 -3.2295 -2.9089 -2.9089 -2.7772 -2.7772 -2.6552 -2.6552 -2.4726 -2.4726 -2.2903 -2.2903 -1.4588 -1.4588 -1.0719 -1.0719 -0.9206 -0.9206 -0.6906 -0.6906 -0.6050 -0.6050 -0.3380 -0.3380 -0.2674 -0.2674 -0.1322 -0.1322 -0.0626 -0.0626 0.1991 0.1991 0.3274 0.3274 0.3937 0.3937 0.4990 0.4990 0.5635 0.5635 0.6165 0.6165 0.7082 0.7082 0.7848 0.7848 0.9145 0.9145 0.9876 0.9876 1.0949 1.0949 1.4936 1.4936 1.6419 1.6419 2.1610 2.1610 3.5143 3.5143 3.9220 3.9220 4.2876 4.2876 4.4284 4.4284 6.7811 6.7811 7.6921 7.6921 8.0326 8.0326 9.0081 9.0081 k = 0.3913-0.0579-0.0486 ( 13343 PWs) bands (ev): -13.6422 -13.6422 -13.2888 -13.2888 -13.0696 -13.0696 -12.5029 -12.5029 -12.2389 -12.2389 -12.2138 -12.2138 -12.0405 -12.0405 -11.7435 -11.7435 -10.4663 -10.4663 -9.8174 -9.8174 -8.8319 -8.8319 -6.6338 -6.6338 -3.2251 -3.2251 -2.9302 -2.9302 -2.7733 -2.7733 -2.6454 -2.6454 -2.4657 -2.4657 -2.2916 -2.2916 -1.4670 -1.4670 -1.0547 -1.0547 -0.9150 -0.9150 -0.6946 -0.6946 -0.6118 -0.6118 -0.3572 -0.3572 -0.2960 -0.2960 -0.1130 -0.1130 -0.0464 -0.0464 0.1846 0.1846 0.3304 0.3304 0.4071 0.4071 0.4933 0.4933 0.5616 0.5616 0.6217 0.6217 0.7011 0.7011 0.7949 0.7949 0.9175 0.9175 0.9865 0.9865 1.1072 1.1072 1.4867 1.4867 1.6511 1.6511 2.1617 2.1617 3.5113 3.5113 3.9239 3.9239 4.2747 4.2747 4.4339 4.4339 6.7869 6.7869 7.6858 7.6858 8.0198 8.0198 8.9858 8.9858 k = 0.3696-0.0547-0.0459 ( 13336 PWs) bands (ev): -13.6461 -13.6461 -13.2851 -13.2851 -13.0694 -13.0694 -12.5023 -12.5023 -12.2389 -12.2389 -12.2140 -12.2140 -12.0400 -12.0400 -11.7438 -11.7438 -10.4607 -10.4607 -9.8246 -9.8246 -8.8296 -8.8296 -6.6371 -6.6371 -3.2205 -3.2205 -2.9507 -2.9507 -2.7700 -2.7700 -2.6362 -2.6362 -2.4588 -2.4588 -2.2920 -2.2920 -1.4766 -1.4766 -1.0353 -1.0353 -0.9083 -0.9083 -0.7042 -0.7042 -0.6134 -0.6134 -0.3765 -0.3765 -0.3252 -0.3252 -0.0943 -0.0943 -0.0320 -0.0320 0.1707 0.1707 0.3312 0.3312 0.4212 0.4212 0.4899 0.4899 0.5575 0.5575 0.6274 0.6274 0.6939 0.6939 0.8058 0.8058 0.9165 0.9165 0.9911 0.9911 1.1195 1.1195 1.4792 1.4792 1.6618 1.6618 2.1623 2.1623 3.5077 3.5077 3.9262 3.9262 4.2614 4.2614 4.4389 4.4389 6.7935 6.7935 7.6784 7.6784 8.0057 8.0057 8.9570 8.9570 k = 0.3478-0.0515-0.0432 ( 13347 PWs) bands (ev): -13.6505 -13.6505 -13.2809 -13.2809 -13.0693 -13.0693 -12.5017 -12.5017 -12.2389 -12.2389 -12.2143 -12.2143 -12.0393 -12.0393 -11.7442 -11.7442 -10.4542 -10.4542 -9.8329 -9.8329 -8.8270 -8.8270 -6.6408 -6.6408 -3.2165 -3.2165 -2.9691 -2.9691 -2.7672 -2.7672 -2.6280 -2.6280 -2.4530 -2.4530 -2.2906 -2.2906 -1.4875 -1.4875 -1.0147 -1.0147 -0.9006 -0.9006 -0.7183 -0.7183 -0.6101 -0.6101 -0.3976 -0.3976 -0.3508 -0.3508 -0.0779 -0.0779 -0.0204 -0.0204 0.1589 0.1589 0.3309 0.3309 0.4347 0.4347 0.4887 0.4887 0.5519 0.5519 0.6332 0.6332 0.6871 0.6871 0.8166 0.8166 0.9117 0.9117 1.0008 1.0008 1.1317 1.1317 1.4712 1.4712 1.6738 1.6738 2.1626 2.1626 3.5035 3.5035 3.9289 3.9289 4.2480 4.2480 4.4432 4.4432 6.8006 6.8006 7.6702 7.6702 7.9910 7.9910 8.9221 8.9221 k = 0.3261-0.0483-0.0405 ( 13349 PWs) bands (ev): -13.6552 -13.6552 -13.2764 -13.2764 -13.0691 -13.0691 -12.5010 -12.5010 -12.2389 -12.2389 -12.2146 -12.2146 -12.0387 -12.0387 -11.7445 -11.7445 -10.4469 -10.4469 -9.8421 -9.8421 -8.8242 -8.8242 -6.6448 -6.6448 -3.2137 -3.2137 -2.9844 -2.9844 -2.7649 -2.7649 -2.6205 -2.6205 -2.4493 -2.4493 -2.2867 -2.2867 -1.4994 -1.4994 -0.9940 -0.9940 -0.8925 -0.8925 -0.7343 -0.7343 -0.6041 -0.6041 -0.4215 -0.4215 -0.3692 -0.3692 -0.0658 -0.0658 -0.0123 -0.0123 0.1500 0.1500 0.3306 0.3306 0.4460 0.4460 0.4897 0.4897 0.5460 0.5460 0.6383 0.6383 0.6818 0.6818 0.8269 0.8269 0.9047 0.9047 1.0136 1.0136 1.1438 1.1438 1.4628 1.4628 1.6872 1.6872 2.1625 2.1625 3.4987 3.4987 3.9319 3.9319 4.2351 4.2351 4.4467 4.4467 6.8079 6.8079 7.6614 7.6614 7.9765 7.9765 8.8820 8.8820 k = 0.3043-0.0451-0.0378 ( 13351 PWs) bands (ev): -13.6600 -13.6600 -13.2718 -13.2718 -13.0689 -13.0689 -12.5002 -12.5002 -12.2389 -12.2389 -12.2149 -12.2149 -12.0381 -12.0381 -11.7449 -11.7449 -10.4389 -10.4389 -9.8522 -9.8522 -8.8212 -8.8212 -6.6492 -6.6492 -3.2132 -3.2132 -2.9955 -2.9955 -2.7631 -2.7631 -2.6137 -2.6137 -2.4487 -2.4487 -2.2799 -2.2799 -1.5125 -1.5125 -0.9745 -0.9745 -0.8847 -0.8847 -0.7493 -0.7493 -0.5979 -0.5979 -0.4463 -0.4463 -0.3800 -0.3800 -0.0603 -0.0603 -0.0069 -0.0069 0.1442 0.1442 0.3314 0.3314 0.4543 0.4543 0.4917 0.4917 0.5411 0.5411 0.6415 0.6415 0.6795 0.6795 0.8359 0.8359 0.8967 0.8967 1.0273 1.0273 1.1561 1.1561 1.4542 1.4542 1.7018 1.7018 2.1618 2.1618 3.4933 3.4933 3.9353 3.9353 4.2231 4.2231 4.4494 4.4494 6.8151 6.8151 7.6523 7.6523 7.9627 7.9627 8.8380 8.8380 k = 0.2826-0.0418-0.0351 ( 13353 PWs) bands (ev): -13.6650 -13.6650 -13.2671 -13.2671 -13.0687 -13.0687 -12.4995 -12.4995 -12.2389 -12.2389 -12.2152 -12.2152 -12.0374 -12.0374 -11.7454 -11.7454 -10.4301 -10.4301 -9.8631 -9.8631 -8.8181 -8.8181 -6.6537 -6.6537 -3.2155 -3.2155 -3.0015 -3.0015 -2.7620 -2.7620 -2.6074 -2.6074 -2.4511 -2.4511 -2.2702 -2.2702 -1.5265 -1.5265 -0.9580 -0.9580 -0.8781 -0.8781 -0.7607 -0.7607 -0.5934 -0.5934 -0.4684 -0.4684 -0.3840 -0.3840 -0.0630 -0.0630 -0.0025 -0.0025 0.1404 0.1404 0.3342 0.3342 0.4595 0.4595 0.4921 0.4921 0.5400 0.5400 0.6419 0.6419 0.6818 0.6818 0.8429 0.8429 0.8891 0.8891 1.0403 1.0403 1.1687 1.1687 1.4455 1.4455 1.7176 1.7176 2.1602 2.1602 3.4874 3.4874 3.9389 3.9389 4.2121 4.2121 4.4514 4.4514 6.8218 6.8218 7.6432 7.6432 7.9501 7.9501 8.7913 8.7913 k = 0.2609-0.0386-0.0324 ( 13350 PWs) bands (ev): -13.6700 -13.6700 -13.2624 -13.2624 -13.0685 -13.0685 -12.4987 -12.4987 -12.2389 -12.2389 -12.2154 -12.2154 -12.0368 -12.0368 -11.7458 -11.7458 -10.4208 -10.4208 -9.8745 -9.8745 -8.8149 -8.8149 -6.6584 -6.6584 -3.2209 -3.2209 -3.0020 -3.0020 -2.7614 -2.7614 -2.6015 -2.6015 -2.4564 -2.4564 -2.2581 -2.2581 -1.5413 -1.5413 -0.9467 -0.9467 -0.8730 -0.8730 -0.7672 -0.7672 -0.5914 -0.5914 -0.4851 -0.4851 -0.3819 -0.3819 -0.0734 -0.0734 0.0014 0.0014 0.1371 0.1371 0.3392 0.3392 0.4622 0.4622 0.4891 0.4891 0.5442 0.5442 0.6400 0.6400 0.6879 0.6879 0.8463 0.8463 0.8837 0.8837 1.0515 1.0515 1.1820 1.1820 1.4368 1.4368 1.7345 1.7345 2.1577 2.1577 3.4812 3.4812 3.9428 3.9428 4.2025 4.2025 4.4528 4.4528 6.8278 6.8278 7.6344 7.6344 7.9390 7.9390 8.7429 8.7429 k = 0.2391-0.0354-0.0297 ( 13351 PWs) bands (ev): -13.6750 -13.6750 -13.2578 -13.2578 -13.0683 -13.0683 -12.4979 -12.4979 -12.2388 -12.2388 -12.2155 -12.2155 -12.0362 -12.0362 -11.7463 -11.7463 -10.4111 -10.4111 -9.8864 -9.8864 -8.8118 -8.8118 -6.6631 -6.6631 -3.2291 -3.2291 -2.9974 -2.9974 -2.7613 -2.7613 -2.5962 -2.5962 -2.4636 -2.4636 -2.2444 -2.2444 -1.5570 -1.5570 -0.9432 -0.9432 -0.8677 -0.8677 -0.7694 -0.7694 -0.5906 -0.5906 -0.4956 -0.4956 -0.3738 -0.3738 -0.0890 -0.0890 0.0038 0.0038 0.1328 0.1328 0.3459 0.3459 0.4605 0.4605 0.4862 0.4862 0.5526 0.5526 0.6376 0.6376 0.6963 0.6963 0.8447 0.8447 0.8820 0.8820 1.0598 1.0598 1.1959 1.1959 1.4283 1.4283 1.7523 1.7523 2.1542 2.1542 3.4746 3.4746 3.9467 3.9467 4.1944 4.1944 4.4535 4.4535 6.8328 6.8328 7.6263 7.6263 7.9298 7.9298 8.6939 8.6939 k = 0.2174-0.0322-0.0270 ( 13351 PWs) bands (ev): -13.6797 -13.6797 -13.2534 -13.2534 -13.0681 -13.0681 -12.4972 -12.4972 -12.2387 -12.2387 -12.2157 -12.2157 -12.0357 -12.0357 -11.7467 -11.7467 -10.4010 -10.4010 -9.8986 -9.8986 -8.8087 -8.8087 -6.6677 -6.6677 -3.2394 -3.2394 -2.9884 -2.9884 -2.7618 -2.7618 -2.5919 -2.5919 -2.4719 -2.4719 -2.2298 -2.2298 -1.5732 -1.5732 -0.9480 -0.9480 -0.8605 -0.8605 -0.7703 -0.7703 -0.5881 -0.5881 -0.5011 -0.5011 -0.3606 -0.3606 -0.1075 -0.1075 0.0039 0.0039 0.1269 0.1269 0.3529 0.3529 0.4524 0.4524 0.4884 0.4884 0.5630 0.5630 0.6360 0.6360 0.7056 0.7056 0.8389 0.8389 0.8835 0.8835 1.0650 1.0650 1.2105 1.2105 1.4203 1.4203 1.7707 1.7707 2.1495 2.1495 3.4677 3.4677 3.9508 3.9508 4.1879 4.1879 4.4538 4.4538 6.8367 6.8367 7.6191 7.6191 7.9225 7.9225 8.6454 8.6454 k = 0.1957-0.0290-0.0243 ( 13353 PWs) bands (ev): -13.6842 -13.6842 -13.2492 -13.2492 -13.0679 -13.0679 -12.4964 -12.4964 -12.2386 -12.2386 -12.2157 -12.2157 -12.0352 -12.0352 -11.7472 -11.7472 -10.3908 -10.3908 -9.9108 -9.9108 -8.8058 -8.8058 -6.6721 -6.6721 -3.2509 -3.2509 -2.9759 -2.9759 -2.7628 -2.7628 -2.5891 -2.5891 -2.4801 -2.4801 -2.2148 -2.2148 -1.5898 -1.5898 -0.9587 -0.9587 -0.8526 -0.8526 -0.7719 -0.7719 -0.5814 -0.5814 -0.5026 -0.5026 -0.3432 -0.3432 -0.1271 -0.1271 0.0011 0.0011 0.1194 0.1194 0.3586 0.3586 0.4403 0.4403 0.4954 0.4954 0.5742 0.5742 0.6356 0.6356 0.7148 0.7148 0.8313 0.8313 0.8862 0.8862 1.0668 1.0668 1.2253 1.2253 1.4130 1.4130 1.7896 1.7896 2.1436 2.1436 3.4608 3.4608 3.9547 3.9547 4.1829 4.1829 4.4537 4.4537 6.8393 6.8393 7.6130 7.6130 7.9171 7.9171 8.5981 8.5981 k = 0.1739-0.0257-0.0216 ( 13357 PWs) bands (ev): -13.6884 -13.6884 -13.2454 -13.2454 -13.0676 -13.0676 -12.4957 -12.4957 -12.2385 -12.2385 -12.2157 -12.2157 -12.0348 -12.0348 -11.7476 -11.7476 -10.3806 -10.3806 -9.9228 -9.9228 -8.8030 -8.8030 -6.6764 -6.6764 -3.2627 -3.2627 -2.9608 -2.9608 -2.7643 -2.7643 -2.5887 -2.5887 -2.4872 -2.4872 -2.2000 -2.2000 -1.6065 -1.6065 -0.9721 -0.9721 -0.8468 -0.8468 -0.7732 -0.7732 -0.5711 -0.5711 -0.5008 -0.5008 -0.3227 -0.3227 -0.1463 -0.1463 -0.0046 -0.0046 0.1106 0.1106 0.3613 0.3613 0.4276 0.4276 0.5056 0.5056 0.5855 0.5855 0.6371 0.6371 0.7232 0.7232 0.8236 0.8236 0.8887 0.8887 1.0654 1.0654 1.2401 1.2401 1.4064 1.4064 1.8086 1.8086 2.1366 2.1366 3.4540 3.4540 3.9586 3.9586 4.1793 4.1793 4.4533 4.4533 6.8409 6.8409 7.6081 7.6081 7.9135 7.9135 8.5530 8.5530 k = 0.1522-0.0225-0.0189 ( 13356 PWs) bands (ev): -13.6923 -13.6923 -13.2419 -13.2419 -13.0674 -13.0674 -12.4951 -12.4951 -12.2384 -12.2384 -12.2157 -12.2157 -12.0344 -12.0344 -11.7480 -11.7480 -10.3707 -10.3707 -9.9345 -9.9345 -8.8004 -8.8004 -6.6803 -6.6803 -3.2742 -3.2742 -2.9439 -2.9439 -2.7662 -2.7662 -2.5914 -2.5914 -2.4921 -2.4921 -2.1858 -2.1858 -1.6229 -1.6229 -0.9864 -0.9864 -0.8455 -0.8455 -0.7717 -0.7717 -0.5595 -0.5595 -0.4955 -0.4955 -0.3005 -0.3005 -0.1638 -0.1638 -0.0133 -0.0133 0.1010 0.1010 0.3594 0.3594 0.4166 0.4166 0.5177 0.5177 0.5965 0.5965 0.6408 0.6408 0.7298 0.7298 0.8172 0.8172 0.8904 0.8904 1.0614 1.0614 1.2545 1.2545 1.4005 1.4005 1.8275 1.8275 2.1287 2.1287 3.4474 3.4474 3.9623 3.9623 4.1771 4.1771 4.4527 4.4527 6.8413 6.8413 7.6045 7.6045 7.9115 7.9115 8.5107 8.5107 k = 0.1304-0.0193-0.0162 ( 13359 PWs) bands (ev): -13.6957 -13.6957 -13.2388 -13.2388 -13.0672 -13.0672 -12.4945 -12.4945 -12.2383 -12.2383 -12.2156 -12.2156 -12.0341 -12.0341 -11.7484 -11.7484 -10.3612 -10.3612 -9.9456 -9.9456 -8.7981 -8.7981 -6.6839 -6.6839 -3.2849 -3.2849 -2.9259 -2.9259 -2.7687 -2.7687 -2.5973 -2.5973 -2.4945 -2.4945 -2.1725 -2.1725 -1.6387 -1.6387 -1.0001 -1.0001 -0.8492 -0.8492 -0.7661 -0.7661 -0.5492 -0.5492 -0.4870 -0.4870 -0.2776 -0.2776 -0.1781 -0.1781 -0.0247 -0.0247 0.0910 0.0910 0.3523 0.3523 0.4089 0.4089 0.5303 0.5303 0.6068 0.6068 0.6467 0.6467 0.7338 0.7338 0.8134 0.8134 0.8907 0.8907 1.0552 1.0552 1.2682 1.2682 1.3954 1.3954 1.8457 1.8457 2.1199 2.1199 3.4412 3.4412 3.9657 3.9657 4.1759 4.1759 4.4521 4.4521 6.8409 6.8409 7.6020 7.6020 7.9109 7.9109 8.4721 8.4721 k = 0.1087-0.0161-0.0135 ( 13364 PWs) bands (ev): -13.6986 -13.6986 -13.2361 -13.2361 -13.0671 -13.0671 -12.4940 -12.4940 -12.2382 -12.2382 -12.2155 -12.2155 -12.0339 -12.0339 -11.7487 -11.7487 -10.3525 -10.3525 -9.9557 -9.9557 -8.7961 -8.7961 -6.6870 -6.6870 -3.2944 -3.2944 -2.9074 -2.9074 -2.7717 -2.7717 -2.6056 -2.6056 -2.4947 -2.4947 -2.1604 -2.1604 -1.6533 -1.6533 -1.0127 -1.0127 -0.8559 -0.8559 -0.7578 -0.7578 -0.5409 -0.5409 -0.4770 -0.4770 -0.2553 -0.2553 -0.1877 -0.1877 -0.0384 -0.0384 0.0810 0.0810 0.3412 0.3412 0.4045 0.4045 0.5423 0.5423 0.6163 0.6163 0.6546 0.6546 0.7344 0.7344 0.8131 0.8131 0.8894 0.8894 1.0476 1.0476 1.2808 1.2808 1.3910 1.3910 1.8631 1.8631 2.1107 2.1107 3.4356 3.4356 3.9688 3.9688 4.1756 4.1756 4.4513 4.4513 6.8400 6.8400 7.6004 7.6004 7.9113 7.9113 8.4379 8.4379 k = 0.0870-0.0129-0.0108 ( 13362 PWs) bands (ev): -13.7011 -13.7011 -13.2339 -13.2339 -13.0669 -13.0669 -12.4936 -12.4936 -12.2381 -12.2381 -12.2154 -12.2154 -12.0337 -12.0337 -11.7490 -11.7490 -10.3447 -10.3447 -9.9645 -9.9645 -8.7944 -8.7944 -6.6896 -6.6896 -3.3025 -3.3025 -2.8891 -2.8891 -2.7755 -2.7755 -2.6153 -2.6153 -2.4935 -2.4935 -2.1500 -2.1500 -1.6663 -1.6663 -1.0235 -1.0235 -0.8634 -0.8634 -0.7487 -0.7487 -0.5342 -0.5342 -0.4682 -0.4682 -0.2348 -0.2348 -0.1913 -0.1913 -0.0539 -0.0539 0.0715 0.0715 0.3287 0.3287 0.4020 0.4020 0.5526 0.5526 0.6251 0.6251 0.6634 0.6634 0.7321 0.7321 0.8166 0.8166 0.8861 0.8861 1.0396 1.0396 1.2922 1.2922 1.3870 1.3870 1.8789 1.8789 2.1015 2.1015 3.4307 3.4307 3.9715 3.9715 4.1758 4.1758 4.4506 4.4506 6.8387 6.8387 7.5995 7.5995 7.9124 7.9124 8.4086 8.4086 k = 0.0652-0.0097-0.0081 ( 13357 PWs) bands (ev): -13.7031 -13.7031 -13.2321 -13.2321 -13.0668 -13.0668 -12.4933 -12.4933 -12.2381 -12.2381 -12.2152 -12.2152 -12.0336 -12.0336 -11.7492 -11.7492 -10.3383 -10.3383 -9.9718 -9.9718 -8.7930 -8.7930 -6.6917 -6.6917 -3.3089 -3.3089 -2.8716 -2.8716 -2.7801 -2.7801 -2.6248 -2.6248 -2.4917 -2.4917 -2.1414 -2.1414 -1.6771 -1.6771 -1.0322 -1.0322 -0.8703 -0.8703 -0.7403 -0.7403 -0.5284 -0.5284 -0.4624 -0.4624 -0.2172 -0.2172 -0.1889 -0.1889 -0.0703 -0.0703 0.0628 0.0628 0.3170 0.3170 0.4005 0.4005 0.5606 0.5606 0.6335 0.6335 0.6712 0.6712 0.7285 0.7285 0.8232 0.8232 0.8807 0.8807 1.0321 1.0321 1.3019 1.3019 1.3835 1.3835 1.8927 1.8927 2.0929 2.0929 3.4268 3.4268 3.9736 3.9736 4.1762 4.1762 4.4500 4.4500 6.8373 6.8373 7.5991 7.5991 7.9139 7.9139 8.3851 8.3851 k = 0.0435-0.0064-0.0054 ( 13363 PWs) bands (ev): -13.7045 -13.7045 -13.2309 -13.2309 -13.0667 -13.0667 -12.4930 -12.4930 -12.2381 -12.2381 -12.2151 -12.2151 -12.0335 -12.0335 -11.7493 -11.7493 -10.3335 -10.3335 -9.9773 -9.9773 -8.7920 -8.7920 -6.6933 -6.6933 -3.3136 -3.3136 -2.8561 -2.8561 -2.7854 -2.7854 -2.6328 -2.6328 -2.4900 -2.4900 -2.1350 -2.1350 -1.6852 -1.6852 -1.0385 -1.0385 -0.8756 -0.8756 -0.7335 -0.7335 -0.5234 -0.5234 -0.4600 -0.4600 -0.2023 -0.2023 -0.1830 -0.1830 -0.0861 -0.0861 0.0557 0.0557 0.3075 0.3075 0.3995 0.3995 0.5662 0.5662 0.6412 0.6412 0.6764 0.6764 0.7251 0.7251 0.8321 0.8321 0.8732 0.8732 1.0260 1.0260 1.3095 1.3095 1.3805 1.3805 1.9036 1.9036 2.0857 2.0857 3.4238 3.4238 3.9752 3.9752 4.1767 4.1767 4.4496 4.4496 6.8362 6.8362 7.5990 7.5990 7.9153 7.9153 8.3677 8.3677 k = 0.0217-0.0032-0.0027 ( 13357 PWs) bands (ev): -13.7053 -13.7053 -13.2301 -13.2301 -13.0667 -13.0667 -12.4929 -12.4929 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7494 -11.7494 -10.3305 -10.3305 -9.9807 -9.9807 -8.7914 -8.7914 -6.6942 -6.6942 -3.3165 -3.3165 -2.8444 -2.8444 -2.7905 -2.7905 -2.6382 -2.6382 -2.4888 -2.4888 -2.1310 -2.1310 -1.6903 -1.6903 -1.0424 -1.0424 -0.8789 -0.8789 -0.7292 -0.7292 -0.5197 -0.5197 -0.4598 -0.4598 -0.1897 -0.1897 -0.1790 -0.1790 -0.0985 -0.0985 0.0509 0.0509 0.3014 0.3014 0.3990 0.3990 0.5695 0.5695 0.6473 0.6473 0.6783 0.6783 0.7233 0.7233 0.8424 0.8424 0.8639 0.8639 1.0221 1.0221 1.3145 1.3145 1.3784 1.3784 1.9106 1.9106 2.0809 2.0809 3.4220 3.4220 3.9762 3.9762 4.1771 4.1771 4.4493 4.4493 6.8354 6.8354 7.5991 7.5991 7.9162 7.9162 8.3571 8.3571 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0219-0.0002 ( 13355 PWs) bands (ev): -13.7054 -13.7054 -13.2298 -13.2298 -13.0668 -13.0668 -12.4931 -12.4931 -12.2380 -12.2380 -12.2151 -12.2151 -12.0332 -12.0332 -11.7495 -11.7495 -10.3297 -10.3297 -9.9814 -9.9814 -8.7915 -8.7915 -6.6943 -6.6943 -3.3174 -3.3174 -2.8409 -2.8409 -2.7924 -2.7924 -2.6396 -2.6396 -2.4881 -2.4881 -2.1301 -2.1301 -1.6898 -1.6898 -1.0434 -1.0434 -0.8801 -0.8801 -0.7273 -0.7273 -0.5258 -0.5258 -0.4532 -0.4532 -0.1884 -0.1884 -0.1738 -0.1738 -0.1036 -0.1036 0.0497 0.0497 0.2988 0.2988 0.3984 0.3984 0.5690 0.5690 0.6487 0.6487 0.6788 0.6788 0.7229 0.7229 0.8516 0.8516 0.8548 0.8548 1.0213 1.0213 1.3155 1.3155 1.3782 1.3782 1.9107 1.9107 2.0800 2.0800 3.4219 3.4219 3.9764 3.9764 4.1775 4.1775 4.4493 4.4493 6.8359 6.8359 7.5985 7.5985 7.9166 7.9166 8.3569 8.3569 k = 0.0000 0.0438-0.0005 ( 13361 PWs) bands (ev): -13.7048 -13.7048 -13.2296 -13.2296 -13.0674 -13.0674 -12.4941 -12.4941 -12.2381 -12.2381 -12.2152 -12.2152 -12.0328 -12.0328 -11.7495 -11.7495 -10.3305 -10.3305 -9.9801 -9.9801 -8.7921 -8.7921 -6.6936 -6.6936 -3.3174 -3.3174 -2.8442 -2.8442 -2.7908 -2.7908 -2.6383 -2.6383 -2.4873 -2.4873 -2.1315 -2.1315 -1.6833 -1.6833 -1.0425 -1.0425 -0.8802 -0.8802 -0.7258 -0.7258 -0.5425 -0.5425 -0.4386 -0.4386 -0.1955 -0.1955 -0.1668 -0.1668 -0.1037 -0.1037 0.0509 0.0509 0.2975 0.2975 0.3972 0.3972 0.5643 0.5643 0.6462 0.6462 0.6793 0.6793 0.7232 0.7232 0.8485 0.8485 0.8574 0.8574 1.0230 1.0230 1.3131 1.3131 1.3798 1.3798 1.9040 1.9040 2.0824 2.0824 3.4234 3.4234 3.9761 3.9761 4.1783 4.1783 4.4496 4.4496 6.8382 6.8382 7.5967 7.5967 7.9166 7.9166 8.3668 8.3668 k = 0.0000 0.0657-0.0007 ( 13361 PWs) bands (ev): -13.7037 -13.7037 -13.2292 -13.2292 -13.0683 -13.0683 -12.4956 -12.4956 -12.2382 -12.2382 -12.2153 -12.2153 -12.0320 -12.0320 -11.7495 -11.7495 -10.3317 -10.3317 -9.9779 -9.9779 -8.7932 -8.7932 -6.6924 -6.6924 -3.3172 -3.3172 -2.8492 -2.8492 -2.7886 -2.7886 -2.6363 -2.6363 -2.4859 -2.4859 -2.1336 -2.1336 -1.6725 -1.6725 -1.0411 -1.0411 -0.8805 -0.8805 -0.7233 -0.7233 -0.5624 -0.5624 -0.4226 -0.4226 -0.2022 -0.2022 -0.1603 -0.1603 -0.1036 -0.1036 0.0528 0.0528 0.2952 0.2952 0.3948 0.3948 0.5569 0.5569 0.6424 0.6424 0.6796 0.6796 0.7237 0.7237 0.8436 0.8436 0.8616 0.8616 1.0258 1.0258 1.3093 1.3093 1.3823 1.3823 1.8933 1.8933 2.0859 2.0859 3.4259 3.4259 3.9757 3.9757 4.1797 4.1797 4.4502 4.4502 6.8421 6.8421 7.5937 7.5937 7.9167 7.9167 8.3832 8.3832 k = 0.0000 0.0876-0.0009 ( 13370 PWs) bands (ev): -13.7023 -13.7023 -13.2287 -13.2287 -13.0695 -13.0695 -12.4977 -12.4977 -12.2383 -12.2383 -12.2155 -12.2155 -12.0310 -12.0310 -11.7496 -11.7496 -10.3334 -10.3334 -9.9750 -9.9750 -8.7947 -8.7947 -6.6908 -6.6908 -3.3171 -3.3171 -2.8556 -2.8556 -2.7859 -2.7859 -2.6337 -2.6337 -2.4840 -2.4840 -2.1364 -2.1364 -1.6578 -1.6578 -1.0392 -1.0392 -0.8811 -0.8811 -0.7198 -0.7198 -0.5832 -0.5832 -0.4077 -0.4077 -0.2078 -0.2078 -0.1548 -0.1548 -0.1029 -0.1029 0.0555 0.0555 0.2921 0.2921 0.3910 0.3910 0.5474 0.5474 0.6379 0.6379 0.6792 0.6792 0.7245 0.7245 0.8371 0.8371 0.8672 0.8672 1.0295 1.0295 1.3044 1.3044 1.3854 1.3854 1.8793 1.8793 2.0898 2.0898 3.4292 3.4292 3.9751 3.9751 4.1814 4.1814 4.4509 4.4509 6.8474 6.8474 7.5897 7.5897 7.9169 7.9169 8.4059 8.4059 k = 0.0000 0.1095-0.0011 ( 13373 PWs) bands (ev): -13.7005 -13.7005 -13.2281 -13.2281 -13.0710 -13.0710 -12.5004 -12.5004 -12.2385 -12.2385 -12.2157 -12.2157 -12.0298 -12.0298 -11.7496 -11.7496 -10.3354 -10.3354 -9.9713 -9.9713 -8.7966 -8.7966 -6.6889 -6.6889 -3.3168 -3.3168 -2.8629 -2.8629 -2.7828 -2.7828 -2.6307 -2.6307 -2.4816 -2.4816 -2.1398 -2.1398 -1.6394 -1.6394 -1.0368 -1.0368 -0.8820 -0.8820 -0.7153 -0.7153 -0.6039 -0.6039 -0.3953 -0.3953 -0.2118 -0.2118 -0.1508 -0.1508 -0.1010 -0.1010 0.0587 0.0587 0.2881 0.2881 0.3854 0.3854 0.5363 0.5363 0.6329 0.6329 0.6781 0.6781 0.7254 0.7254 0.8296 0.8296 0.8738 0.8738 1.0340 1.0340 1.2983 1.2983 1.3889 1.3889 1.8629 1.8629 2.0937 2.0937 3.4333 3.4333 3.9745 3.9745 4.1836 4.1836 4.4520 4.4520 6.8541 6.8541 7.5847 7.5847 7.9175 7.9175 8.4345 8.4345 k = 0.0000 0.1314-0.0014 ( 13366 PWs) bands (ev): -13.6983 -13.6983 -13.2275 -13.2275 -13.0728 -13.0728 -12.5036 -12.5036 -12.2386 -12.2386 -12.2158 -12.2158 -12.0284 -12.0284 -11.7497 -11.7497 -10.3378 -10.3378 -9.9670 -9.9670 -8.7988 -8.7988 -6.6865 -6.6865 -3.3166 -3.3166 -2.8709 -2.8709 -2.7795 -2.7795 -2.6274 -2.6274 -2.4787 -2.4787 -2.1437 -2.1437 -1.6175 -1.6175 -1.0339 -1.0339 -0.8835 -0.8835 -0.7104 -0.7104 -0.6231 -0.6231 -0.3865 -0.3865 -0.2134 -0.2134 -0.1488 -0.1488 -0.0974 -0.0974 0.0625 0.0625 0.2833 0.2833 0.3777 0.3777 0.5240 0.5240 0.6277 0.6277 0.6767 0.6767 0.7260 0.7260 0.8214 0.8214 0.8813 0.8813 1.0392 1.0392 1.2913 1.2913 1.3927 1.3927 1.8446 1.8446 2.0972 2.0972 3.4381 3.4381 3.9738 3.9738 4.1860 4.1860 4.4532 4.4532 6.8619 6.8619 7.5788 7.5788 7.9184 7.9184 8.4688 8.4688 k = 0.0000 0.1533-0.0016 ( 13354 PWs) bands (ev): -13.6958 -13.6958 -13.2268 -13.2268 -13.0748 -13.0748 -12.5072 -12.5072 -12.2388 -12.2388 -12.2160 -12.2160 -12.0270 -12.0270 -11.7498 -11.7498 -10.3405 -10.3405 -9.9621 -9.9621 -8.8013 -8.8013 -6.6839 -6.6839 -3.3164 -3.3164 -2.8792 -2.8792 -2.7761 -2.7761 -2.6239 -2.6239 -2.4754 -2.4754 -2.1479 -2.1479 -1.5926 -1.5926 -1.0305 -1.0305 -0.8857 -0.8857 -0.7073 -0.7073 -0.6384 -0.6384 -0.3821 -0.3821 -0.2124 -0.2124 -0.1490 -0.1490 -0.0922 -0.0922 0.0667 0.0667 0.2778 0.2778 0.3677 0.3677 0.5109 0.5109 0.6223 0.6223 0.6754 0.6754 0.7261 0.7261 0.8132 0.8132 0.8894 0.8894 1.0448 1.0448 1.2834 1.2834 1.3968 1.3968 1.8249 1.8249 2.1000 2.1000 3.4433 3.4433 3.9733 3.9733 4.1887 4.1887 4.4547 4.4547 6.8708 6.8708 7.5723 7.5723 7.9199 7.9199 8.5083 8.5083 k = 0.0000 0.1752-0.0018 ( 13349 PWs) bands (ev): -13.6931 -13.6931 -13.2261 -13.2261 -13.0769 -13.0769 -12.5113 -12.5113 -12.2389 -12.2389 -12.2161 -12.2161 -12.0254 -12.0254 -11.7498 -11.7498 -10.3433 -10.3433 -9.9568 -9.9568 -8.8041 -8.8041 -6.6809 -6.6809 -3.3161 -3.3161 -2.8878 -2.8878 -2.7725 -2.7725 -2.6204 -2.6204 -2.4716 -2.4716 -2.1524 -2.1524 -1.5650 -1.5650 -1.0267 -1.0267 -0.8885 -0.8885 -0.7104 -0.7104 -0.6451 -0.6451 -0.3820 -0.3820 -0.2089 -0.2089 -0.1513 -0.1513 -0.0856 -0.0856 0.0711 0.0711 0.2717 0.2717 0.3556 0.3556 0.4973 0.4973 0.6166 0.6166 0.6746 0.6746 0.7254 0.7254 0.8056 0.8056 0.8979 0.8979 1.0506 1.0506 1.2745 1.2745 1.4009 1.4009 1.8044 1.8044 2.1020 2.1020 3.4490 3.4490 3.9728 3.9728 4.1914 4.1914 4.4563 4.4563 6.8806 6.8806 7.5654 7.5654 7.9220 7.9220 8.5526 8.5526 k = 0.0000 0.1971-0.0020 ( 13345 PWs) bands (ev): -13.6901 -13.6901 -13.2254 -13.2254 -13.0792 -13.0792 -12.5156 -12.5156 -12.2389 -12.2389 -12.2162 -12.2162 -12.0238 -12.0238 -11.7499 -11.7499 -10.3463 -10.3463 -9.9512 -9.9512 -8.8071 -8.8071 -6.6778 -6.6778 -3.3159 -3.3159 -2.8964 -2.8964 -2.7688 -2.7688 -2.6170 -2.6170 -2.4675 -2.4675 -2.1570 -2.1570 -1.5350 -1.5350 -1.0223 -1.0223 -0.8920 -0.8920 -0.7221 -0.7221 -0.6406 -0.6406 -0.3854 -0.3854 -0.2041 -0.2041 -0.1553 -0.1553 -0.0783 -0.0783 0.0757 0.0757 0.2651 0.2651 0.3418 0.3418 0.4835 0.4835 0.6105 0.6105 0.6745 0.6745 0.7236 0.7236 0.7991 0.7991 0.9067 0.9067 1.0566 1.0566 1.2647 1.2647 1.4051 1.4051 1.7835 1.7835 2.1031 2.1031 3.4550 3.4550 3.9725 3.9725 4.1942 4.1942 4.4582 4.4582 6.8909 6.8909 7.5582 7.5582 7.9247 7.9247 8.6012 8.6012 k = 0.0000 0.2190-0.0023 ( 13350 PWs) bands (ev): -13.6869 -13.6869 -13.2247 -13.2247 -13.0815 -13.0815 -12.5202 -12.5202 -12.2390 -12.2390 -12.2162 -12.2162 -12.0222 -12.0222 -11.7499 -11.7499 -10.3493 -10.3493 -9.9453 -9.9453 -8.8103 -8.8103 -6.6745 -6.6745 -3.3156 -3.3156 -2.9048 -2.9048 -2.7649 -2.7649 -2.6136 -2.6136 -2.4632 -2.4632 -2.1618 -2.1618 -1.5031 -1.5031 -1.0175 -1.0175 -0.8961 -0.8961 -0.7389 -0.7389 -0.6281 -0.6281 -0.3914 -0.3914 -0.1992 -0.1992 -0.1609 -0.1609 -0.0706 -0.0706 0.0800 0.0800 0.2581 0.2581 0.3271 0.3271 0.4698 0.4698 0.6041 0.6041 0.6751 0.6751 0.7207 0.7207 0.7941 0.7941 0.9156 0.9156 1.0625 1.0625 1.2539 1.2539 1.4093 1.4093 1.7626 1.7626 2.1033 2.1033 3.4610 3.4610 3.9724 3.9724 4.1970 4.1970 4.4603 4.4603 6.9015 6.9015 7.5512 7.5512 7.9280 7.9280 8.6535 8.6535 k = 0.0000 0.2409-0.0025 ( 13356 PWs) bands (ev): -13.6835 -13.6835 -13.2242 -13.2242 -13.0838 -13.0838 -12.5250 -12.5250 -12.2390 -12.2390 -12.2162 -12.2162 -12.0207 -12.0207 -11.7500 -11.7500 -10.3524 -10.3524 -9.9394 -9.9394 -8.8136 -8.8136 -6.6711 -6.6711 -3.3154 -3.3154 -2.9130 -2.9130 -2.7610 -2.7610 -2.6103 -2.6103 -2.4587 -2.4587 -2.1665 -2.1665 -1.4697 -1.4697 -1.0122 -1.0122 -0.9007 -0.9007 -0.7573 -0.7573 -0.6111 -0.6111 -0.3987 -0.3987 -0.1961 -0.1961 -0.1676 -0.1676 -0.0630 -0.0630 0.0836 0.0836 0.2511 0.2511 0.3124 0.3124 0.4564 0.4564 0.5974 0.5974 0.6758 0.6758 0.7173 0.7173 0.7909 0.7909 0.9244 0.9244 1.0681 1.0681 1.2421 1.2421 1.4135 1.4135 1.7420 1.7420 2.1027 2.1027 3.4671 3.4671 3.9725 3.9725 4.1996 4.1996 4.4626 4.4626 6.9120 6.9120 7.5445 7.5445 7.9319 7.9319 8.7091 8.7091 k = 0.0000 0.2629-0.0027 ( 13360 PWs) bands (ev): -13.6801 -13.6801 -13.2237 -13.2237 -13.0860 -13.0860 -12.5298 -12.5298 -12.2389 -12.2389 -12.2161 -12.2161 -12.0193 -12.0193 -11.7500 -11.7500 -10.3554 -10.3554 -9.9334 -9.9334 -8.8170 -8.8170 -6.6676 -6.6676 -3.3152 -3.3152 -2.9207 -2.9207 -2.7571 -2.7571 -2.6071 -2.6071 -2.4541 -2.4541 -2.1713 -2.1713 -1.4352 -1.4352 -1.0066 -1.0066 -0.9061 -0.9061 -0.7754 -0.7754 -0.5914 -0.5914 -0.4063 -0.4063 -0.1976 -0.1976 -0.1739 -0.1739 -0.0554 -0.0554 0.0857 0.0857 0.2444 0.2444 0.2987 0.2987 0.4439 0.4439 0.5907 0.5907 0.6758 0.6758 0.7143 0.7143 0.7894 0.7894 0.9332 0.9332 1.0734 1.0734 1.2292 1.2292 1.4176 1.4176 1.7223 1.7223 2.1013 2.1013 3.4731 3.4731 3.9728 3.9728 4.2021 4.2021 4.4650 4.4650 6.9222 6.9222 7.5384 7.5384 7.9364 7.9364 8.7673 8.7673 k = 0.0000 0.2848-0.0030 ( 13363 PWs) bands (ev): -13.6767 -13.6767 -13.2234 -13.2234 -13.0881 -13.0881 -12.5347 -12.5347 -12.2389 -12.2389 -12.2160 -12.2160 -12.0180 -12.0180 -11.7500 -11.7500 -10.3583 -10.3583 -9.9276 -9.9276 -8.8203 -8.8203 -6.6642 -6.6642 -3.3151 -3.3151 -2.9280 -2.9280 -2.7533 -2.7533 -2.6040 -2.6040 -2.4496 -2.4496 -2.1761 -2.1761 -1.4001 -1.4001 -1.0008 -1.0008 -0.9122 -0.9122 -0.7915 -0.7915 -0.5706 -0.5706 -0.4131 -0.4131 -0.2073 -0.2073 -0.1770 -0.1770 -0.0481 -0.0481 0.0852 0.0852 0.2384 0.2384 0.2868 0.2868 0.4330 0.4330 0.5843 0.5843 0.6739 0.6739 0.7126 0.7126 0.7893 0.7893 0.9419 0.9419 1.0783 1.0783 1.2152 1.2152 1.4216 1.4216 1.7037 1.7037 2.0992 2.0992 3.4788 3.4788 3.9733 3.9733 4.2044 4.2044 4.4674 4.4674 6.9318 6.9318 7.5331 7.5331 7.9413 7.9413 8.8275 8.8275 k = 0.0000 0.3067-0.0032 ( 13353 PWs) bands (ev): -13.6733 -13.6733 -13.2233 -13.2233 -13.0900 -13.0900 -12.5394 -12.5394 -12.2387 -12.2387 -12.2159 -12.2159 -12.0168 -12.0168 -11.7500 -11.7500 -10.3611 -10.3611 -9.9219 -9.9219 -8.8236 -8.8236 -6.6609 -6.6609 -3.3150 -3.3150 -2.9348 -2.9348 -2.7495 -2.7495 -2.6009 -2.6009 -2.4453 -2.4453 -2.1807 -2.1807 -1.3649 -1.3649 -0.9953 -0.9953 -0.9196 -0.9196 -0.8040 -0.8040 -0.5501 -0.5501 -0.4176 -0.4176 -0.2243 -0.2243 -0.1779 -0.1779 -0.0413 -0.0413 0.0811 0.0811 0.2335 0.2335 0.2771 0.2771 0.4244 0.4244 0.5782 0.5782 0.6694 0.6694 0.7129 0.7129 0.7905 0.7905 0.9505 0.9505 1.0826 1.0826 1.2002 1.2002 1.4253 1.4253 1.6864 1.6864 2.0967 2.0967 3.4843 3.4843 3.9740 3.9740 4.2065 4.2065 4.4699 4.4699 6.9405 6.9405 7.5288 7.5288 7.9464 7.9464 8.8888 8.8888 k = 0.0000 0.3286-0.0034 ( 13345 PWs) bands (ev): -13.6700 -13.6700 -13.2232 -13.2232 -13.0917 -13.0917 -12.5439 -12.5439 -12.2386 -12.2386 -12.2157 -12.2157 -12.0157 -12.0157 -11.7500 -11.7500 -10.3637 -10.3637 -9.9166 -9.9166 -8.8267 -8.8267 -6.6577 -6.6577 -3.3150 -3.3150 -2.9409 -2.9409 -2.7460 -2.7460 -2.5979 -2.5979 -2.4412 -2.4412 -2.1851 -2.1851 -1.3301 -1.3301 -0.9907 -0.9907 -0.9290 -0.9290 -0.8109 -0.8109 -0.5320 -0.5320 -0.4183 -0.4183 -0.2463 -0.2463 -0.1783 -0.1783 -0.0351 -0.0351 0.0727 0.0727 0.2295 0.2295 0.2698 0.2698 0.4189 0.4189 0.5729 0.5729 0.6629 0.6629 0.7146 0.7146 0.7927 0.7927 0.9591 0.9591 1.0865 1.0865 1.1843 1.1843 1.4289 1.4289 1.6708 1.6708 2.0938 2.0938 3.4894 3.4894 3.9748 3.9748 4.2083 4.2083 4.4723 4.4723 6.9482 6.9482 7.5256 7.5256 7.9516 7.9516 8.9503 8.9503 k = 0.0000 0.3505-0.0036 ( 13343 PWs) bands (ev): -13.6669 -13.6669 -13.2234 -13.2234 -13.0932 -13.0932 -12.5481 -12.5481 -12.2384 -12.2384 -12.2155 -12.2155 -12.0148 -12.0148 -11.7500 -11.7500 -10.3660 -10.3660 -9.9116 -9.9116 -8.8297 -8.8297 -6.6548 -6.6548 -3.3150 -3.3150 -2.9464 -2.9464 -2.7427 -2.7427 -2.5951 -2.5951 -2.4374 -2.4374 -2.1893 -2.1893 -1.2963 -1.2963 -0.9877 -0.9877 -0.9407 -0.9407 -0.8107 -0.8107 -0.5189 -0.5189 -0.4140 -0.4140 -0.2709 -0.2709 -0.1786 -0.1786 -0.0299 -0.0299 0.0598 0.0598 0.2261 0.2261 0.2651 0.2651 0.4170 0.4170 0.5683 0.5683 0.6549 0.6549 0.7170 0.7170 0.7955 0.7955 0.9677 0.9677 1.0898 1.0898 1.1676 1.1676 1.4321 1.4321 1.6570 1.6570 2.0907 2.0907 3.4940 3.4940 3.9757 3.9757 4.2099 4.2099 4.4747 4.4747 6.9547 6.9547 7.5234 7.5234 7.9568 7.9568 9.0109 9.0109 k = 0.0000 0.3724-0.0039 ( 13343 PWs) bands (ev): -13.6640 -13.6640 -13.2236 -13.2236 -13.0944 -13.0944 -12.5520 -12.5520 -12.2383 -12.2383 -12.2153 -12.2153 -12.0140 -12.0140 -11.7499 -11.7499 -10.3681 -10.3681 -9.9072 -9.9072 -8.8323 -8.8323 -6.6521 -6.6521 -3.3150 -3.3150 -2.9511 -2.9511 -2.7397 -2.7397 -2.5923 -2.5923 -2.4340 -2.4340 -2.1932 -2.1932 -1.2638 -1.2638 -0.9871 -0.9871 -0.9543 -0.9543 -0.8026 -0.8026 -0.5118 -0.5118 -0.4072 -0.4072 -0.2942 -0.2942 -0.1786 -0.1786 -0.0261 -0.0261 0.0431 0.0431 0.2230 0.2230 0.2625 0.2625 0.4187 0.4187 0.5647 0.5647 0.6459 0.6459 0.7196 0.7196 0.7987 0.7987 0.9765 0.9765 1.0925 1.0925 1.1505 1.1505 1.4350 1.4350 1.6451 1.6451 2.0876 2.0876 3.4982 3.4982 3.9767 3.9767 4.2112 4.2112 4.4769 4.4769 6.9600 6.9600 7.5221 7.5221 7.9617 7.9617 9.0685 9.0685 k = 0.0000 0.3943-0.0041 ( 13338 PWs) bands (ev): -13.6615 -13.6615 -13.2239 -13.2239 -13.0955 -13.0955 -12.5554 -12.5554 -12.2381 -12.2381 -12.2151 -12.2151 -12.0133 -12.0133 -11.7499 -11.7499 -10.3699 -10.3699 -9.9033 -9.9033 -8.8347 -8.8347 -6.6497 -6.6497 -3.3150 -3.3150 -2.9552 -2.9552 -2.7371 -2.7371 -2.5898 -2.5898 -2.4311 -2.4311 -2.1967 -2.1967 -1.2330 -1.2330 -0.9911 -0.9911 -0.9667 -0.9667 -0.7873 -0.7873 -0.5095 -0.5095 -0.4070 -0.4070 -0.3074 -0.3074 -0.1781 -0.1781 -0.0250 -0.0250 0.0242 0.0242 0.2199 0.2199 0.2614 0.2614 0.4233 0.4233 0.5624 0.5624 0.6363 0.6363 0.7220 0.7220 0.8021 0.8021 0.9857 0.9857 1.0946 1.0946 1.1332 1.1332 1.4375 1.4375 1.6352 1.6352 2.0846 2.0846 3.5018 3.5018 3.9776 3.9776 4.2123 4.2123 4.4789 4.4789 6.9642 6.9642 7.5216 7.5216 7.9663 7.9663 9.1198 9.1198 k = 0.0000 0.4162-0.0043 ( 13341 PWs) bands (ev): -13.6593 -13.6593 -13.2242 -13.2242 -13.0963 -13.0963 -12.5583 -12.5583 -12.2380 -12.2380 -12.2149 -12.2149 -12.0128 -12.0128 -11.7499 -11.7499 -10.3715 -10.3715 -9.9000 -9.9000 -8.8367 -8.8367 -6.6477 -6.6477 -3.3151 -3.3151 -2.9585 -2.9585 -2.7349 -2.7349 -2.5875 -2.5875 -2.4287 -2.4287 -2.1997 -2.1997 -1.2042 -1.2042 -1.0026 -1.0026 -0.9739 -0.9739 -0.7662 -0.7662 -0.5101 -0.5101 -0.4231 -0.4231 -0.3026 -0.3026 -0.1762 -0.1762 -0.0306 -0.0306 0.0079 0.0079 0.2172 0.2172 0.2612 0.2612 0.4298 0.4298 0.5614 0.5614 0.6264 0.6264 0.7240 0.7240 0.8053 0.8053 0.9954 0.9954 1.0955 1.0955 1.1166 1.1166 1.4396 1.4396 1.6272 1.6272 2.0819 2.0819 3.5047 3.5047 3.9784 3.9784 4.2131 4.2131 4.4806 4.4806 6.9673 6.9673 7.5217 7.5217 7.9702 7.9702 9.1595 9.1595 k = 0.0000 0.4381-0.0045 ( 13342 PWs) bands (ev): -13.6576 -13.6576 -13.2245 -13.2245 -13.0969 -13.0969 -12.5606 -12.5606 -12.2379 -12.2379 -12.2147 -12.2147 -12.0124 -12.0124 -11.7499 -11.7499 -10.3726 -10.3726 -9.8974 -9.8974 -8.8383 -8.8383 -6.6461 -6.6461 -3.3152 -3.3152 -2.9611 -2.9611 -2.7332 -2.7332 -2.5857 -2.5857 -2.4268 -2.4268 -2.2021 -2.2021 -1.1777 -1.1777 -1.0193 -1.0193 -0.9770 -0.9770 -0.7415 -0.7415 -0.5123 -0.5123 -0.4501 -0.4501 -0.2861 -0.2861 -0.1720 -0.1720 -0.0481 -0.0481 0.0004 0.0004 0.2149 0.2149 0.2614 0.2614 0.4369 0.4369 0.5619 0.5619 0.6166 0.6166 0.7256 0.7256 0.8081 0.8081 1.0058 1.0058 1.0917 1.0917 1.1047 1.1047 1.4412 1.4412 1.6210 1.6210 2.0797 2.0797 3.5071 3.5071 3.9791 3.9791 4.2138 4.2138 4.4820 4.4820 6.9696 6.9696 7.5221 7.5221 7.9735 7.9735 9.1836 9.1836 k = 0.0000 0.4600-0.0048 ( 13345 PWs) bands (ev): -13.6563 -13.6563 -13.2247 -13.2247 -13.0973 -13.0973 -12.5623 -12.5623 -12.2378 -12.2378 -12.2146 -12.2146 -12.0121 -12.0121 -11.7499 -11.7499 -10.3735 -10.3735 -9.8955 -9.8955 -8.8395 -8.8395 -6.6450 -6.6450 -3.3152 -3.3152 -2.9630 -2.9630 -2.7319 -2.7319 -2.5842 -2.5842 -2.4254 -2.4254 -2.2039 -2.2039 -1.1542 -1.1542 -1.0371 -1.0371 -0.9786 -0.9786 -0.7159 -0.7159 -0.5162 -0.5162 -0.4777 -0.4777 -0.2680 -0.2680 -0.1637 -0.1637 -0.0733 -0.0733 -0.0014 -0.0014 0.2131 0.2131 0.2618 0.2618 0.4432 0.4432 0.5638 0.5638 0.6075 0.6075 0.7268 0.7268 0.8103 0.8103 1.0168 1.0168 1.0790 1.0790 1.1023 1.1023 1.4424 1.4424 1.6167 1.6167 2.0780 2.0780 3.5088 3.5088 3.9797 3.9797 4.2143 4.2143 4.4830 4.4830 6.9710 6.9710 7.5225 7.5225 7.9759 7.9759 9.1949 9.1949 k = 0.0000 0.4819-0.0050 ( 13347 PWs) bands (ev): -13.6555 -13.6555 -13.2249 -13.2249 -13.0975 -13.0975 -12.5634 -12.5634 -12.2377 -12.2377 -12.2145 -12.2145 -12.0120 -12.0120 -11.7498 -11.7498 -10.3740 -10.3740 -9.8943 -9.8943 -8.8402 -8.8402 -6.6442 -6.6442 -3.3152 -3.3152 -2.9641 -2.9641 -2.7311 -2.7311 -2.5834 -2.5834 -2.4246 -2.4246 -2.2050 -2.2050 -1.1355 -1.1355 -1.0526 -1.0526 -0.9795 -0.9795 -0.6946 -0.6946 -0.5237 -0.5237 -0.4957 -0.4957 -0.2550 -0.2550 -0.1492 -0.1492 -0.1002 -0.1002 -0.0016 -0.0016 0.2120 0.2120 0.2621 0.2621 0.4475 0.4475 0.5663 0.5663 0.6003 0.6003 0.7275 0.7275 0.8117 0.8117 1.0277 1.0277 1.0655 1.0655 1.1022 1.1022 1.4431 1.4431 1.6141 1.6141 2.0770 2.0770 3.5099 3.5099 3.9800 3.9800 4.2145 4.2145 4.4836 4.4836 6.9719 6.9719 7.5229 7.5229 7.9773 7.9773 9.1992 9.1992 k = 0.0000 0.5038-0.0052 ( 13340 PWs) bands (ev): -13.6552 -13.6552 -13.2250 -13.2250 -13.0976 -13.0976 -12.5637 -12.5637 -12.2377 -12.2377 -12.2145 -12.2145 -12.0119 -12.0119 -11.7498 -11.7498 -10.3742 -10.3742 -9.8939 -9.8939 -8.8405 -8.8405 -6.6440 -6.6440 -3.3152 -3.3152 -2.9644 -2.9644 -2.7309 -2.7309 -2.5831 -2.5831 -2.4243 -2.4243 -2.2054 -2.2054 -1.1275 -1.1275 -1.0596 -1.0596 -0.9798 -0.9798 -0.6857 -0.6857 -0.5293 -0.5293 -0.5005 -0.5005 -0.2503 -0.2503 -0.1331 -0.1331 -0.1207 -0.1207 -0.0016 -0.0016 0.2117 0.2117 0.2622 0.2622 0.4490 0.4490 0.5677 0.5677 0.5974 0.5974 0.7278 0.7278 0.8121 0.8121 1.0340 1.0340 1.0582 1.0582 1.1023 1.1023 1.4433 1.4433 1.6133 1.6133 2.0766 2.0766 3.5102 3.5102 3.9801 3.9801 4.2146 4.2146 4.4838 4.4838 6.9721 6.9721 7.5230 7.5230 7.9778 7.9778 9.2002 9.2002 k = 0.5000 0.4298-0.0674 ( 13348 PWs) bands (ev): -13.5983 -13.5983 -13.2007 -13.2007 -13.1792 -13.1792 -12.5631 -12.5631 -12.2405 -12.2405 -12.2132 -12.2132 -12.0262 -12.0262 -11.7440 -11.7440 -10.4153 -10.4153 -9.9077 -9.9077 -8.7950 -8.7950 -6.5792 -6.5792 -3.1186 -3.1186 -3.0015 -3.0015 -2.7463 -2.7463 -2.6084 -2.6084 -2.4093 -2.4093 -2.2976 -2.2976 -1.1577 -1.1577 -0.9979 -0.9979 -0.9187 -0.9187 -0.6815 -0.6815 -0.6575 -0.6575 -0.4873 -0.4873 -0.2903 -0.2903 -0.2100 -0.2100 -0.1854 -0.1854 0.0116 0.0116 0.1504 0.1504 0.2390 0.2390 0.4574 0.4574 0.5997 0.5997 0.6843 0.6843 0.6879 0.6879 0.8469 0.8469 0.9242 0.9242 1.1290 1.1290 1.1644 1.1644 1.4734 1.4734 1.5884 1.5884 1.9322 1.9322 3.6030 3.6030 3.9494 3.9494 4.2287 4.2287 4.4251 4.4251 7.0922 7.0922 7.7346 7.7346 8.0998 8.0998 9.1733 9.1733 k = 0.4833 0.4155-0.0651 ( 13349 PWs) bands (ev): -13.5986 -13.5986 -13.2034 -13.2034 -13.1762 -13.1762 -12.5630 -12.5630 -12.2404 -12.2404 -12.2132 -12.2132 -12.0262 -12.0262 -11.7440 -11.7440 -10.4151 -10.4151 -9.9078 -9.9078 -8.7950 -8.7950 -6.5796 -6.5796 -3.1190 -3.1190 -3.0016 -3.0016 -2.7462 -2.7462 -2.6084 -2.6084 -2.4100 -2.4100 -2.2966 -2.2966 -1.1594 -1.1594 -0.9977 -0.9977 -0.9177 -0.9177 -0.6896 -0.6896 -0.6499 -0.6499 -0.4869 -0.4869 -0.2908 -0.2908 -0.2277 -0.2277 -0.1667 -0.1667 0.0126 0.0126 0.1519 0.1519 0.2394 0.2394 0.4570 0.4570 0.5988 0.5988 0.6778 0.6778 0.6939 0.6939 0.8470 0.8470 0.9240 0.9240 1.1279 1.1279 1.1658 1.1658 1.4724 1.4724 1.5896 1.5896 1.9326 1.9326 3.6025 3.6025 3.9494 3.9494 4.2285 4.2285 4.4252 4.4252 7.0916 7.0916 7.7343 7.7343 8.0992 8.0992 9.1728 9.1728 k = 0.4667 0.4011-0.0629 ( 13356 PWs) bands (ev): -13.5995 -13.5995 -13.2091 -13.2091 -13.1697 -13.1697 -12.5626 -12.5626 -12.2404 -12.2404 -12.2133 -12.2133 -12.0262 -12.0262 -11.7441 -11.7441 -10.4145 -10.4145 -9.9083 -9.9083 -8.7949 -8.7949 -6.5806 -6.5806 -3.1203 -3.1203 -3.0020 -3.0020 -2.7461 -2.7461 -2.6083 -2.6083 -2.4122 -2.4122 -2.2936 -2.2936 -1.1646 -1.1646 -0.9969 -0.9969 -0.9149 -0.9149 -0.7045 -0.7045 -0.6367 -0.6367 -0.4857 -0.4857 -0.2933 -0.2933 -0.2512 -0.2512 -0.1395 -0.1395 0.0153 0.0153 0.1564 0.1564 0.2407 0.2407 0.4559 0.4559 0.5961 0.5961 0.6695 0.6695 0.7007 0.7007 0.8474 0.8474 0.9236 0.9236 1.1252 1.1252 1.1696 1.1696 1.4696 1.4696 1.5931 1.5931 1.9339 1.9339 3.6011 3.6011 3.9496 3.9496 4.2280 4.2280 4.4253 4.4253 7.0898 7.0898 7.7333 7.7333 8.0972 8.0972 9.1713 9.1713 k = 0.4500 0.3868-0.0606 ( 13362 PWs) bands (ev): -13.6009 -13.6009 -13.2155 -13.2155 -13.1619 -13.1619 -12.5619 -12.5619 -12.2404 -12.2404 -12.2134 -12.2134 -12.0262 -12.0262 -11.7442 -11.7442 -10.4136 -10.4136 -9.9090 -9.9090 -8.7949 -8.7949 -6.5823 -6.5823 -3.1224 -3.1224 -3.0024 -3.0024 -2.7458 -2.7458 -2.6081 -2.6081 -2.4157 -2.4157 -2.2889 -2.2889 -1.1729 -1.1729 -0.9959 -0.9959 -0.9102 -0.9102 -0.7209 -0.7209 -0.6228 -0.6228 -0.4845 -0.4845 -0.3011 -0.3011 -0.2679 -0.2679 -0.1119 -0.1119 0.0195 0.0195 0.1637 0.1637 0.2431 0.2431 0.4541 0.4541 0.5916 0.5916 0.6609 0.6609 0.7068 0.7068 0.8480 0.8480 0.9229 0.9229 1.1214 1.1214 1.1751 1.1751 1.4653 1.4653 1.5987 1.5987 1.9360 1.9360 3.5986 3.5986 3.9498 3.9498 4.2272 4.2272 4.4254 4.4254 7.0868 7.0868 7.7316 7.7316 8.0940 8.0940 9.1692 9.1692 k = 0.4333 0.3725-0.0584 ( 13364 PWs) bands (ev): -13.6030 -13.6030 -13.2218 -13.2218 -13.1536 -13.1536 -12.5610 -12.5610 -12.2403 -12.2403 -12.2135 -12.2135 -12.0261 -12.0261 -11.7443 -11.7443 -10.4123 -10.4123 -9.9101 -9.9101 -8.7948 -8.7948 -6.5846 -6.5846 -3.1255 -3.1255 -3.0027 -3.0027 -2.7456 -2.7456 -2.6078 -2.6078 -2.4202 -2.4202 -2.2828 -2.2828 -1.1839 -1.1839 -0.9945 -0.9945 -0.9039 -0.9039 -0.7381 -0.7381 -0.6088 -0.6088 -0.4846 -0.4846 -0.3171 -0.3171 -0.2732 -0.2732 -0.0850 -0.0850 0.0248 0.0248 0.1734 0.1734 0.2468 0.2468 0.4517 0.4517 0.5854 0.5854 0.6524 0.6524 0.7119 0.7119 0.8486 0.8486 0.9221 0.9221 1.1168 1.1168 1.1818 1.1818 1.4599 1.4599 1.6059 1.6059 1.9389 1.9389 3.5953 3.5953 3.9500 3.9500 4.2260 4.2260 4.4257 4.4257 7.0827 7.0827 7.7293 7.7293 8.0895 8.0895 9.1666 9.1666 k = 0.4167 0.3582-0.0561 ( 13370 PWs) bands (ev): -13.6056 -13.6056 -13.2278 -13.2278 -13.1453 -13.1453 -12.5598 -12.5598 -12.2403 -12.2403 -12.2137 -12.2137 -12.0260 -12.0260 -11.7445 -11.7445 -10.4106 -10.4106 -9.9114 -9.9114 -8.7947 -8.7947 -6.5876 -6.5876 -3.1297 -3.1297 -3.0028 -3.0028 -2.7455 -2.7455 -2.6072 -2.6072 -2.4255 -2.4255 -2.2756 -2.2756 -1.1974 -1.1974 -0.9930 -0.9930 -0.8963 -0.8963 -0.7555 -0.7555 -0.5948 -0.5948 -0.4873 -0.4873 -0.3351 -0.3351 -0.2712 -0.2712 -0.0593 -0.0593 0.0308 0.0308 0.1851 0.1851 0.2522 0.2522 0.4489 0.4489 0.5775 0.5775 0.6440 0.6440 0.7161 0.7161 0.8493 0.8493 0.9214 0.9214 1.1117 1.1117 1.1893 1.1893 1.4538 1.4538 1.6146 1.6146 1.9425 1.9425 3.5911 3.5911 3.9504 3.9504 4.2245 4.2245 4.4260 4.4260 7.0773 7.0773 7.7263 7.7263 8.0839 8.0839 9.1640 9.1640 k = 0.4000 0.3438-0.0539 ( 13363 PWs) bands (ev): -13.6087 -13.6087 -13.2332 -13.2332 -13.1370 -13.1370 -12.5583 -12.5583 -12.2402 -12.2402 -12.2138 -12.2138 -12.0260 -12.0260 -11.7447 -11.7447 -10.4086 -10.4086 -9.9130 -9.9130 -8.7946 -8.7946 -6.5911 -6.5911 -3.1350 -3.1350 -3.0023 -3.0023 -2.7455 -2.7455 -2.6063 -2.6063 -2.4314 -2.4314 -2.2676 -2.2676 -1.2131 -1.2131 -0.9913 -0.9913 -0.8876 -0.8876 -0.7727 -0.7727 -0.5808 -0.5808 -0.4938 -0.4938 -0.3511 -0.3511 -0.2648 -0.2648 -0.0351 -0.0351 0.0371 0.0371 0.1982 0.1982 0.2597 0.2597 0.4459 0.4459 0.5681 0.5681 0.6358 0.6358 0.7193 0.7193 0.8497 0.8497 0.9209 0.9209 1.1062 1.1062 1.1974 1.1974 1.4474 1.4474 1.6245 1.6245 1.9468 1.9468 3.5860 3.5860 3.9509 3.9509 4.2228 4.2228 4.4264 4.4264 7.0707 7.0707 7.7227 7.7227 8.0772 8.0772 9.1616 9.1616 k = 0.3833 0.3295-0.0516 ( 13364 PWs) bands (ev): -13.6123 -13.6123 -13.2380 -13.2380 -13.1289 -13.1289 -12.5565 -12.5565 -12.2401 -12.2401 -12.2140 -12.2140 -12.0259 -12.0259 -11.7450 -11.7450 -10.4063 -10.4063 -9.9149 -9.9149 -8.7944 -8.7944 -6.5952 -6.5952 -3.1415 -3.1415 -3.0011 -3.0011 -2.7457 -2.7457 -2.6050 -2.6050 -2.4378 -2.4378 -2.2592 -2.2592 -1.2306 -1.2306 -0.9895 -0.9895 -0.8785 -0.8785 -0.7891 -0.7891 -0.5672 -0.5672 -0.5043 -0.5043 -0.3637 -0.3637 -0.2549 -0.2549 -0.0130 -0.0130 0.0435 0.0435 0.2118 0.2118 0.2696 0.2696 0.4431 0.4431 0.5574 0.5574 0.6280 0.6280 0.7217 0.7217 0.8498 0.8498 0.9207 0.9207 1.1003 1.1003 1.2058 1.2058 1.4409 1.4409 1.6355 1.6355 1.9517 1.9517 3.5802 3.5802 3.9515 3.9515 4.2207 4.2207 4.4268 4.4268 7.0630 7.0630 7.7184 7.7184 8.0695 8.0695 9.1594 9.1594 k = 0.3667 0.3152-0.0494 ( 13358 PWs) bands (ev): -13.6164 -13.6164 -13.2421 -13.2421 -13.1212 -13.1212 -12.5545 -12.5545 -12.2400 -12.2400 -12.2142 -12.2142 -12.0259 -12.0259 -11.7452 -11.7452 -10.4036 -10.4036 -9.9171 -9.9171 -8.7943 -8.7943 -6.5997 -6.5997 -3.1491 -3.1491 -2.9991 -2.9991 -2.7462 -2.7462 -2.6034 -2.6034 -2.4444 -2.4444 -2.2504 -2.2504 -1.2499 -1.2499 -0.9873 -0.9873 -0.8700 -0.8700 -0.8035 -0.8035 -0.5549 -0.5549 -0.5170 -0.5170 -0.3733 -0.3733 -0.2419 -0.2419 0.0063 0.0063 0.0505 0.0505 0.2252 0.2252 0.2818 0.2818 0.4409 0.4409 0.5455 0.5455 0.6206 0.6206 0.7232 0.7232 0.8495 0.8495 0.9209 0.9209 1.0942 1.0942 1.2142 1.2142 1.4346 1.4346 1.6475 1.6475 1.9571 1.9571 3.5736 3.5736 3.9522 3.9522 4.2185 4.2185 4.4274 4.4274 7.0541 7.0541 7.7136 7.7136 8.0610 8.0610 9.1574 9.1574 k = 0.3500 0.3009-0.0471 ( 13350 PWs) bands (ev): -13.6209 -13.6209 -13.2455 -13.2455 -13.1138 -13.1138 -12.5522 -12.5522 -12.2398 -12.2398 -12.2144 -12.2144 -12.0259 -12.0259 -11.7455 -11.7455 -10.4006 -10.4006 -9.9195 -9.9195 -8.7941 -8.7941 -6.6046 -6.6046 -3.1577 -3.1577 -2.9963 -2.9963 -2.7470 -2.7470 -2.6014 -2.6014 -2.4513 -2.4513 -2.2415 -2.2415 -1.2708 -1.2708 -0.9849 -0.9849 -0.8646 -0.8646 -0.8135 -0.8135 -0.5502 -0.5502 -0.5246 -0.5246 -0.3806 -0.3806 -0.2266 -0.2266 0.0209 0.0209 0.0598 0.0598 0.2378 0.2378 0.2962 0.2962 0.4398 0.4398 0.5326 0.5326 0.6137 0.6137 0.7240 0.7240 0.8485 0.8485 0.9216 0.9216 1.0880 1.0880 1.2226 1.2226 1.4286 1.4286 1.6604 1.6604 1.9631 1.9631 3.5664 3.5664 3.9530 3.9530 4.2161 4.2161 4.4281 4.4281 7.0442 7.0442 7.7082 7.7082 8.0518 8.0518 9.1545 9.1545 k = 0.3333 0.2865-0.0449 ( 13352 PWs) bands (ev): -13.6257 -13.6257 -13.2483 -13.2483 -13.1068 -13.1068 -12.5496 -12.5496 -12.2397 -12.2397 -12.2147 -12.2147 -12.0260 -12.0260 -11.7459 -11.7459 -10.3974 -10.3974 -9.9222 -9.9222 -8.7939 -8.7939 -6.6099 -6.6099 -3.1671 -3.1671 -2.9925 -2.9925 -2.7480 -2.7480 -2.5991 -2.5991 -2.4583 -2.4583 -2.2327 -2.2327 -1.2931 -1.2931 -0.9820 -0.9820 -0.8657 -0.8657 -0.8157 -0.8157 -0.5613 -0.5613 -0.5176 -0.5176 -0.3859 -0.3859 -0.2096 -0.2096 0.0289 0.0289 0.0733 0.0733 0.2487 0.2487 0.3122 0.3122 0.4405 0.4405 0.5190 0.5190 0.6075 0.6075 0.7242 0.7242 0.8469 0.8469 0.9228 0.9228 1.0816 1.0816 1.2306 1.2306 1.4230 1.4230 1.6742 1.6742 1.9695 1.9695 3.5587 3.5587 3.9540 3.9540 4.2135 4.2135 4.4289 4.4289 7.0333 7.0333 7.7022 7.7022 8.0420 8.0420 9.1488 9.1488 k = 0.3167 0.2722-0.0427 ( 13351 PWs) bands (ev): -13.6308 -13.6308 -13.2503 -13.2503 -13.1004 -13.1004 -12.5468 -12.5468 -12.2396 -12.2396 -12.2149 -12.2149 -12.0261 -12.0261 -11.7462 -11.7462 -10.3938 -10.3938 -9.9252 -9.9252 -8.7937 -8.7937 -6.6155 -6.6155 -3.1772 -3.1772 -2.9880 -2.9880 -2.7493 -2.7493 -2.5966 -2.5966 -2.4652 -2.4652 -2.2239 -2.2239 -1.3167 -1.3167 -0.9787 -0.9787 -0.8730 -0.8730 -0.8107 -0.8107 -0.5772 -0.5772 -0.5061 -0.5061 -0.3893 -0.3893 -0.1920 -0.1920 0.0312 0.0312 0.0901 0.0901 0.2573 0.2573 0.3292 0.3292 0.4433 0.4433 0.5052 0.5052 0.6019 0.6019 0.7240 0.7240 0.8447 0.8447 0.9244 0.9244 1.0752 1.0752 1.2384 1.2384 1.4178 1.4178 1.6888 1.6888 1.9762 1.9762 3.5504 3.5504 3.9551 3.9551 4.2108 4.2108 4.4298 4.4298 7.0214 7.0214 7.6958 7.6958 8.0317 8.0317 9.1367 9.1367 k = 0.3000 0.2579-0.0404 ( 13359 PWs) bands (ev): -13.6362 -13.6362 -13.2517 -13.2517 -13.0945 -13.0945 -12.5437 -12.5437 -12.2394 -12.2394 -12.2150 -12.2150 -12.0262 -12.0262 -11.7465 -11.7465 -10.3901 -10.3901 -9.9283 -9.9283 -8.7935 -8.7935 -6.6213 -6.6213 -3.1878 -3.1878 -2.9826 -2.9826 -2.7508 -2.7508 -2.5940 -2.5940 -2.4721 -2.4721 -2.2154 -2.2154 -1.3415 -1.3415 -0.9753 -0.9753 -0.8822 -0.8822 -0.8030 -0.8030 -0.5926 -0.5926 -0.4949 -0.4949 -0.3903 -0.3903 -0.1745 -0.1745 0.0298 0.0298 0.1081 0.1081 0.2633 0.2633 0.3468 0.3468 0.4479 0.4479 0.4924 0.4924 0.5971 0.5971 0.7236 0.7236 0.8419 0.8419 0.9264 0.9264 1.0687 1.0687 1.2457 1.2457 1.4132 1.4132 1.7041 1.7041 1.9831 1.9831 3.5417 3.5417 3.9562 3.9562 4.2081 4.2081 4.4308 4.4308 7.0089 7.0089 7.6890 7.6890 8.0212 8.0212 9.1133 9.1133 k = 0.2833 0.2435-0.0382 ( 13368 PWs) bands (ev): -13.6418 -13.6418 -13.2525 -13.2525 -13.0891 -13.0891 -12.5404 -12.5404 -12.2393 -12.2393 -12.2152 -12.2152 -12.0264 -12.0264 -11.7468 -11.7468 -10.3861 -10.3861 -9.9317 -9.9317 -8.7933 -8.7933 -6.6273 -6.6273 -3.1987 -3.1987 -2.9766 -2.9766 -2.7525 -2.7525 -2.5916 -2.5916 -2.4787 -2.4787 -2.2071 -2.2071 -1.3672 -1.3672 -0.9721 -0.9721 -0.8905 -0.8905 -0.7957 -0.7957 -0.6057 -0.6057 -0.4854 -0.4854 -0.3883 -0.3883 -0.1580 -0.1580 0.0261 0.0261 0.1256 0.1256 0.2670 0.2670 0.3644 0.3644 0.4511 0.4511 0.4838 0.4838 0.5933 0.5933 0.7230 0.7230 0.8386 0.8386 0.9285 0.9285 1.0624 1.0624 1.2525 1.2525 1.4091 1.4091 1.7199 1.7199 1.9903 1.9903 3.5328 3.5328 3.9575 3.9575 4.2053 4.2053 4.4319 4.4319 6.9957 6.9957 7.6819 7.6819 8.0105 8.0105 9.0756 9.0756 k = 0.2667 0.2292-0.0359 ( 13364 PWs) bands (ev): -13.6474 -13.6474 -13.2527 -13.2527 -13.0844 -13.0844 -12.5370 -12.5370 -12.2392 -12.2392 -12.2154 -12.2154 -12.0267 -12.0267 -11.7471 -11.7471 -10.3819 -10.3819 -9.9353 -9.9353 -8.7931 -8.7931 -6.6333 -6.6333 -3.2098 -3.2098 -2.9698 -2.9698 -2.7543 -2.7543 -2.5895 -2.5895 -2.4848 -2.4848 -2.1992 -2.1992 -1.3937 -1.3937 -0.9699 -0.9699 -0.8962 -0.8962 -0.7905 -0.7905 -0.6156 -0.6156 -0.4781 -0.4781 -0.3826 -0.3826 -0.1431 -0.1431 0.0208 0.0208 0.1408 0.1408 0.2697 0.2697 0.3812 0.3812 0.4475 0.4475 0.4854 0.4854 0.5906 0.5906 0.7224 0.7224 0.8350 0.8350 0.9307 0.9307 1.0562 1.0562 1.2589 1.2589 1.4055 1.4055 1.7362 1.7362 1.9976 1.9976 3.5236 3.5236 3.9589 3.9589 4.2025 4.2025 4.4331 4.4331 6.9821 6.9821 7.6746 7.6746 7.9999 7.9999 9.0256 9.0256 k = 0.2500 0.2149-0.0337 ( 13362 PWs) bands (ev): -13.6531 -13.6531 -13.2524 -13.2524 -13.0803 -13.0803 -12.5333 -12.5333 -12.2390 -12.2390 -12.2155 -12.2155 -12.0270 -12.0270 -11.7474 -11.7474 -10.3776 -10.3776 -9.9390 -9.9390 -8.7929 -8.7929 -6.6393 -6.6393 -3.2208 -3.2208 -2.9624 -2.9624 -2.7562 -2.7562 -2.5881 -2.5881 -2.4902 -2.4902 -2.1916 -2.1916 -1.4207 -1.4207 -0.9699 -0.9699 -0.8978 -0.8978 -0.7885 -0.7885 -0.6216 -0.6216 -0.4726 -0.4726 -0.3734 -0.3734 -0.1306 -0.1306 0.0145 0.0145 0.1517 0.1517 0.2733 0.2733 0.3957 0.3957 0.4397 0.4397 0.4954 0.4954 0.5891 0.5891 0.7218 0.7218 0.8313 0.8313 0.9326 0.9326 1.0502 1.0502 1.2649 1.2649 1.4022 1.4022 1.7528 1.7528 2.0049 2.0049 3.5143 3.5143 3.9604 3.9604 4.1998 4.1998 4.4343 4.4343 6.9683 6.9683 7.6672 7.6672 7.9895 7.9895 8.9680 8.9680 k = 0.2333 0.2006-0.0314 ( 13358 PWs) bands (ev): -13.6588 -13.6588 -13.2516 -13.2516 -13.0768 -13.0768 -12.5295 -12.5295 -12.2389 -12.2389 -12.2156 -12.2156 -12.0274 -12.0274 -11.7477 -11.7477 -10.3731 -10.3731 -9.9428 -9.9428 -8.7927 -8.7927 -6.6453 -6.6453 -3.2317 -3.2317 -2.9545 -2.9545 -2.7582 -2.7582 -2.5877 -2.5877 -2.4947 -2.4947 -2.1844 -2.1844 -1.4479 -1.4479 -0.9726 -0.9726 -0.8947 -0.8947 -0.7899 -0.7899 -0.6239 -0.6239 -0.4680 -0.4680 -0.3615 -0.3615 -0.1209 -0.1209 0.0076 0.0076 0.1563 0.1563 0.2799 0.2799 0.4035 0.4035 0.4367 0.4367 0.5086 0.5086 0.5892 0.5892 0.7214 0.7214 0.8277 0.8277 0.9341 0.9341 1.0445 1.0445 1.2706 1.2706 1.3993 1.3993 1.7695 1.7695 2.0123 2.0123 3.5049 3.5049 3.9619 3.9619 4.1971 4.1971 4.4356 4.4356 6.9544 6.9544 7.6597 7.6597 7.9794 7.9794 8.9067 8.9067 k = 0.2167 0.1862-0.0292 ( 13360 PWs) bands (ev): -13.6643 -13.6643 -13.2504 -13.2504 -13.0738 -13.0738 -12.5257 -12.5257 -12.2388 -12.2388 -12.2156 -12.2156 -12.0279 -12.0279 -11.7480 -11.7480 -10.3686 -10.3686 -9.9467 -9.9467 -8.7926 -8.7926 -6.6512 -6.6512 -3.2423 -3.2423 -2.9461 -2.9461 -2.7602 -2.7602 -2.5883 -2.5883 -2.4981 -2.4981 -2.1776 -2.1776 -1.4751 -1.4751 -0.9776 -0.9776 -0.8876 -0.8876 -0.7941 -0.7941 -0.6236 -0.6236 -0.4632 -0.4632 -0.3475 -0.3475 -0.1147 -0.1147 0.0006 0.0006 0.1539 0.1539 0.2900 0.2900 0.4008 0.4008 0.4441 0.4441 0.5227 0.5227 0.5912 0.5912 0.7211 0.7211 0.8243 0.8243 0.9350 0.9350 1.0393 1.0393 1.2759 1.2759 1.3967 1.3967 1.7860 1.7860 2.0196 2.0196 3.4956 3.4956 3.9634 3.9634 4.1945 4.1945 4.4369 4.4369 6.9405 6.9405 7.6523 7.6523 7.9698 7.9698 8.8441 8.8441 k = 0.2000 0.1719-0.0269 ( 13365 PWs) bands (ev): -13.6697 -13.6697 -13.2489 -13.2489 -13.0714 -13.0714 -12.5219 -12.5219 -12.2387 -12.2387 -12.2157 -12.2157 -12.0283 -12.0283 -11.7482 -11.7482 -10.3641 -10.3641 -9.9507 -9.9507 -8.7924 -8.7924 -6.6569 -6.6569 -3.2524 -3.2524 -2.9372 -2.9372 -2.7622 -2.7622 -2.5902 -2.5902 -2.5002 -2.5002 -2.1712 -2.1712 -1.5018 -1.5018 -0.9840 -0.9840 -0.8776 -0.8776 -0.7998 -0.7998 -0.6217 -0.6217 -0.4572 -0.4572 -0.3323 -0.3323 -0.1122 -0.1122 -0.0062 -0.0062 0.1458 0.1458 0.3020 0.3020 0.3938 0.3938 0.4564 0.4564 0.5368 0.5368 0.5955 0.5955 0.7208 0.7208 0.8213 0.8213 0.9350 0.9350 1.0345 1.0345 1.2809 1.2809 1.3944 1.3944 1.8022 1.8022 2.0268 2.0268 3.4865 3.4865 3.9650 3.9650 4.1920 4.1920 4.4383 4.4383 6.9270 6.9270 7.6451 7.6451 7.9609 7.9609 8.7822 8.7822 k = 0.1833 0.1576-0.0247 ( 13361 PWs) bands (ev): -13.6749 -13.6749 -13.2471 -13.2471 -13.0695 -13.0695 -12.5180 -12.5180 -12.2386 -12.2386 -12.2157 -12.2157 -12.0289 -12.0289 -11.7484 -11.7484 -10.3596 -10.3596 -9.9546 -9.9546 -8.7922 -8.7922 -6.6623 -6.6623 -3.2621 -3.2621 -2.9280 -2.9280 -2.7642 -2.7642 -2.5934 -2.5934 -2.5012 -2.5012 -2.1651 -2.1651 -1.5279 -1.5279 -0.9911 -0.9911 -0.8664 -0.8664 -0.8055 -0.8055 -0.6192 -0.6192 -0.4497 -0.4497 -0.3166 -0.3166 -0.1136 -0.1136 -0.0127 -0.0127 0.1340 0.1340 0.3136 0.3136 0.3876 0.3876 0.4696 0.4696 0.5501 0.5501 0.6023 0.6023 0.7204 0.7204 0.8189 0.8189 0.9338 0.9338 1.0305 1.0305 1.2857 1.2857 1.3922 1.3922 1.8180 1.8180 2.0338 2.0338 3.4776 3.4776 3.9665 3.9665 4.1897 4.1897 4.4397 4.4397 6.9139 6.9139 7.6382 7.6382 7.9527 7.9527 8.7220 8.7220 k = 0.1667 0.1433-0.0225 ( 13367 PWs) bands (ev): -13.6799 -13.6799 -13.2451 -13.2451 -13.0681 -13.0681 -12.5143 -12.5143 -12.2385 -12.2385 -12.2156 -12.2156 -12.0294 -12.0294 -11.7486 -11.7486 -10.3553 -10.3553 -9.9585 -9.9585 -8.7920 -8.7920 -6.6675 -6.6675 -3.2712 -3.2712 -2.9184 -2.9184 -2.7663 -2.7663 -2.5977 -2.5977 -2.5011 -2.5011 -2.1595 -2.1595 -1.5531 -1.5531 -0.9984 -0.9984 -0.8566 -0.8566 -0.8084 -0.8084 -0.6165 -0.6165 -0.4410 -0.4410 -0.3007 -0.3007 -0.1186 -0.1186 -0.0191 -0.0191 0.1203 0.1203 0.3224 0.3224 0.3839 0.3839 0.4826 0.4826 0.5625 0.5625 0.6117 0.6117 0.7198 0.7198 0.8172 0.8172 0.9313 0.9313 1.0272 1.0272 1.2902 1.2902 1.3902 1.3902 1.8330 1.8330 2.0406 2.0406 3.4690 3.4690 3.9680 3.9680 4.1876 4.1876 4.4411 4.4411 6.9014 6.9014 7.6316 7.6316 7.9453 7.9453 8.6644 8.6644 k = 0.1500 0.1289-0.0202 ( 13366 PWs) bands (ev): -13.6845 -13.6845 -13.2429 -13.2429 -13.0671 -13.0671 -12.5107 -12.5107 -12.2384 -12.2384 -12.2156 -12.2156 -12.0300 -12.0300 -11.7488 -11.7488 -10.3510 -10.3510 -9.9623 -9.9623 -8.7919 -8.7919 -6.6723 -6.6723 -3.2796 -3.2796 -2.9087 -2.9087 -2.7686 -2.7686 -2.6028 -2.6028 -2.5003 -2.5003 -2.1542 -2.1542 -1.5769 -1.5769 -1.0057 -1.0057 -0.8519 -0.8519 -0.8051 -0.8051 -0.6137 -0.6137 -0.4317 -0.4317 -0.2849 -0.2849 -0.1263 -0.1263 -0.0260 -0.0260 0.1063 0.1063 0.3266 0.3266 0.3836 0.3836 0.4954 0.4954 0.5740 0.5740 0.6232 0.6232 0.7189 0.7189 0.8164 0.8164 0.9274 0.9274 1.0248 1.0248 1.2945 1.2945 1.3882 1.3882 1.8471 1.8471 2.0471 2.0471 3.4609 3.4609 3.9694 3.9694 4.1856 4.1856 4.4424 4.4424 6.8897 6.8897 7.6256 7.6256 7.9388 7.9388 8.6102 8.6102 k = 0.1333 0.1146-0.0180 ( 13371 PWs) bands (ev): -13.6887 -13.6887 -13.2408 -13.2408 -13.0665 -13.0665 -12.5073 -12.5073 -12.2383 -12.2383 -12.2155 -12.2155 -12.0306 -12.0306 -11.7490 -11.7490 -10.3470 -10.3470 -9.9659 -9.9659 -8.7918 -8.7918 -6.6768 -6.6768 -3.2873 -3.2873 -2.8988 -2.8988 -2.7709 -2.7709 -2.6085 -2.6085 -2.4988 -2.4988 -2.1494 -2.1494 -1.5992 -1.5992 -1.0127 -1.0127 -0.8532 -0.8532 -0.7949 -0.7949 -0.6102 -0.6102 -0.4227 -0.4227 -0.2697 -0.2697 -0.1357 -0.1357 -0.0339 -0.0339 0.0931 0.0931 0.3265 0.3265 0.3860 0.3860 0.5079 0.5079 0.5851 0.5851 0.6360 0.6360 0.7175 0.7175 0.8166 0.8166 0.9221 0.9221 1.0230 1.0230 1.2985 1.2985 1.3864 1.3864 1.8602 1.8602 2.0532 2.0532 3.4533 3.4533 3.9708 3.9708 4.1839 4.1839 4.4437 4.4437 6.8789 6.8789 7.6200 7.6200 7.9333 7.9333 8.5599 8.5599 k = 0.1167 0.1003-0.0157 ( 13361 PWs) bands (ev): -13.6925 -13.6925 -13.2386 -13.2386 -13.0661 -13.0661 -12.5041 -12.5041 -12.2382 -12.2382 -12.2154 -12.2154 -12.0312 -12.0312 -11.7491 -11.7491 -10.3432 -10.3432 -9.9693 -9.9693 -8.7916 -8.7916 -6.6808 -6.6808 -3.2942 -3.2942 -2.8889 -2.8889 -2.7735 -2.7735 -2.6144 -2.6144 -2.4971 -2.4971 -2.1450 -2.1450 -1.6196 -1.6196 -1.0193 -1.0193 -0.8576 -0.8576 -0.7814 -0.7814 -0.6053 -0.6053 -0.4154 -0.4154 -0.2553 -0.2553 -0.1454 -0.1454 -0.0432 -0.0432 0.0817 0.0817 0.3234 0.3234 0.3894 0.3894 0.5200 0.5200 0.5960 0.5960 0.6492 0.6492 0.7156 0.7156 0.8177 0.8177 0.9155 0.9155 1.0219 1.0219 1.3023 1.3023 1.3847 1.3847 1.8721 1.8721 2.0588 2.0588 3.4463 3.4463 3.9720 3.9720 4.1823 4.1823 4.4448 4.4448 6.8690 6.8690 7.6151 7.6151 7.9286 7.9286 8.5141 8.5141 k = 0.1000 0.0860-0.0135 ( 13365 PWs) bands (ev): -13.6959 -13.6959 -13.2365 -13.2365 -13.0660 -13.0660 -12.5013 -12.5013 -12.2382 -12.2382 -12.2154 -12.2154 -12.0317 -12.0317 -11.7492 -11.7492 -10.3398 -10.3398 -9.9724 -9.9724 -8.7915 -8.7915 -6.6843 -6.6843 -3.3002 -3.3002 -2.8792 -2.8792 -2.7763 -2.7763 -2.6202 -2.6202 -2.4952 -2.4952 -2.1411 -2.1411 -1.6380 -1.6380 -1.0254 -1.0254 -0.8627 -0.8627 -0.7675 -0.7675 -0.5981 -0.5981 -0.4112 -0.4112 -0.2419 -0.2419 -0.1542 -0.1542 -0.0538 -0.0538 0.0722 0.0722 0.3190 0.3190 0.3925 0.3925 0.5315 0.5315 0.6066 0.6066 0.6620 0.6620 0.7134 0.7134 0.8198 0.8198 0.9079 0.9079 1.0213 1.0213 1.3057 1.3057 1.3831 1.3831 1.8826 1.8826 2.0639 2.0639 3.4400 3.4400 3.9732 3.9732 4.1810 4.1810 4.4459 4.4459 6.8603 6.8603 7.6108 7.6108 7.9249 7.9249 8.4733 8.4733 k = 0.0833 0.0716-0.0112 ( 13363 PWs) bands (ev): -13.6988 -13.6988 -13.2347 -13.2347 -13.0660 -13.0660 -12.4988 -12.4988 -12.2381 -12.2381 -12.2153 -12.2153 -12.0322 -12.0322 -11.7493 -11.7493 -10.3368 -10.3368 -9.9752 -9.9752 -8.7915 -8.7915 -6.6874 -6.6874 -3.3054 -3.3054 -2.8697 -2.8697 -2.7794 -2.7794 -2.6256 -2.6256 -2.4933 -2.4933 -2.1377 -2.1377 -1.6539 -1.6539 -1.0307 -1.0307 -0.8677 -0.8677 -0.7549 -0.7549 -0.5881 -0.5881 -0.4113 -0.4113 -0.2297 -0.2297 -0.1610 -0.1610 -0.0652 -0.0652 0.0646 0.0646 0.3142 0.3142 0.3950 0.3950 0.5421 0.5421 0.6168 0.6168 0.6732 0.6732 0.7114 0.7114 0.8229 0.8229 0.8994 0.8994 1.0210 1.0210 1.3087 1.3087 1.3816 1.3816 1.8917 1.8917 2.0684 2.0684 3.4345 3.4345 3.9741 3.9741 4.1798 4.1798 4.4469 4.4469 6.8528 6.8528 7.6072 7.6072 7.9219 7.9219 8.4378 8.4378 k = 0.0667 0.0573-0.0090 ( 13365 PWs) bands (ev): -13.7012 -13.7012 -13.2330 -13.2330 -13.0662 -13.0662 -12.4967 -12.4967 -12.2381 -12.2381 -12.2152 -12.2152 -12.0326 -12.0326 -11.7494 -11.7494 -10.3343 -10.3343 -9.9775 -9.9775 -8.7914 -8.7914 -6.6899 -6.6899 -3.3097 -3.3097 -2.8608 -2.8608 -2.7828 -2.7828 -2.6305 -2.6305 -2.4917 -2.4917 -2.1349 -2.1349 -1.6674 -1.6674 -1.0352 -1.0352 -0.8720 -0.8720 -0.7445 -0.7445 -0.5750 -0.5750 -0.4164 -0.4164 -0.2185 -0.2185 -0.1654 -0.1654 -0.0767 -0.0767 0.0589 0.0589 0.3095 0.3095 0.3967 0.3967 0.5516 0.5516 0.6263 0.6263 0.6809 0.6809 0.7111 0.7111 0.8270 0.8270 0.8903 0.8903 1.0208 1.0208 1.3113 1.3113 1.3803 1.3803 1.8993 1.8993 2.0722 2.0722 3.4299 3.4299 3.9750 3.9750 4.1789 4.1789 4.4477 4.4477 6.8465 6.8465 7.6042 7.6042 7.9198 7.9198 8.4081 8.4081 k = 0.0500 0.0430-0.0067 ( 13361 PWs) bands (ev): -13.7031 -13.7031 -13.2317 -13.2317 -13.0663 -13.0663 -12.4950 -12.4950 -12.2381 -12.2381 -12.2151 -12.2151 -12.0329 -12.0329 -11.7494 -11.7494 -10.3322 -10.3322 -9.9794 -9.9794 -8.7913 -8.7913 -6.6919 -6.6919 -3.3131 -3.3131 -2.8527 -2.8527 -2.7862 -2.7862 -2.6345 -2.6345 -2.4903 -2.4903 -2.1327 -2.1327 -1.6780 -1.6780 -1.0389 -1.0389 -0.8755 -0.8755 -0.7368 -0.7368 -0.5591 -0.5591 -0.4262 -0.4262 -0.2081 -0.2081 -0.1681 -0.1681 -0.0873 -0.0873 0.0546 0.0546 0.3053 0.3053 0.3978 0.3978 0.5595 0.5595 0.6349 0.6349 0.6836 0.6836 0.7137 0.7137 0.8320 0.8320 0.8809 0.8809 1.0207 1.0207 1.3134 1.3134 1.3792 1.3792 1.9053 1.9053 2.0752 2.0752 3.4262 3.4262 3.9756 3.9756 4.1782 4.1782 4.4483 4.4483 6.8415 6.8415 7.6020 7.6020 7.9183 7.9183 8.3845 8.3845 k = 0.0333 0.0287-0.0045 ( 13361 PWs) bands (ev): -13.7045 -13.7045 -13.2307 -13.2307 -13.0665 -13.0665 -12.4938 -12.4938 -12.2380 -12.2380 -12.2151 -12.2151 -12.0332 -12.0332 -11.7494 -11.7494 -10.3307 -10.3307 -9.9807 -9.9807 -8.7913 -8.7913 -6.6933 -6.6933 -3.3155 -3.3155 -2.8460 -2.8460 -2.7895 -2.7895 -2.6375 -2.6375 -2.4892 -2.4892 -2.1310 -2.1310 -1.6857 -1.6857 -1.0415 -1.0415 -0.8780 -0.8780 -0.7316 -0.7316 -0.5418 -0.5418 -0.4396 -0.4396 -0.1983 -0.1983 -0.1708 -0.1708 -0.0959 -0.0959 0.0516 0.0516 0.3020 0.3020 0.3984 0.3984 0.5655 0.5655 0.6422 0.6422 0.6823 0.6823 0.7180 0.7180 0.8381 0.8381 0.8714 0.8714 1.0207 1.0207 1.3150 1.3150 1.3784 1.3784 1.9096 1.9096 2.0774 2.0774 3.4236 3.4236 3.9761 3.9761 4.1776 4.1776 4.4488 4.4488 6.8380 6.8380 7.6004 7.6004 7.9173 7.9173 8.3674 8.3674 k = 0.0167 0.0143-0.0022 ( 13361 PWs) bands (ev): -13.7053 -13.7053 -13.2301 -13.2301 -13.0666 -13.0666 -12.4931 -12.4931 -12.2380 -12.2380 -12.2151 -12.2151 -12.0333 -12.0333 -11.7495 -11.7495 -10.3298 -10.3298 -9.9816 -9.9816 -8.7913 -8.7913 -6.6942 -6.6942 -3.3170 -3.3170 -2.8414 -2.8414 -2.7920 -2.7920 -2.6394 -2.6394 -2.4886 -2.4886 -2.1300 -2.1300 -1.6904 -1.6904 -1.0431 -1.0431 -0.8796 -0.8796 -0.7287 -0.7287 -0.5259 -0.5259 -0.4532 -0.4532 -0.1891 -0.1891 -0.1748 -0.1748 -0.1016 -0.1016 0.0498 0.0498 0.3000 0.3000 0.3987 0.3987 0.5693 0.5693 0.6476 0.6476 0.6797 0.6797 0.7215 0.7215 0.8452 0.8452 0.8621 0.8621 1.0207 1.0207 1.3159 1.3159 1.3779 1.3779 1.9122 1.9122 2.0787 2.0787 3.4219 3.4219 3.9764 3.9764 4.1773 4.1773 4.4491 4.4491 6.8358 6.8358 7.5994 7.5994 7.9168 7.9168 8.3571 8.3571 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0000 0.0218 ( 13356 PWs) bands (ev): -13.7053 -13.7053 -13.2303 -13.2303 -13.0665 -13.0665 -12.4929 -12.4929 -12.2382 -12.2382 -12.2152 -12.2152 -12.0332 -12.0332 -11.7493 -11.7493 -10.3294 -10.3294 -9.9819 -9.9819 -8.7912 -8.7912 -6.6942 -6.6942 -3.3167 -3.3167 -2.8436 -2.8436 -2.7911 -2.7911 -2.6394 -2.6394 -2.4886 -2.4886 -2.1312 -2.1312 -1.6911 -1.6911 -1.0424 -1.0424 -0.8793 -0.8793 -0.7290 -0.7290 -0.5210 -0.5210 -0.4564 -0.4564 -0.1914 -0.1914 -0.1750 -0.1750 -0.1084 -0.1084 0.0574 0.0574 0.3012 0.3012 0.3993 0.3993 0.5692 0.5692 0.6481 0.6481 0.6795 0.6795 0.7222 0.7222 0.8459 0.8459 0.8615 0.8615 1.0214 1.0214 1.3157 1.3157 1.3776 1.3776 1.9129 1.9129 2.0789 2.0789 3.4214 3.4214 3.9766 3.9766 4.1770 4.1770 4.4496 4.4496 6.8349 6.8349 7.5988 7.5988 7.9150 7.9150 8.3569 8.3569 k = 0.0000 0.0000 0.0437 ( 13361 PWs) bands (ev): -13.7044 -13.7044 -13.2316 -13.2316 -13.0660 -13.0660 -12.4933 -12.4933 -12.2388 -12.2388 -12.2157 -12.2157 -12.0327 -12.0327 -11.7486 -11.7486 -10.3293 -10.3293 -9.9819 -9.9819 -8.7910 -8.7910 -6.6933 -6.6933 -3.3143 -3.3143 -2.8536 -2.8536 -2.7869 -2.7869 -2.6376 -2.6376 -2.4892 -2.4892 -2.1356 -2.1356 -1.6883 -1.6883 -1.0387 -1.0387 -0.8771 -0.8771 -0.7328 -0.7328 -0.5272 -0.5272 -0.4472 -0.4472 -0.2039 -0.2039 -0.1785 -0.1785 -0.1156 -0.1156 0.0776 0.0776 0.3068 0.3068 0.4008 0.4008 0.5653 0.5653 0.6440 0.6440 0.6817 0.6817 0.7203 0.7203 0.8402 0.8402 0.8701 0.8701 1.0236 1.0236 1.3140 1.3140 1.3775 1.3775 1.9123 1.9123 2.0781 2.0781 3.4213 3.4213 3.9768 3.9768 4.1762 4.1762 4.4510 4.4510 6.8342 6.8342 7.5980 7.5980 7.9104 7.9104 8.3666 8.3666 k = 0.0000 0.0000 0.0655 ( 13365 PWs) bands (ev): -13.7030 -13.7030 -13.2338 -13.2338 -13.0652 -13.0652 -12.4939 -12.4939 -12.2399 -12.2399 -12.2164 -12.2164 -12.0318 -12.0318 -11.7475 -11.7475 -10.3290 -10.3290 -9.9820 -9.9820 -8.7906 -8.7906 -6.6918 -6.6918 -3.3103 -3.3103 -2.8673 -2.8673 -2.7828 -2.7828 -2.6348 -2.6348 -2.4902 -2.4902 -2.1428 -2.1428 -1.6839 -1.6839 -1.0326 -1.0326 -0.8738 -0.8738 -0.7391 -0.7391 -0.5345 -0.5345 -0.4350 -0.4350 -0.2194 -0.2194 -0.1936 -0.1936 -0.1153 -0.1153 0.1033 0.1033 0.3158 0.3158 0.4032 0.4032 0.5592 0.5592 0.6382 0.6382 0.6833 0.6833 0.7169 0.7169 0.8369 0.8369 0.8786 0.8786 1.0274 1.0274 1.3112 1.3112 1.3771 1.3771 1.9112 1.9112 2.0767 2.0767 3.4213 3.4213 3.9770 3.9770 4.1748 4.1748 4.4532 4.4532 6.8330 6.8330 7.5965 7.5965 7.9031 7.9031 8.3825 8.3825 k = 0.0000 0.0000 0.0874 ( 13371 PWs) bands (ev): -13.7010 -13.7010 -13.2368 -13.2368 -13.0641 -13.0641 -12.4947 -12.4947 -12.2414 -12.2414 -12.2173 -12.2173 -12.0307 -12.0307 -11.7461 -11.7461 -10.3286 -10.3286 -9.9820 -9.9820 -8.7902 -8.7902 -6.6898 -6.6898 -3.3048 -3.3048 -2.8831 -2.8831 -2.7797 -2.7797 -2.6313 -2.6313 -2.4915 -2.4915 -2.1526 -2.1526 -1.6778 -1.6778 -1.0245 -1.0245 -0.8696 -0.8696 -0.7478 -0.7478 -0.5409 -0.5409 -0.4214 -0.4214 -0.2417 -0.2417 -0.2098 -0.2098 -0.1094 -0.1094 0.1306 0.1306 0.3276 0.3276 0.4066 0.4066 0.5513 0.5513 0.6312 0.6312 0.6832 0.6832 0.7117 0.7117 0.8371 0.8371 0.8867 0.8867 1.0329 1.0329 1.3076 1.3076 1.3765 1.3765 1.9098 1.9098 2.0748 2.0748 3.4214 3.4214 3.9773 3.9773 4.1730 4.1730 4.4564 4.4564 6.8313 6.8313 7.5944 7.5944 7.8939 7.8939 8.4039 8.4039 k = 0.0000 0.0000 0.1092 ( 13372 PWs) bands (ev): -13.6984 -13.6984 -13.2406 -13.2406 -13.0627 -13.0627 -12.4957 -12.4957 -12.2433 -12.2433 -12.2182 -12.2182 -12.0293 -12.0293 -11.7443 -11.7443 -10.3282 -10.3282 -9.9821 -9.9821 -8.7896 -8.7896 -6.6873 -6.6873 -3.2979 -3.2979 -2.9002 -2.9002 -2.7779 -2.7779 -2.6274 -2.6274 -2.4931 -2.4931 -2.1648 -2.1648 -1.6703 -1.6703 -1.0148 -1.0148 -0.8653 -0.8653 -0.7586 -0.7586 -0.5456 -0.5456 -0.4076 -0.4076 -0.2700 -0.2700 -0.2206 -0.2206 -0.1015 -0.1015 0.1571 0.1571 0.3417 0.3417 0.4110 0.4110 0.5421 0.5421 0.6228 0.6228 0.6807 0.6807 0.7045 0.7045 0.8410 0.8410 0.8941 0.8941 1.0402 1.0402 1.3032 1.3032 1.3756 1.3756 1.9080 1.9080 2.0724 2.0724 3.4219 3.4219 3.9775 3.9775 4.1706 4.1706 4.4605 4.4605 6.8293 6.8293 7.5916 7.5916 7.8835 7.8835 8.4302 8.4302 k = 0.0000 0.0000 0.1310 ( 13374 PWs) bands (ev): -13.6954 -13.6954 -13.2451 -13.2451 -13.0611 -13.0611 -12.4968 -12.4968 -12.2457 -12.2457 -12.2192 -12.2192 -12.0277 -12.0277 -11.7423 -11.7423 -10.3277 -10.3277 -9.9822 -9.9822 -8.7889 -8.7889 -6.6843 -6.6843 -3.2897 -3.2897 -2.9179 -2.9179 -2.7774 -2.7774 -2.6236 -2.6236 -2.4947 -2.4947 -2.1790 -2.1790 -1.6616 -1.6616 -1.0041 -1.0041 -0.8619 -0.8619 -0.7705 -0.7705 -0.5479 -0.5479 -0.3961 -0.3961 -0.2982 -0.2982 -0.2268 -0.2268 -0.0932 -0.0932 0.1818 0.1818 0.3569 0.3569 0.4165 0.4165 0.5320 0.5320 0.6129 0.6129 0.6754 0.6754 0.6961 0.6961 0.8483 0.8483 0.9005 0.9005 1.0494 1.0494 1.2983 1.2983 1.3744 1.3744 1.9059 1.9059 2.0694 2.0694 3.4228 3.4228 3.9775 3.9775 4.1677 4.1677 4.4655 4.4655 6.8269 6.8269 7.5880 7.5880 7.8726 7.8726 8.4608 8.4608 k = 0.0000 0.0000 0.1529 ( 13372 PWs) bands (ev): -13.6919 -13.6919 -13.2501 -13.2501 -13.0593 -13.0593 -12.4982 -12.4982 -12.2485 -12.2485 -12.2200 -12.2200 -12.0260 -12.0260 -11.7400 -11.7400 -10.3271 -10.3271 -9.9823 -9.9823 -8.7882 -8.7882 -6.6809 -6.6809 -3.2803 -3.2803 -2.9358 -2.9358 -2.7781 -2.7781 -2.6203 -2.6203 -2.4963 -2.4963 -2.1950 -2.1950 -1.6520 -1.6520 -0.9931 -0.9931 -0.8609 -0.8609 -0.7818 -0.7818 -0.5475 -0.5475 -0.3927 -0.3927 -0.3179 -0.3179 -0.2291 -0.2291 -0.0850 -0.0850 0.2040 0.2040 0.3720 0.3720 0.4237 0.4237 0.5212 0.5212 0.6015 0.6015 0.6669 0.6669 0.6877 0.6877 0.8583 0.8583 0.9057 0.9057 1.0605 1.0605 1.2930 1.2930 1.3727 1.3727 1.9036 1.9036 2.0660 2.0660 3.4243 3.4243 3.9772 3.9772 4.1642 4.1642 4.4714 4.4714 6.8242 6.8242 7.5833 7.5833 7.8618 7.8618 8.4950 8.4950 k = 0.0000 0.0000 0.1747 ( 13375 PWs) bands (ev): -13.6880 -13.6880 -13.2557 -13.2557 -13.0574 -13.0574 -12.4997 -12.4997 -12.2515 -12.2515 -12.2207 -12.2207 -12.0242 -12.0242 -11.7375 -11.7375 -10.3264 -10.3264 -9.9824 -9.9824 -8.7873 -8.7873 -6.6773 -6.6773 -3.2698 -3.2698 -2.9533 -2.9533 -2.7798 -2.7798 -2.6180 -2.6180 -2.4978 -2.4978 -2.2122 -2.2122 -1.6416 -1.6416 -0.9828 -0.9828 -0.8641 -0.8641 -0.7903 -0.7903 -0.5441 -0.5441 -0.4056 -0.4056 -0.3198 -0.3198 -0.2274 -0.2274 -0.0772 -0.0772 0.2233 0.2233 0.3850 0.3850 0.4330 0.4330 0.5103 0.5103 0.5884 0.5884 0.6555 0.6555 0.6801 0.6801 0.8698 0.8698 0.9099 0.9099 1.0732 1.0732 1.2875 1.2875 1.3708 1.3708 1.9009 1.9009 2.0622 2.0622 3.4266 3.4266 3.9767 3.9767 4.1602 4.1602 4.4781 4.4781 6.8213 6.8213 7.5776 7.5776 7.8520 7.8520 8.5323 8.5323 k = 0.0000 0.0000 0.1965 ( 13369 PWs) bands (ev): -13.6838 -13.6838 -13.2617 -13.2617 -13.0554 -13.0554 -12.5014 -12.5014 -12.2548 -12.2548 -12.2213 -12.2213 -12.0224 -12.0224 -11.7350 -11.7350 -10.3257 -10.3257 -9.9825 -9.9825 -8.7864 -8.7864 -6.6734 -6.6734 -3.2587 -3.2587 -2.9700 -2.9700 -2.7824 -2.7824 -2.6168 -2.6168 -2.4988 -2.4988 -2.2303 -2.2303 -1.6307 -1.6307 -0.9745 -0.9745 -0.8718 -0.8718 -0.7944 -0.7944 -0.5380 -0.5380 -0.4298 -0.4298 -0.3080 -0.3080 -0.2218 -0.2218 -0.0698 -0.0698 0.2393 0.2393 0.3939 0.3939 0.4448 0.4448 0.5001 0.5001 0.5738 0.5738 0.6425 0.6425 0.6735 0.6735 0.8816 0.8816 0.9132 0.9132 1.0873 1.0873 1.2818 1.2818 1.3685 1.3685 1.8982 1.8982 2.0580 2.0580 3.4297 3.4297 3.9758 3.9758 4.1557 4.1557 4.4856 4.4856 6.8181 6.8181 7.5708 7.5708 7.8436 7.8436 8.5721 8.5721 k = 0.0000 0.0000 0.2184 ( 13364 PWs) bands (ev): -13.6793 -13.6793 -13.2680 -13.2680 -13.0534 -13.0534 -12.5031 -12.5031 -12.2583 -12.2583 -12.2218 -12.2218 -12.0206 -12.0206 -11.7324 -11.7324 -10.3250 -10.3250 -9.9826 -9.9826 -8.7855 -8.7855 -6.6693 -6.6693 -3.2471 -3.2471 -2.9853 -2.9853 -2.7856 -2.7856 -2.6171 -2.6171 -2.4995 -2.4995 -2.2489 -2.2489 -1.6197 -1.6197 -0.9706 -0.9706 -0.8811 -0.8811 -0.7948 -0.7948 -0.5296 -0.5296 -0.4566 -0.4566 -0.2904 -0.2904 -0.2124 -0.2124 -0.0628 -0.0628 0.2515 0.2515 0.3975 0.3975 0.4581 0.4581 0.4917 0.4917 0.5577 0.5577 0.6297 0.6297 0.6677 0.6677 0.8921 0.8921 0.9170 0.9170 1.1024 1.1024 1.2762 1.2762 1.3661 1.3661 1.8952 1.8952 2.0536 2.0536 3.4337 3.4337 3.9746 3.9746 4.1507 4.1507 4.4936 4.4936 6.8148 6.8148 7.5628 7.5628 7.8368 7.8368 8.6139 8.6139 k = 0.0000 0.0000 0.2402 ( 13356 PWs) bands (ev): -13.6746 -13.6746 -13.2744 -13.2744 -13.0513 -13.0513 -12.5049 -12.5049 -12.2617 -12.2617 -12.2221 -12.2221 -12.0188 -12.0188 -11.7298 -11.7298 -10.3243 -10.3243 -9.9826 -9.9826 -8.7846 -8.7846 -6.6653 -6.6653 -3.2355 -3.2355 -2.9988 -2.9988 -2.7896 -2.7896 -2.6189 -2.6189 -2.4995 -2.4995 -2.2674 -2.2674 -1.6086 -1.6086 -0.9737 -0.9737 -0.8872 -0.8872 -0.7935 -0.7935 -0.5222 -0.5222 -0.4796 -0.4796 -0.2698 -0.2698 -0.1996 -0.1996 -0.0562 -0.0562 0.2595 0.2595 0.3960 0.3960 0.4687 0.4687 0.4879 0.4879 0.5408 0.5408 0.6184 0.6184 0.6625 0.6625 0.8988 0.8988 0.9230 0.9230 1.1179 1.1179 1.2706 1.2706 1.3636 1.3636 1.8923 1.8923 2.0489 2.0489 3.4384 3.4384 3.9731 3.9731 4.1454 4.1454 4.5021 4.5021 6.8115 6.8115 7.5539 7.5539 7.8320 7.8320 8.6570 8.6570 k = 0.0000 0.0000 0.2621 ( 13354 PWs) bands (ev): -13.6698 -13.6698 -13.2809 -13.2809 -13.0493 -13.0493 -12.5067 -12.5067 -12.2651 -12.2651 -12.2223 -12.2223 -12.0171 -12.0171 -11.7274 -11.7274 -10.3236 -10.3236 -9.9827 -9.9827 -8.7837 -8.7837 -6.6612 -6.6612 -3.2245 -3.2245 -3.0098 -3.0098 -2.7942 -2.7942 -2.6222 -2.6222 -2.4991 -2.4991 -2.2856 -2.2856 -1.5977 -1.5977 -0.9845 -0.9845 -0.8878 -0.8878 -0.7917 -0.7917 -0.5285 -0.5285 -0.4851 -0.4851 -0.2471 -0.2471 -0.1841 -0.1841 -0.0500 -0.0500 0.2626 0.2626 0.3900 0.3900 0.4704 0.4704 0.4921 0.4921 0.5246 0.5246 0.6102 0.6102 0.6581 0.6581 0.9008 0.9008 0.9319 0.9319 1.1333 1.1333 1.2653 1.2653 1.3612 1.3612 1.8893 1.8893 2.0442 2.0442 3.4438 3.4438 3.9714 3.9714 4.1397 4.1397 4.5109 4.5109 6.8081 6.8081 7.5442 7.5442 7.8290 7.8290 8.7010 8.7010 k = 0.0000 0.0000 0.2839 ( 13352 PWs) bands (ev): -13.6651 -13.6651 -13.2873 -13.2873 -13.0474 -13.0474 -12.5085 -12.5085 -12.2684 -12.2684 -12.2225 -12.2225 -12.0156 -12.0156 -11.7250 -11.7250 -10.3229 -10.3229 -9.9827 -9.9827 -8.7828 -8.7828 -6.6573 -6.6573 -3.2146 -3.2146 -3.0177 -3.0177 -2.7995 -2.7995 -2.6267 -2.6267 -2.4981 -2.4981 -2.3029 -2.3029 -1.5873 -1.5873 -1.0006 -1.0006 -0.8840 -0.8840 -0.7903 -0.7903 -0.5491 -0.5491 -0.4723 -0.4723 -0.2230 -0.2230 -0.1665 -0.1665 -0.0440 -0.0440 0.2603 0.2603 0.3809 0.3809 0.4649 0.4649 0.4961 0.4961 0.5138 0.5138 0.6063 0.6063 0.6549 0.6549 0.8999 0.8999 0.9418 0.9418 1.1483 1.1483 1.2602 1.2602 1.3590 1.3590 1.8865 1.8865 2.0395 2.0395 3.4498 3.4498 3.9695 3.9695 4.1339 4.1339 4.5197 4.5197 6.8048 6.8048 7.5342 7.5342 7.8276 7.8276 8.7453 8.7453 k = 0.0000 0.0000 0.3057 ( 13350 PWs) bands (ev): -13.6605 -13.6605 -13.2935 -13.2935 -13.0456 -13.0456 -12.5102 -12.5102 -12.2714 -12.2714 -12.2225 -12.2225 -12.0142 -12.0142 -11.7228 -11.7228 -10.3223 -10.3223 -9.9828 -9.9828 -8.7820 -8.7820 -6.6536 -6.6536 -3.2064 -3.2064 -3.0220 -3.0220 -2.8057 -2.8057 -2.6321 -2.6321 -2.4968 -2.4968 -2.3189 -2.3189 -1.5776 -1.5776 -1.0187 -1.0187 -0.8779 -0.8779 -0.7897 -0.7897 -0.5717 -0.5717 -0.4540 -0.4540 -0.1979 -0.1979 -0.1477 -0.1477 -0.0381 -0.0381 0.2525 0.2525 0.3698 0.3698 0.4537 0.4537 0.4937 0.4937 0.5126 0.5126 0.6069 0.6069 0.6529 0.6529 0.8975 0.8975 0.9512 0.9512 1.1624 1.1624 1.2555 1.2555 1.3572 1.3572 1.8838 1.8838 2.0349 2.0349 3.4560 3.4560 3.9676 3.9676 4.1282 4.1282 4.5283 4.5283 6.8017 6.8017 7.5242 7.5242 7.8276 7.8276 8.7893 8.7893 k = 0.0000 0.0000 0.3276 ( 13352 PWs) bands (ev): -13.6561 -13.6561 -13.2992 -13.2992 -13.0439 -13.0439 -12.5118 -12.5118 -12.2742 -12.2742 -12.2225 -12.2225 -12.0129 -12.0129 -11.7209 -11.7209 -10.3217 -10.3217 -9.9828 -9.9828 -8.7812 -8.7812 -6.6502 -6.6502 -3.2005 -3.2005 -3.0223 -3.0223 -2.8126 -2.8126 -2.6380 -2.6380 -2.4953 -2.4953 -2.3335 -2.3335 -1.5688 -1.5688 -1.0369 -1.0369 -0.8705 -0.8705 -0.7902 -0.7902 -0.5930 -0.5930 -0.4337 -0.4337 -0.1726 -0.1726 -0.1285 -0.1285 -0.0321 -0.0321 0.2402 0.2402 0.3568 0.3568 0.4388 0.4388 0.4908 0.4908 0.5139 0.5139 0.6107 0.6107 0.6527 0.6527 0.8942 0.8942 0.9594 0.9594 1.1753 1.1753 1.2511 1.2511 1.3558 1.3558 1.8813 1.8813 2.0307 2.0307 3.4622 3.4622 3.9658 3.9658 4.1226 4.1226 4.5364 4.5364 6.7988 6.7988 7.5146 7.5146 7.8285 7.8285 8.8325 8.8325 k = 0.0000 0.0000 0.3494 ( 13351 PWs) bands (ev): -13.6521 -13.6521 -13.3045 -13.3045 -13.0424 -13.0424 -12.5132 -12.5132 -12.2766 -12.2766 -12.2224 -12.2224 -12.0118 -12.0118 -11.7191 -11.7191 -10.3211 -10.3211 -9.9828 -9.9828 -8.7806 -8.7806 -6.6472 -6.6472 -3.1968 -3.1968 -3.0189 -3.0189 -2.8204 -2.8204 -2.6440 -2.6440 -2.4936 -2.4936 -2.3462 -2.3462 -1.5610 -1.5610 -1.0538 -1.0538 -0.8626 -0.8626 -0.7919 -0.7919 -0.6121 -0.6121 -0.4131 -0.4131 -0.1480 -0.1480 -0.1098 -0.1098 -0.0258 -0.0258 0.2252 0.2252 0.3409 0.3409 0.4243 0.4243 0.4889 0.4889 0.5148 0.5148 0.6157 0.6157 0.6544 0.6544 0.8906 0.8906 0.9663 0.9663 1.1868 1.1868 1.2470 1.2470 1.3549 1.3549 1.8792 1.8792 2.0268 2.0268 3.4681 3.4681 3.9640 3.9640 4.1174 4.1174 4.5437 4.5437 6.7962 6.7962 7.5059 7.5059 7.8301 7.8301 8.8743 8.8743 k = 0.0000 0.0000 0.3713 ( 13350 PWs) bands (ev): -13.6486 -13.6486 -13.3090 -13.3090 -13.0412 -13.0412 -12.5145 -12.5145 -12.2786 -12.2786 -12.2223 -12.2223 -12.0109 -12.0109 -11.7177 -11.7177 -10.3207 -10.3207 -9.9828 -9.9828 -8.7800 -8.7800 -6.6446 -6.6446 -3.1949 -3.1949 -3.0127 -3.0127 -2.8287 -2.8287 -2.6494 -2.6494 -2.4921 -2.4921 -2.3569 -2.3569 -1.5543 -1.5543 -1.0686 -1.0686 -0.8543 -0.8543 -0.7949 -0.7949 -0.6284 -0.6284 -0.3934 -0.3934 -0.1253 -0.1253 -0.0927 -0.0927 -0.0190 -0.0190 0.2098 0.2098 0.3219 0.3219 0.4123 0.4123 0.4875 0.4875 0.5154 0.5154 0.6201 0.6201 0.6579 0.6579 0.8869 0.8869 0.9717 0.9717 1.1969 1.1969 1.2431 1.2431 1.3544 1.3544 1.8773 1.8773 2.0234 2.0234 3.4735 3.4735 3.9625 3.9625 4.1128 4.1128 4.5501 4.5501 6.7939 6.7939 7.4982 7.4982 7.8319 7.8319 8.9139 8.9139 k = 0.0000 0.0000 0.3931 ( 13343 PWs) bands (ev): -13.6457 -13.6457 -13.3127 -13.3127 -13.0402 -13.0402 -12.5155 -12.5155 -12.2802 -12.2802 -12.2223 -12.2223 -12.0102 -12.0102 -11.7166 -11.7166 -10.3203 -10.3203 -9.9828 -9.9828 -8.7796 -8.7796 -6.6426 -6.6426 -3.1944 -3.1944 -3.0049 -3.0049 -2.8371 -2.8371 -2.6541 -2.6541 -2.4908 -2.4908 -2.3655 -2.3655 -1.5490 -1.5490 -1.0805 -1.0805 -0.8457 -0.8457 -0.7993 -0.7993 -0.6416 -0.6416 -0.3761 -0.3761 -0.1059 -0.1059 -0.0780 -0.0780 -0.0123 -0.0123 0.1965 0.1965 0.3013 0.3013 0.4035 0.4035 0.4865 0.4865 0.5159 0.5159 0.6232 0.6232 0.6623 0.6623 0.8836 0.8836 0.9757 0.9757 1.2054 1.2054 1.2394 1.2394 1.3542 1.3542 1.8759 1.8759 2.0207 2.0207 3.4780 3.4780 3.9613 3.9613 4.1090 4.1090 4.5553 4.5553 6.7921 6.7921 7.4920 7.4920 7.8337 7.8337 8.9504 8.9504 k = 0.0000 0.0000 0.4149 ( 13339 PWs) bands (ev): -13.6436 -13.6436 -13.3154 -13.3154 -13.0395 -13.0395 -12.5162 -12.5162 -12.2814 -12.2814 -12.2222 -12.2222 -12.0097 -12.0097 -11.7157 -11.7157 -10.3201 -10.3201 -9.9828 -9.9828 -8.7792 -8.7792 -6.6411 -6.6411 -3.1946 -3.1946 -2.9972 -2.9972 -2.8446 -2.8446 -2.6576 -2.6576 -2.4897 -2.4897 -2.3716 -2.3716 -1.5452 -1.5452 -1.0894 -1.0894 -0.8370 -0.8370 -0.8049 -0.8049 -0.6512 -0.6512 -0.3624 -0.3624 -0.0912 -0.0912 -0.0663 -0.0663 -0.0066 -0.0066 0.1874 0.1874 0.2816 0.2816 0.3973 0.3973 0.4858 0.4858 0.5162 0.5162 0.6252 0.6252 0.6664 0.6664 0.8810 0.8810 0.9784 0.9784 1.2125 1.2125 1.2358 1.2358 1.3543 1.3543 1.8748 1.8748 2.0187 2.0187 3.4814 3.4814 3.9603 3.9603 4.1062 4.1062 4.5591 4.5591 6.7907 6.7907 7.4874 7.4874 7.8352 7.8352 8.9819 8.9819 k = 0.0000 0.0000 0.4368 ( 13339 PWs) bands (ev): -13.6423 -13.6423 -13.3171 -13.3171 -13.0390 -13.0390 -12.5166 -12.5166 -12.2821 -12.2821 -12.2222 -12.2222 -12.0093 -12.0093 -11.7152 -11.7152 -10.3199 -10.3199 -9.9828 -9.9828 -8.7790 -8.7790 -6.6402 -6.6402 -3.1949 -3.1949 -2.9915 -2.9915 -2.8499 -2.8499 -2.6597 -2.6597 -2.4890 -2.4890 -2.3754 -2.3754 -1.5428 -1.5428 -1.0948 -1.0948 -0.8283 -0.8283 -0.8117 -0.8117 -0.6571 -0.6571 -0.3536 -0.3536 -0.0823 -0.0823 -0.0582 -0.0582 -0.0030 -0.0030 0.1832 0.1832 0.2667 0.2667 0.3937 0.3937 0.4855 0.4855 0.5164 0.5164 0.6264 0.6264 0.6693 0.6693 0.8793 0.8793 0.9799 0.9799 1.2180 1.2180 1.2325 1.2325 1.3544 1.3544 1.8741 1.8741 2.0174 2.0174 3.4835 3.4835 3.9598 3.9598 4.1044 4.1044 4.5615 4.5615 6.7899 6.7899 7.4846 7.4846 7.8361 7.8361 9.0047 9.0047 k = 0.0000 0.0000 0.4586 ( 13340 PWs) bands (ev): -13.6419 -13.6419 -13.3177 -13.3177 -13.0389 -13.0389 -12.5168 -12.5168 -12.2823 -12.2823 -12.2221 -12.2221 -12.0092 -12.0092 -11.7151 -11.7151 -10.3199 -10.3199 -9.9828 -9.9828 -8.7789 -8.7789 -6.6399 -6.6399 -3.1950 -3.1950 -2.9894 -2.9894 -2.8519 -2.8519 -2.6605 -2.6605 -2.4888 -2.4888 -2.3766 -2.3766 -1.5420 -1.5420 -1.0966 -1.0966 -0.8215 -0.8215 -0.8180 -0.8180 -0.6591 -0.6591 -0.3506 -0.3506 -0.0794 -0.0794 -0.0552 -0.0552 -0.0020 -0.0020 0.1823 0.1823 0.2609 0.2609 0.3924 0.3924 0.4854 0.4854 0.5164 0.5164 0.6267 0.6267 0.6703 0.6703 0.8787 0.8787 0.9804 0.9804 1.2205 1.2205 1.2307 1.2307 1.3544 1.3544 1.8739 1.8739 2.0170 2.0170 3.4842 3.4842 3.9596 3.9596 4.1038 4.1038 4.5623 4.5623 6.7896 6.7896 7.4836 7.4836 7.8364 7.8364 9.0135 9.0135 k = 0.5000-0.0740 0.3965 ( 13344 PWs) bands (ev): -13.6147 -13.6147 -13.2736 -13.2736 -13.0725 -13.0725 -12.5285 -12.5285 -12.3016 -12.3016 -12.2361 -12.2361 -12.0551 -12.0551 -11.6987 -11.6987 -10.4454 -10.4454 -9.7842 -9.7842 -8.8235 -8.8235 -6.6037 -6.6037 -3.1915 -3.1915 -2.9647 -2.9647 -2.8581 -2.8581 -2.7293 -2.7293 -2.4475 -2.4475 -2.2959 -2.2959 -1.6385 -1.6385 -1.0266 -1.0266 -0.8771 -0.8771 -0.6668 -0.6668 -0.4258 -0.4258 -0.3184 -0.3184 -0.1986 -0.1986 -0.0937 -0.0937 0.1241 0.1241 0.1657 0.1657 0.2536 0.2536 0.3064 0.3064 0.5016 0.5016 0.5554 0.5554 0.6150 0.6150 0.6230 0.6230 0.7481 0.7481 0.8894 0.8894 1.0464 1.0464 1.1881 1.1881 1.4240 1.4240 1.4726 1.4726 2.0602 2.0602 3.7725 3.7725 3.9850 3.9850 4.2655 4.2655 4.4754 4.4754 6.6666 6.6666 7.4894 7.4894 7.8558 7.8558 9.1692 9.1692 k = 0.4828-0.0715 0.3828 ( 13352 PWs) bands (ev): -13.6148 -13.6148 -13.2741 -13.2741 -13.0722 -13.0722 -12.5283 -12.5283 -12.3014 -12.3014 -12.2362 -12.2362 -12.0547 -12.0547 -11.6989 -11.6989 -10.4452 -10.4452 -9.7848 -9.7848 -8.8234 -8.8234 -6.6037 -6.6037 -3.1909 -3.1909 -2.9688 -2.9688 -2.8544 -2.8544 -2.7272 -2.7272 -2.4470 -2.4470 -2.2994 -2.2994 -1.6378 -1.6378 -1.0283 -1.0283 -0.8758 -0.8758 -0.6658 -0.6658 -0.4268 -0.4268 -0.3291 -0.3291 -0.1863 -0.1863 -0.0960 -0.0960 0.1247 0.1247 0.1668 0.1668 0.2502 0.2502 0.3096 0.3096 0.5008 0.5008 0.5529 0.5529 0.6155 0.6155 0.6242 0.6242 0.7480 0.7480 0.8906 0.8906 1.0472 1.0472 1.1878 1.1878 1.4228 1.4228 1.4747 1.4747 2.0609 2.0609 3.7698 3.7698 3.9845 3.9845 4.2672 4.2672 4.4743 4.4743 6.6672 6.6672 7.4898 7.4898 7.8557 7.8557 9.1679 9.1679 k = 0.4655-0.0689 0.3691 ( 13349 PWs) bands (ev): -13.6151 -13.6151 -13.2752 -13.2752 -13.0715 -13.0715 -12.5278 -12.5278 -12.3008 -12.3008 -12.2365 -12.2365 -12.0534 -12.0534 -11.6993 -11.6993 -10.4449 -10.4449 -9.7866 -9.7866 -8.8232 -8.8232 -6.6037 -6.6037 -3.1890 -3.1890 -2.9791 -2.9791 -2.8454 -2.8454 -2.7208 -2.7208 -2.4457 -2.4457 -2.3096 -2.3096 -1.6356 -1.6356 -1.0329 -1.0329 -0.8729 -0.8729 -0.6623 -0.6623 -0.4309 -0.4309 -0.3503 -0.3503 -0.1617 -0.1617 -0.0999 -0.0999 0.1249 0.1249 0.1713 0.1713 0.2425 0.2425 0.3172 0.3172 0.4987 0.4987 0.5469 0.5469 0.6153 0.6153 0.6281 0.6281 0.7479 0.7479 0.8943 0.8943 1.0495 1.0495 1.1870 1.1870 1.4194 1.4194 1.4806 1.4806 2.0630 2.0630 3.7620 3.7620 3.9829 3.9829 4.2721 4.2721 4.4710 4.4710 6.6691 6.6691 7.4911 7.4911 7.8555 7.8555 9.1639 9.1639 k = 0.4483-0.0664 0.3555 ( 13363 PWs) bands (ev): -13.6156 -13.6156 -13.2771 -13.2771 -13.0704 -13.0704 -12.5269 -12.5269 -12.2999 -12.2999 -12.2369 -12.2369 -12.0514 -12.0514 -11.7002 -11.7002 -10.4443 -10.4443 -9.7895 -9.7895 -8.8228 -8.8228 -6.6037 -6.6037 -3.1862 -3.1862 -2.9916 -2.9916 -2.8348 -2.8348 -2.7102 -2.7102 -2.4436 -2.4436 -2.3259 -2.3259 -1.6320 -1.6320 -1.0397 -1.0397 -0.8701 -0.8701 -0.6559 -0.6559 -0.4412 -0.4412 -0.3681 -0.3681 -0.1483 -0.1483 -0.0926 -0.0926 0.1214 0.1214 0.1803 0.1803 0.2348 0.2348 0.3258 0.3258 0.4954 0.4954 0.5394 0.5394 0.6140 0.6140 0.6331 0.6331 0.7484 0.7484 0.9002 0.9002 1.0528 1.0528 1.1856 1.1856 1.4149 1.4149 1.4894 1.4894 2.0663 2.0663 3.7494 3.7494 3.9805 3.9805 4.2793 4.2793 4.4661 4.4661 6.6723 6.6723 7.4931 7.4931 7.8551 7.8551 9.1571 9.1571 k = 0.4310-0.0638 0.3418 ( 13349 PWs) bands (ev): -13.6163 -13.6163 -13.2794 -13.2794 -13.0690 -13.0690 -12.5257 -12.5257 -12.2986 -12.2986 -12.2374 -12.2374 -12.0489 -12.0489 -11.7013 -11.7013 -10.4435 -10.4435 -9.7936 -9.7936 -8.8222 -8.8222 -6.6038 -6.6038 -3.1833 -3.1833 -3.0033 -3.0033 -2.8249 -2.8249 -2.6957 -2.6957 -2.4412 -2.4412 -2.3471 -2.3471 -1.6272 -1.6272 -1.0475 -1.0475 -0.8695 -0.8695 -0.6460 -0.6460 -0.4592 -0.4592 -0.3762 -0.3762 -0.1566 -0.1566 -0.0681 -0.0681 0.1134 0.1134 0.1921 0.1921 0.2310 0.2310 0.3338 0.3338 0.4914 0.4914 0.5322 0.5322 0.6125 0.6125 0.6368 0.6368 0.7505 0.7505 0.9078 0.9078 1.0563 1.0563 1.1839 1.1839 1.4100 1.4100 1.5004 1.5004 2.0707 2.0707 3.7326 3.7326 3.9776 3.9776 4.2876 4.2876 4.4600 4.4600 6.6767 6.6767 7.4960 7.4960 7.8544 7.8544 9.1468 9.1468 k = 0.4138-0.0613 0.3281 ( 13349 PWs) bands (ev): -13.6173 -13.6173 -13.2821 -13.2821 -13.0673 -13.0673 -12.5244 -12.5244 -12.2969 -12.2969 -12.2378 -12.2378 -12.0459 -12.0459 -11.7026 -11.7026 -10.4424 -10.4424 -9.7986 -9.7986 -8.8215 -8.8215 -6.6041 -6.6041 -3.1812 -3.1812 -3.0118 -3.0118 -2.8166 -2.8166 -2.6784 -2.6784 -2.4399 -2.4399 -2.3707 -2.3707 -1.6214 -1.6214 -1.0556 -1.0556 -0.8726 -0.8726 -0.6328 -0.6328 -0.4813 -0.4813 -0.3764 -0.3764 -0.1733 -0.1733 -0.0424 -0.0424 0.1017 0.1017 0.2021 0.2021 0.2356 0.2356 0.3409 0.3409 0.4874 0.4874 0.5265 0.5265 0.6113 0.6113 0.6377 0.6377 0.7551 0.7551 0.9167 0.9167 1.0595 1.0595 1.1819 1.1819 1.4053 1.4053 1.5132 1.5132 2.0761 2.0761 3.7124 3.7124 3.9744 3.9744 4.2955 4.2955 4.4539 4.4539 6.6822 6.6822 7.4997 7.4997 7.8535 7.8535 9.1328 9.1328 k = 0.3966-0.0587 0.3144 ( 13352 PWs) bands (ev): -13.6186 -13.6186 -13.2849 -13.2849 -13.0654 -13.0654 -12.5228 -12.5228 -12.2950 -12.2950 -12.2380 -12.2380 -12.0426 -12.0426 -11.7042 -11.7042 -10.4409 -10.4409 -9.8047 -9.8047 -8.8206 -8.8206 -6.6045 -6.6045 -3.1807 -3.1807 -3.0154 -3.0154 -2.8100 -2.8100 -2.6597 -2.6597 -2.4438 -2.4438 -2.3912 -2.3912 -1.6147 -1.6147 -1.0634 -1.0634 -0.8795 -0.8795 -0.6180 -0.6180 -0.5028 -0.5028 -0.3720 -0.3720 -0.1921 -0.1921 -0.0241 -0.0241 0.0876 0.0876 0.2081 0.2081 0.2494 0.2494 0.3480 0.3480 0.4843 0.4843 0.5227 0.5227 0.6106 0.6106 0.6353 0.6353 0.7625 0.7625 0.9263 0.9263 1.0618 1.0618 1.1798 1.1798 1.4009 1.4009 1.5277 1.5277 2.0822 2.0822 3.6894 3.6894 3.9712 3.9712 4.3011 4.3011 4.4489 4.4489 6.6889 6.6889 7.5042 7.5042 7.8521 7.8521 9.1145 9.1145 k = 0.3793-0.0561 0.3008 ( 13348 PWs) bands (ev): -13.6203 -13.6203 -13.2876 -13.2876 -13.0636 -13.0636 -12.5212 -12.5212 -12.2927 -12.2927 -12.2379 -12.2379 -12.0392 -12.0392 -11.7061 -11.7061 -10.4391 -10.4391 -9.8116 -9.8116 -8.8196 -8.8196 -6.6053 -6.6053 -3.1823 -3.1823 -3.0132 -3.0132 -2.8049 -2.8049 -2.6419 -2.6419 -2.4599 -2.4599 -2.3997 -2.3997 -1.6076 -1.6076 -1.0703 -1.0703 -0.8895 -0.8895 -0.6053 -0.6053 -0.5200 -0.5200 -0.3650 -0.3650 -0.2103 -0.2103 -0.0168 -0.0168 0.0735 0.0735 0.2116 0.2116 0.2671 0.2671 0.3575 0.3575 0.4827 0.4827 0.5211 0.5211 0.6102 0.6102 0.6308 0.6308 0.7724 0.7724 0.9358 0.9358 1.0629 1.0629 1.1777 1.1777 1.3970 1.3970 1.5436 1.5436 2.0889 2.0889 3.6644 3.6644 3.9680 3.9680 4.3030 4.3030 4.4464 4.4464 6.6965 6.6965 7.5095 7.5095 7.8504 7.8504 9.0916 9.0916 k = 0.3621-0.0536 0.2871 ( 13352 PWs) bands (ev): -13.6225 -13.6225 -13.2900 -13.2900 -13.0617 -13.0617 -12.5195 -12.5195 -12.2902 -12.2902 -12.2375 -12.2375 -12.0358 -12.0358 -11.7081 -11.7081 -10.4369 -10.4369 -9.8193 -9.8193 -8.8184 -8.8184 -6.6064 -6.6064 -3.1858 -3.1858 -3.0055 -3.0055 -2.8011 -2.8011 -2.6277 -2.6277 -2.4835 -2.4835 -2.3976 -2.3976 -1.6003 -1.6003 -1.0761 -1.0761 -0.9013 -0.9013 -0.6013 -0.6013 -0.5281 -0.5281 -0.3565 -0.3565 -0.2258 -0.2258 -0.0214 -0.0214 0.0612 0.0612 0.2116 0.2116 0.2849 0.2849 0.3717 0.3717 0.4829 0.4829 0.5220 0.5220 0.6093 0.6093 0.6262 0.6262 0.7839 0.7839 0.9447 0.9447 1.0630 1.0630 1.1757 1.1757 1.3939 1.3939 1.5608 1.5608 2.0959 2.0959 3.6381 3.6381 3.9651 3.9651 4.3002 4.3002 4.4472 4.4472 6.7051 6.7051 7.5156 7.5156 7.8482 7.8482 9.0641 9.0641 k = 0.3448-0.0510 0.2734 ( 13351 PWs) bands (ev): -13.6252 -13.6252 -13.2919 -13.2919 -13.0600 -13.0600 -12.5178 -12.5178 -12.2874 -12.2874 -12.2368 -12.2368 -12.0327 -12.0327 -11.7102 -11.7102 -10.4343 -10.4343 -9.8277 -9.8277 -8.8171 -8.8171 -6.6080 -6.6080 -3.1903 -3.1903 -2.9931 -2.9931 -2.7987 -2.7987 -2.6223 -2.6223 -2.5030 -2.5030 -2.3911 -2.3911 -1.5933 -1.5933 -1.0805 -1.0805 -0.9137 -0.9137 -0.6095 -0.6095 -0.5256 -0.5256 -0.3482 -0.3482 -0.2364 -0.2364 -0.0356 -0.0356 0.0514 0.0514 0.2061 0.2061 0.3016 0.3016 0.3900 0.3900 0.4845 0.4845 0.5254 0.5254 0.6065 0.6065 0.6242 0.6242 0.7963 0.7963 0.9523 0.9523 1.0625 1.0625 1.1738 1.1738 1.3914 1.3914 1.5790 1.5790 2.1028 2.1028 3.6111 3.6111 3.9626 3.9626 4.2928 4.2928 4.4509 4.4509 6.7145 6.7145 7.5224 7.5224 7.8456 7.8456 9.0322 9.0322 k = 0.3276-0.0485 0.2598 ( 13351 PWs) bands (ev): -13.6284 -13.6284 -13.2931 -13.2931 -13.0584 -13.0584 -12.5162 -12.5162 -12.2844 -12.2844 -12.2357 -12.2357 -12.0299 -12.0299 -11.7125 -11.7125 -10.4311 -10.4311 -9.8367 -9.8367 -8.8158 -8.8158 -6.6100 -6.6100 -3.1951 -3.1951 -2.9775 -2.9775 -2.7978 -2.7978 -2.6304 -2.6304 -2.5101 -2.5101 -2.3827 -2.3827 -1.5869 -1.5869 -1.0831 -1.0831 -0.9253 -0.9253 -0.6253 -0.6253 -0.5190 -0.5190 -0.3422 -0.3422 -0.2395 -0.2395 -0.0558 -0.0558 0.0432 0.0432 0.1952 0.1952 0.3173 0.3173 0.4095 0.4095 0.4871 0.4871 0.5313 0.5313 0.6030 0.6030 0.6253 0.6253 0.8090 0.8090 0.9583 0.9583 1.0618 1.0618 1.1722 1.1722 1.3895 1.3895 1.5982 1.5982 2.1095 2.1095 3.5841 3.5841 3.9606 3.9606 4.2819 4.2819 4.4566 4.4566 6.7245 6.7245 7.5298 7.5298 7.8427 7.8427 8.9963 8.9963 k = 0.3103-0.0459 0.2461 ( 13348 PWs) bands (ev): -13.6321 -13.6321 -13.2935 -13.2935 -13.0571 -13.0571 -12.5146 -12.5146 -12.2813 -12.2813 -12.2343 -12.2343 -12.0274 -12.0274 -11.7148 -11.7148 -10.4275 -10.4275 -9.8461 -9.8461 -8.8143 -8.8143 -6.6126 -6.6126 -3.1992 -3.1992 -2.9602 -2.9602 -2.7993 -2.7993 -2.6489 -2.6489 -2.5053 -2.5053 -2.3732 -2.3732 -1.5816 -1.5816 -1.0837 -1.0837 -0.9353 -0.9353 -0.6442 -0.6442 -0.5136 -0.5136 -0.3406 -0.3406 -0.2342 -0.2342 -0.0782 -0.0782 0.0356 0.0356 0.1803 0.1803 0.3316 0.3316 0.4267 0.4267 0.4898 0.4898 0.5384 0.5384 0.6020 0.6020 0.6286 0.6286 0.8216 0.8216 0.9624 0.9624 1.0614 1.0614 1.1711 1.1711 1.3881 1.3881 1.6180 1.6180 2.1157 2.1157 3.5575 3.5575 3.9593 3.9593 4.2688 4.2688 4.4632 4.4632 6.7351 6.7351 7.5376 7.5376 7.8397 7.8397 8.9570 8.9570 k = 0.2931-0.0434 0.2324 ( 13352 PWs) bands (ev): -13.6363 -13.6363 -13.2931 -13.2931 -13.0561 -13.0561 -12.5130 -12.5130 -12.2780 -12.2780 -12.2327 -12.2327 -12.0254 -12.0254 -11.7172 -11.7172 -10.4233 -10.4233 -9.8559 -9.8559 -8.8127 -8.8127 -6.6159 -6.6159 -3.2022 -3.2022 -2.9436 -2.9436 -2.8038 -2.8038 -2.6690 -2.6690 -2.4948 -2.4948 -2.3631 -2.3631 -1.5779 -1.5779 -1.0822 -1.0822 -0.9429 -0.9429 -0.6642 -0.6642 -0.5110 -0.5110 -0.3435 -0.3435 -0.2228 -0.2228 -0.0997 -0.0997 0.0283 0.0283 0.1632 0.1632 0.3444 0.3444 0.4397 0.4397 0.4921 0.4921 0.5443 0.5443 0.6056 0.6056 0.6335 0.6335 0.8338 0.8338 0.9648 0.9648 1.0614 1.0614 1.1709 1.1709 1.3871 1.3871 1.6383 1.6383 2.1212 2.1212 3.5319 3.5319 3.9588 3.9588 4.2543 4.2543 4.4697 4.4697 6.7461 6.7461 7.5456 7.5456 7.8368 7.8368 8.9149 8.9149 k = 0.2759-0.0408 0.2187 ( 13354 PWs) bands (ev): -13.6409 -13.6409 -13.2917 -13.2917 -13.0553 -13.0553 -12.5114 -12.5114 -12.2746 -12.2746 -12.2309 -12.2309 -12.0239 -12.0239 -11.7196 -11.7196 -10.4185 -10.4185 -9.8659 -9.8659 -8.8111 -8.8111 -6.6197 -6.6197 -3.2037 -3.2037 -2.9309 -2.9309 -2.8103 -2.8103 -2.6841 -2.6841 -2.4829 -2.4829 -2.3527 -2.3527 -1.5760 -1.5760 -1.0784 -1.0784 -0.9477 -0.9477 -0.6845 -0.6845 -0.5107 -0.5107 -0.3501 -0.3501 -0.2113 -0.2113 -0.1165 -0.1165 0.0213 0.0213 0.1455 0.1455 0.3554 0.3554 0.4476 0.4476 0.4948 0.4948 0.5479 0.5479 0.6120 0.6120 0.6410 0.6410 0.8455 0.8455 0.9660 0.9660 1.0612 1.0612 1.1721 1.1721 1.3862 1.3862 1.6590 1.6590 2.1258 2.1258 3.5079 3.5079 3.9592 3.9592 4.2395 4.2395 4.4756 4.4756 6.7572 6.7572 7.5535 7.5535 7.8343 7.8343 8.8708 8.8708 k = 0.2586-0.0383 0.2051 ( 13347 PWs) bands (ev): -13.6460 -13.6460 -13.2895 -13.2895 -13.0549 -13.0549 -12.5098 -12.5098 -12.2711 -12.2711 -12.2291 -12.2291 -12.0229 -12.0229 -11.7221 -11.7221 -10.4133 -10.4133 -9.8761 -9.8761 -8.8094 -8.8094 -6.6241 -6.6241 -3.2039 -3.2039 -2.9270 -2.9270 -2.8147 -2.8147 -2.6915 -2.6915 -2.4715 -2.4715 -2.3419 -2.3419 -1.5763 -1.5763 -1.0725 -1.0725 -0.9496 -0.9496 -0.7045 -0.7045 -0.5115 -0.5115 -0.3596 -0.3596 -0.2064 -0.2064 -0.1245 -0.1245 0.0150 0.0150 0.1287 0.1287 0.3649 0.3649 0.4495 0.4495 0.4996 0.4996 0.5506 0.5506 0.6170 0.6170 0.6516 0.6516 0.8567 0.8567 0.9664 0.9664 1.0602 1.0602 1.1752 1.1752 1.3855 1.3855 1.6799 1.6799 2.1294 2.1294 3.4858 3.4858 3.9605 3.9605 4.2250 4.2250 4.4804 4.4804 6.7682 6.7682 7.5611 7.5611 7.8326 7.8326 8.8254 8.8254 k = 0.2414-0.0357 0.1914 ( 13352 PWs) bands (ev): -13.6514 -13.6514 -13.2865 -13.2865 -13.0547 -13.0547 -12.5082 -12.5082 -12.2675 -12.2675 -12.2274 -12.2274 -12.0223 -12.0223 -11.7246 -11.7246 -10.4075 -10.4075 -9.8864 -9.8864 -8.8076 -8.8076 -6.6291 -6.6291 -3.2030 -3.2030 -2.9350 -2.9350 -2.8124 -2.8124 -2.6916 -2.6916 -2.4619 -2.4619 -2.3305 -2.3305 -1.5788 -1.5788 -1.0647 -1.0647 -0.9485 -0.9485 -0.7236 -0.7236 -0.5124 -0.5124 -0.3720 -0.3720 -0.2106 -0.2106 -0.1238 -0.1238 0.0098 0.0098 0.1142 0.1142 0.3729 0.3729 0.4456 0.4456 0.5070 0.5070 0.5536 0.5536 0.6188 0.6188 0.6639 0.6639 0.8672 0.8672 0.9661 0.9661 1.0578 1.0578 1.1806 1.1806 1.3850 1.3850 1.7009 1.7009 2.1318 2.1318 3.4661 3.4661 3.9626 3.9626 4.2111 4.2111 4.4838 4.4838 6.7790 6.7790 7.5680 7.5680 7.8320 7.8320 8.7792 8.7792 k = 0.2241-0.0332 0.1777 ( 13351 PWs) bands (ev): -13.6570 -13.6570 -13.2827 -13.2827 -13.0549 -13.0549 -12.5066 -12.5066 -12.2640 -12.2640 -12.2258 -12.2258 -12.0222 -12.0222 -11.7271 -11.7271 -10.4012 -10.4012 -9.8966 -9.8966 -8.8059 -8.8059 -6.6346 -6.6346 -3.2018 -3.2018 -2.9514 -2.9514 -2.8045 -2.8045 -2.6858 -2.6858 -2.4549 -2.4549 -2.3183 -2.3183 -1.5835 -1.5835 -1.0558 -1.0558 -0.9442 -0.9442 -0.7415 -0.7415 -0.5125 -0.5125 -0.3868 -0.3868 -0.2195 -0.2195 -0.1214 -0.1214 0.0060 0.0060 0.1037 0.1037 0.3797 0.3797 0.4379 0.4379 0.5157 0.5157 0.5573 0.5573 0.6182 0.6182 0.6762 0.6762 0.8767 0.8767 0.9646 0.9646 1.0539 1.0539 1.1883 1.1883 1.3847 1.3847 1.7218 1.7218 2.1330 2.1330 3.4490 3.4490 3.9654 3.9654 4.1983 4.1983 4.4860 4.4860 6.7892 6.7892 7.5740 7.5740 7.8330 7.8330 8.7329 8.7329 k = 0.2069-0.0306 0.1641 ( 13356 PWs) bands (ev): -13.6627 -13.6627 -13.2783 -13.2783 -13.0553 -13.0553 -12.5050 -12.5050 -12.2605 -12.2605 -12.2243 -12.2243 -12.0225 -12.0225 -11.7295 -11.7295 -10.3945 -10.3945 -9.9067 -9.9067 -8.8041 -8.8041 -6.6405 -6.6405 -3.2014 -3.2014 -2.9699 -2.9699 -2.7949 -2.7949 -2.6755 -2.6755 -2.4511 -2.4511 -2.3048 -2.3048 -1.5903 -1.5903 -1.0467 -1.0467 -0.9369 -0.9369 -0.7576 -0.7576 -0.5113 -0.5113 -0.4030 -0.4030 -0.2289 -0.2289 -0.1232 -0.1232 0.0029 0.0029 0.0985 0.0985 0.3850 0.3850 0.4282 0.4282 0.5242 0.5242 0.5618 0.5618 0.6163 0.6163 0.6878 0.6878 0.8850 0.8850 0.9612 0.9612 1.0489 1.0489 1.1983 1.1983 1.3846 1.3846 1.7426 1.7426 2.1330 2.1330 3.4348 3.4348 3.9688 3.9688 4.1869 4.1869 4.4867 4.4867 6.7987 6.7987 7.5790 7.5790 7.8358 7.8358 8.6872 8.6872 k = 0.1897-0.0281 0.1504 ( 13362 PWs) bands (ev): -13.6683 -13.6683 -13.2734 -13.2734 -13.0560 -13.0560 -12.5033 -12.5033 -12.2570 -12.2570 -12.2229 -12.2229 -12.0231 -12.0231 -11.7320 -11.7320 -10.3874 -10.3874 -9.9166 -9.9166 -8.8024 -8.8024 -6.6466 -6.6466 -3.2033 -3.2033 -2.9854 -2.9854 -2.7861 -2.7861 -2.6621 -2.6621 -2.4507 -2.4507 -2.2898 -2.2898 -1.5990 -1.5990 -1.0386 -1.0386 -0.9263 -0.9263 -0.7718 -0.7718 -0.5089 -0.5089 -0.4189 -0.4189 -0.2375 -0.2375 -0.1302 -0.1302 -0.0010 -0.0010 0.0989 0.0989 0.3881 0.3881 0.4183 0.4183 0.5309 0.5309 0.5675 0.5675 0.6147 0.6147 0.6986 0.6986 0.8915 0.8915 0.9552 0.9552 1.0434 1.0434 1.2099 1.2099 1.3847 1.3847 1.7630 1.7630 2.1317 2.1317 3.4236 3.4236 3.9723 3.9723 4.1772 4.1772 4.4862 4.4862 6.8072 6.8072 7.5829 7.5829 7.8404 7.8404 8.6424 8.6424 k = 0.1724-0.0255 0.1367 ( 13356 PWs) bands (ev): -13.6739 -13.6739 -13.2681 -13.2681 -13.0569 -13.0569 -12.5018 -12.5018 -12.2538 -12.2538 -12.2218 -12.2218 -12.0240 -12.0240 -11.7345 -11.7345 -10.3801 -10.3801 -9.9262 -9.9262 -8.8008 -8.8008 -6.6530 -6.6530 -3.2089 -3.2089 -2.9944 -2.9944 -2.7791 -2.7791 -2.6471 -2.6471 -2.4538 -2.4538 -2.2731 -2.2731 -1.6090 -1.6090 -1.0325 -1.0325 -0.9127 -0.9127 -0.7839 -0.7839 -0.5061 -0.5061 -0.4323 -0.4323 -0.2452 -0.2452 -0.1409 -0.1409 -0.0068 -0.0068 0.1034 0.1034 0.3864 0.3864 0.4113 0.4113 0.5348 0.5348 0.5745 0.5745 0.6151 0.6151 0.7087 0.7087 0.8953 0.8953 0.9467 0.9467 1.0379 1.0379 1.2227 1.2227 1.3850 1.3850 1.7830 1.7830 2.1292 2.1292 3.4155 3.4155 3.9758 3.9758 4.1695 4.1695 4.4845 4.4845 6.8147 6.8147 7.5858 7.5858 7.8468 7.8468 8.5991 8.5991 k = 0.1552-0.0230 0.1230 ( 13362 PWs) bands (ev): -13.6793 -13.6793 -13.2626 -13.2626 -13.0580 -13.0580 -12.5002 -12.5002 -12.2507 -12.2507 -12.2207 -12.2207 -12.0251 -12.0251 -11.7368 -11.7368 -10.3727 -10.3727 -9.9353 -9.9353 -8.7992 -8.7992 -6.6594 -6.6594 -3.2188 -3.2188 -2.9955 -2.9955 -2.7739 -2.7739 -2.6321 -2.6321 -2.4598 -2.4598 -2.2550 -2.2550 -1.6200 -1.6200 -1.0289 -1.0289 -0.8966 -0.8966 -0.7940 -0.7940 -0.5043 -0.5043 -0.4411 -0.4411 -0.2521 -0.2521 -0.1529 -0.1529 -0.0145 -0.0145 0.1092 0.1092 0.3778 0.3778 0.4093 0.4093 0.5362 0.5362 0.5829 0.5829 0.6184 0.6184 0.7181 0.7181 0.8956 0.8956 0.9364 0.9364 1.0330 1.0330 1.2361 1.2361 1.3853 1.3853 1.8025 1.8025 2.1255 2.1255 3.4102 3.4102 3.9787 3.9787 4.1640 4.1640 4.4818 4.4818 6.8208 6.8208 7.5880 7.5880 7.8546 7.8546 8.5579 8.5579 k = 0.1379-0.0204 0.1094 ( 13361 PWs) bands (ev): -13.6844 -13.6844 -13.2571 -13.2571 -13.0593 -13.0593 -12.4988 -12.4988 -12.2480 -12.2480 -12.2198 -12.2198 -12.0263 -12.0263 -11.7391 -11.7391 -10.3654 -10.3654 -9.9440 -9.9440 -8.7976 -8.7976 -6.6656 -6.6656 -3.2323 -3.2323 -2.9888 -2.9888 -2.7702 -2.7702 -2.6188 -2.6188 -2.4679 -2.4679 -2.2359 -2.2359 -1.6316 -1.6316 -1.0278 -1.0278 -0.8795 -0.8795 -0.8018 -0.8018 -0.5043 -0.5043 -0.4445 -0.4445 -0.2580 -0.2580 -0.1638 -0.1638 -0.0238 -0.0238 0.1138 0.1138 0.3653 0.3653 0.4093 0.4093 0.5365 0.5365 0.5922 0.5922 0.6244 0.6244 0.7263 0.7263 0.8916 0.8916 0.9256 0.9256 1.0289 1.0289 1.2495 1.2495 1.3854 1.3854 1.8212 1.8212 2.1208 2.1208 3.4075 3.4075 3.9809 3.9809 4.1608 4.1608 4.4782 4.4782 6.8257 6.8257 7.5898 7.5898 7.8635 7.8635 8.5191 8.5191 k = 0.1207-0.0179 0.0957 ( 13369 PWs) bands (ev): -13.6890 -13.6890 -13.2516 -13.2516 -13.0606 -13.0606 -12.4974 -12.4974 -12.2455 -12.2455 -12.2189 -12.2189 -12.0276 -12.0276 -11.7413 -11.7413 -10.3582 -10.3582 -9.9520 -9.9520 -8.7963 -8.7963 -6.6716 -6.6716 -3.2478 -3.2478 -2.9757 -2.9757 -2.7680 -2.7680 -2.6088 -2.6088 -2.4766 -2.4766 -2.2163 -2.2163 -1.6432 -1.6432 -1.0287 -1.0287 -0.8643 -0.8643 -0.8059 -0.8059 -0.5053 -0.5053 -0.4442 -0.4442 -0.2617 -0.2617 -0.1723 -0.1723 -0.0342 -0.0342 0.1152 0.1152 0.3518 0.3518 0.4091 0.4091 0.5374 0.5374 0.6019 0.6019 0.6324 0.6324 0.7331 0.7331 0.8833 0.8833 0.9155 0.9155 1.0257 1.0257 1.2625 1.2625 1.3853 1.3853 1.8390 1.8390 2.1152 2.1152 3.4070 3.4070 3.9820 3.9820 4.1599 4.1599 4.4740 4.4740 6.8294 6.8294 7.5913 7.5913 7.8730 7.8730 8.4834 8.4834 k = 0.1034-0.0153 0.0820 ( 13363 PWs) bands (ev): -13.6932 -13.6932 -13.2465 -13.2465 -13.0619 -13.0619 -12.4962 -12.4962 -12.2434 -12.2434 -12.2181 -12.2181 -12.0289 -12.0289 -11.7433 -11.7433 -10.3515 -10.3515 -9.9594 -9.9594 -8.7950 -8.7950 -6.6772 -6.6772 -3.2637 -3.2637 -2.9577 -2.9577 -2.7670 -2.7670 -2.6036 -2.6036 -2.4843 -2.4843 -2.1970 -2.1970 -1.6545 -1.6545 -1.0309 -1.0309 -0.8561 -0.8561 -0.8024 -0.8024 -0.5060 -0.5060 -0.4440 -0.4440 -0.2614 -0.2614 -0.1777 -0.1777 -0.0455 -0.0455 0.1123 0.1123 0.3385 0.3385 0.4080 0.4080 0.5401 0.5401 0.6116 0.6116 0.6417 0.6417 0.7377 0.7377 0.8725 0.8725 0.9059 0.9059 1.0235 1.0235 1.2747 1.2747 1.3848 1.3848 1.8558 1.8558 2.1089 2.1089 3.4082 3.4082 3.9822 3.9822 4.1610 4.1610 4.4693 4.4693 6.8320 6.8320 7.5927 7.5927 7.8826 7.8826 8.4510 8.4510 k = 0.0862-0.0128 0.0684 ( 13369 PWs) bands (ev): -13.6969 -13.6969 -13.2418 -13.2418 -13.0631 -13.0631 -12.4952 -12.4952 -12.2417 -12.2417 -12.2173 -12.2173 -12.0301 -12.0301 -11.7450 -11.7450 -10.3453 -10.3453 -9.9659 -9.9659 -8.7939 -8.7939 -6.6822 -6.6822 -3.2788 -3.2788 -2.9365 -2.9365 -2.7675 -2.7675 -2.6043 -2.6043 -2.4894 -2.4894 -2.1788 -2.1788 -1.6649 -1.6649 -1.0338 -1.0338 -0.8570 -0.8570 -0.7898 -0.7898 -0.5058 -0.5058 -0.4463 -0.4463 -0.2552 -0.2552 -0.1800 -0.1800 -0.0574 -0.0574 0.1047 0.1047 0.3265 0.3265 0.4062 0.4062 0.5449 0.5449 0.6209 0.6209 0.6514 0.6514 0.7394 0.7394 0.8621 0.8621 0.8961 0.8961 1.0222 1.0222 1.2860 1.2860 1.3839 1.3839 1.8712 1.8712 2.1021 2.1021 3.4106 3.4106 3.9815 3.9815 4.1636 4.1636 4.4644 4.4644 6.8337 6.8337 7.5942 7.5942 7.8918 7.8918 8.4226 8.4226 k = 0.0690-0.0102 0.0547 ( 13369 PWs) bands (ev): -13.7000 -13.7000 -13.2377 -13.2377 -13.0643 -13.0643 -12.4944 -12.4944 -12.2403 -12.2403 -12.2166 -12.2166 -12.0312 -12.0312 -11.7466 -11.7466 -10.3399 -10.3399 -9.9714 -9.9714 -8.7930 -8.7930 -6.6864 -6.6864 -3.2921 -3.2921 -2.9133 -2.9133 -2.7697 -2.7697 -2.6105 -2.6105 -2.4914 -2.4914 -2.1625 -2.1625 -1.6741 -1.6741 -1.0368 -1.0368 -0.8626 -0.8626 -0.7729 -0.7729 -0.5059 -0.5059 -0.4510 -0.4510 -0.2430 -0.2430 -0.1797 -0.1797 -0.0696 -0.0696 0.0930 0.0930 0.3165 0.3165 0.4040 0.4040 0.5511 0.5511 0.6294 0.6294 0.6608 0.6608 0.7378 0.7378 0.8541 0.8541 0.8860 0.8860 1.0214 1.0214 1.2959 1.2959 1.3826 1.3826 1.8849 1.8849 2.0954 2.0954 3.4136 3.4136 3.9803 3.9803 4.1672 4.1672 4.4597 4.4597 6.8346 6.8346 7.5957 7.5957 7.9000 7.9000 8.3985 8.3985 k = 0.0517-0.0077 0.0410 ( 13359 PWs) bands (ev): -13.7024 -13.7024 -13.2344 -13.2344 -13.0653 -13.0653 -12.4937 -12.4937 -12.2393 -12.2393 -12.2160 -12.2160 -12.0321 -12.0321 -11.7478 -11.7478 -10.3355 -10.3355 -9.9759 -9.9759 -8.7922 -8.7922 -6.6899 -6.6899 -3.3029 -3.3029 -2.8895 -2.8895 -2.7738 -2.7738 -2.6201 -2.6201 -2.4912 -2.4912 -2.1487 -2.1487 -1.6817 -1.6817 -1.0396 -1.0396 -0.8692 -0.8692 -0.7559 -0.7559 -0.5077 -0.5077 -0.4559 -0.4559 -0.2264 -0.2264 -0.1779 -0.1779 -0.0816 -0.0816 0.0786 0.0786 0.3088 0.3088 0.4020 0.4020 0.5580 0.5580 0.6369 0.6369 0.6690 0.6690 0.7335 0.7335 0.8496 0.8496 0.8759 0.8759 1.0210 1.0210 1.3042 1.3042 1.3810 1.3810 1.8965 1.8965 2.0891 2.0891 3.4166 3.4166 3.9789 3.9789 4.1709 4.1709 4.4555 4.4555 6.8350 6.8350 7.5970 7.5970 7.9070 7.9070 8.3792 8.3792 k = 0.0345-0.0051 0.0273 ( 13361 PWs) bands (ev): -13.7042 -13.7042 -13.2319 -13.2319 -13.0660 -13.0660 -12.4932 -12.4932 -12.2386 -12.2386 -12.2155 -12.2155 -12.0328 -12.0328 -11.7487 -11.7487 -10.3322 -10.3322 -9.9792 -9.9792 -8.7917 -8.7917 -6.6924 -6.6924 -3.3109 -3.3109 -2.8668 -2.8668 -2.7803 -2.7803 -2.6300 -2.6300 -2.4899 -2.4899 -2.1384 -2.1384 -1.6873 -1.6873 -1.0418 -1.0418 -0.8749 -0.8749 -0.7413 -0.7413 -0.5119 -0.5119 -0.4588 -0.4588 -0.2084 -0.2084 -0.1759 -0.1759 -0.0924 -0.0924 0.0643 0.0643 0.3034 0.3034 0.4003 0.4003 0.5644 0.5644 0.6433 0.6433 0.6749 0.6749 0.7282 0.7282 0.8483 0.8483 0.8667 0.8667 1.0208 1.0208 1.3107 1.3107 1.3794 1.3794 1.9054 1.9054 2.0839 2.0839 3.4191 3.4191 3.9777 3.9777 4.1742 4.1742 4.4521 4.4521 6.8351 6.8351 7.5981 7.5981 7.9122 7.9122 8.3651 8.3651 k = 0.0172-0.0026 0.0137 ( 13360 PWs) bands (ev): -13.7053 -13.7053 -13.2304 -13.2304 -13.0665 -13.0665 -12.4929 -12.4929 -12.2382 -12.2382 -12.2152 -12.2152 -12.0332 -12.0332 -11.7493 -11.7493 -10.3302 -10.3302 -9.9812 -9.9812 -8.7914 -8.7914 -6.6940 -6.6940 -3.3158 -3.3158 -2.8481 -2.8481 -2.7884 -2.7884 -2.6374 -2.6374 -2.4888 -2.4888 -2.1319 -2.1319 -1.6908 -1.6908 -1.0432 -1.0432 -0.8787 -0.8787 -0.7313 -0.7313 -0.5164 -0.5164 -0.4598 -0.4598 -0.1923 -0.1923 -0.1760 -0.1760 -0.1004 -0.1004 0.0534 0.0534 0.3003 0.3003 0.3992 0.3992 0.5689 0.5689 0.6479 0.6479 0.6778 0.6778 0.7242 0.7242 0.8497 0.8497 0.8590 0.8590 1.0207 1.0207 1.3148 1.3148 1.3781 1.3781 1.9111 1.9111 2.0804 2.0804 3.4208 3.4208 3.9768 3.9768 4.1764 4.1764 4.4499 4.4499 6.8351 6.8351 7.5988 7.5988 7.9155 7.9155 8.3565 8.3565 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 k = 0.0000 0.0163 0.0146 ( 13351 PWs) bands (ev): -13.7053 -13.7053 -13.2301 -13.2301 -13.0666 -13.0666 -12.4931 -12.4931 -12.2381 -12.2381 -12.2152 -12.2152 -12.0332 -12.0332 -11.7494 -11.7494 -10.3295 -10.3295 -9.9817 -9.9817 -8.7913 -8.7913 -6.6942 -6.6942 -3.3170 -3.3170 -2.8416 -2.8416 -2.7922 -2.7922 -2.6397 -2.6397 -2.4880 -2.4880 -2.1310 -2.1310 -1.6903 -1.6903 -1.0422 -1.0422 -0.8800 -0.8800 -0.7283 -0.7283 -0.5184 -0.5184 -0.4602 -0.4602 -0.1932 -0.1932 -0.1711 -0.1711 -0.1070 -0.1070 0.0545 0.0545 0.3001 0.3001 0.3986 0.3986 0.5686 0.5686 0.6486 0.6486 0.6800 0.6800 0.7218 0.7218 0.8485 0.8485 0.8587 0.8587 1.0217 1.0217 1.3158 1.3158 1.3778 1.3778 1.9119 1.9119 2.0793 2.0793 3.4216 3.4216 3.9763 3.9763 4.1775 4.1775 4.4492 4.4492 6.8353 6.8353 7.5986 7.5986 7.9153 7.9153 8.3571 8.3571 k = 0.0000 0.0325 0.0293 ( 13355 PWs) bands (ev): -13.7046 -13.7046 -13.2309 -13.2309 -13.0663 -13.0663 -12.4938 -12.4938 -12.2385 -12.2385 -12.2155 -12.2155 -12.0326 -12.0326 -11.7491 -11.7491 -10.3297 -10.3297 -9.9811 -9.9811 -8.7916 -8.7916 -6.6935 -6.6935 -3.3158 -3.3158 -2.8469 -2.8469 -2.7904 -2.7904 -2.6386 -2.6386 -2.4870 -2.4870 -2.1351 -2.1351 -1.6851 -1.6851 -1.0378 -1.0378 -0.8797 -0.8797 -0.7301 -0.7301 -0.5188 -0.5188 -0.4607 -0.4607 -0.2069 -0.2069 -0.1658 -0.1658 -0.1138 -0.1138 0.0680 0.0680 0.3025 0.3025 0.3979 0.3979 0.5629 0.5629 0.6459 0.6459 0.6839 0.6839 0.7189 0.7189 0.8446 0.8446 0.8646 0.8646 1.0246 1.0246 1.3143 1.3143 1.3781 1.3781 1.9086 1.9086 2.0795 2.0795 3.4224 3.4224 3.9757 3.9757 4.1782 4.1782 4.4493 4.4493 6.8361 6.8361 7.5973 7.5973 7.9116 7.9116 8.3674 8.3674 k = 0.0000 0.0488 0.0439 ( 13358 PWs) bands (ev): -13.7033 -13.7033 -13.2321 -13.2321 -13.0659 -13.0659 -12.4950 -12.4950 -12.2391 -12.2391 -12.2160 -12.2160 -12.0317 -12.0317 -11.7486 -11.7486 -10.3300 -10.3300 -9.9802 -9.9802 -8.7920 -8.7920 -6.6922 -6.6922 -3.3138 -3.3138 -2.8548 -2.8548 -2.7880 -2.7880 -2.6369 -2.6369 -2.4853 -2.4853 -2.1416 -2.1416 -1.6766 -1.6766 -1.0305 -1.0305 -0.8792 -0.8792 -0.7330 -0.7330 -0.5197 -0.5197 -0.4613 -0.4613 -0.2223 -0.2223 -0.1694 -0.1694 -0.1154 -0.1154 0.0861 0.0861 0.3064 0.3064 0.3968 0.3968 0.5540 0.5540 0.6422 0.6422 0.6884 0.6884 0.7146 0.7146 0.8416 0.8416 0.8711 0.8711 1.0292 1.0292 1.3120 1.3120 1.3786 1.3786 1.9030 1.9030 2.0798 2.0798 3.4236 3.4236 3.9748 3.9748 4.1794 4.1794 4.4494 4.4494 6.8373 6.8373 7.5951 7.5951 7.9057 7.9057 8.3844 8.3844 k = 0.0000 0.0650 0.0585 ( 13367 PWs) bands (ev): -13.7015 -13.7015 -13.2338 -13.2338 -13.0655 -13.0655 -12.4967 -12.4967 -12.2399 -12.2399 -12.2167 -12.2167 -12.0305 -12.0305 -11.7479 -11.7479 -10.3305 -10.3305 -9.9789 -9.9789 -8.7926 -8.7926 -6.6904 -6.6904 -3.3109 -3.3109 -2.8647 -2.8647 -2.7855 -2.7855 -2.6349 -2.6349 -2.4829 -2.4829 -2.1507 -2.1507 -1.6650 -1.6650 -1.0204 -1.0204 -0.8787 -0.8787 -0.7369 -0.7369 -0.5216 -0.5216 -0.4618 -0.4618 -0.2398 -0.2398 -0.1802 -0.1802 -0.1100 -0.1100 0.1059 0.1059 0.3118 0.3118 0.3953 0.3953 0.5426 0.5426 0.6377 0.6377 0.6914 0.6914 0.7103 0.7103 0.8397 0.8397 0.8779 0.8779 1.0354 1.0354 1.3089 1.3089 1.3793 1.3793 1.8954 1.8954 2.0803 2.0803 3.4252 3.4252 3.9735 3.9735 4.1810 4.1810 4.4496 4.4496 6.8390 6.8390 7.5921 7.5921 7.8981 7.8981 8.4074 8.4074 k = 0.0000 0.0813 0.0731 ( 13367 PWs) bands (ev): -13.6992 -13.6992 -13.2359 -13.2359 -13.0650 -13.0650 -12.4989 -12.4989 -12.2409 -12.2409 -12.2175 -12.2175 -12.0289 -12.0289 -11.7470 -11.7470 -10.3311 -10.3311 -9.9773 -9.9773 -8.7934 -8.7934 -6.6881 -6.6881 -3.3072 -3.3072 -2.8760 -2.8760 -2.7831 -2.7831 -2.6326 -2.6326 -2.4799 -2.4799 -2.1619 -2.1619 -1.6504 -1.6504 -1.0078 -1.0078 -0.8782 -0.8782 -0.7418 -0.7418 -0.5245 -0.5245 -0.4622 -0.4622 -0.2591 -0.2591 -0.1923 -0.1923 -0.1014 -0.1014 0.1254 0.1254 0.3184 0.3184 0.3934 0.3934 0.5291 0.5291 0.6322 0.6322 0.6901 0.6901 0.7087 0.7087 0.8392 0.8392 0.8852 0.8852 1.0426 1.0426 1.3051 1.3051 1.3801 1.3801 1.8859 1.8859 2.0807 2.0807 3.4274 3.4274 3.9719 3.9719 4.1831 4.1831 4.4499 4.4499 6.8413 6.8413 7.5883 7.5883 7.8892 7.8892 8.4360 8.4360 k = 0.0000 0.0975 0.0878 ( 13369 PWs) bands (ev): -13.6964 -13.6964 -13.2383 -13.2383 -13.0645 -13.0645 -12.5015 -12.5015 -12.2420 -12.2420 -12.2184 -12.2184 -12.0271 -12.0271 -11.7460 -11.7460 -10.3319 -10.3319 -9.9752 -9.9752 -8.7943 -8.7943 -6.6853 -6.6853 -3.3028 -3.3028 -2.8883 -2.8883 -2.7810 -2.7810 -2.6303 -2.6303 -2.4765 -2.4765 -2.1752 -2.1752 -1.6332 -1.6332 -0.9929 -0.9929 -0.8779 -0.8779 -0.7476 -0.7476 -0.5288 -0.5288 -0.4629 -0.4629 -0.2789 -0.2789 -0.2028 -0.2028 -0.0920 -0.0920 0.1437 0.1437 0.3259 0.3259 0.3915 0.3915 0.5142 0.5142 0.6255 0.6255 0.6841 0.6841 0.7100 0.7100 0.8401 0.8401 0.8929 0.8929 1.0508 1.0508 1.3006 1.3006 1.3812 1.3812 1.8747 1.8747 2.0810 2.0810 3.4301 3.4301 3.9700 3.9700 4.1855 4.1855 4.4502 4.4502 6.8443 6.8443 7.5837 7.5837 7.8795 7.8795 8.4695 8.4695 k = 0.0000 0.1138 0.1024 ( 13369 PWs) bands (ev): -13.6932 -13.6932 -13.2408 -13.2408 -13.0641 -13.0641 -12.5045 -12.5045 -12.2434 -12.2434 -12.2194 -12.2194 -12.0251 -12.0251 -11.7447 -11.7447 -10.3328 -10.3328 -9.9727 -9.9727 -8.7954 -8.7954 -6.6821 -6.6821 -3.2975 -3.2975 -2.9013 -2.9013 -2.7791 -2.7791 -2.6281 -2.6281 -2.4725 -2.4725 -2.1903 -2.1903 -1.6135 -1.6135 -0.9760 -0.9760 -0.8779 -0.8779 -0.7540 -0.7540 -0.5344 -0.5344 -0.4644 -0.4644 -0.2972 -0.2972 -0.2111 -0.2111 -0.0829 -0.0829 0.1599 0.1599 0.3336 0.3336 0.3900 0.3900 0.4984 0.4984 0.6171 0.6171 0.6763 0.6763 0.7116 0.7116 0.8425 0.8425 0.9009 0.9009 1.0594 1.0594 1.2955 1.2955 1.3826 1.3826 1.8620 1.8620 2.0813 2.0813 3.4332 3.4332 3.9679 3.9679 4.1883 4.1883 4.4506 4.4506 6.8479 6.8479 7.5785 7.5785 7.8695 7.8695 8.5074 8.5074 k = 0.0000 0.1300 0.1170 ( 13367 PWs) bands (ev): -13.6897 -13.6897 -13.2435 -13.2435 -13.0639 -13.0639 -12.5080 -12.5080 -12.2449 -12.2449 -12.2205 -12.2205 -12.0229 -12.0229 -11.7434 -11.7434 -10.3340 -10.3340 -9.9699 -9.9699 -8.7967 -8.7967 -6.6785 -6.6785 -3.2915 -3.2915 -2.9147 -2.9147 -2.7774 -2.7774 -2.6261 -2.6261 -2.4682 -2.4682 -2.2071 -2.2071 -1.5916 -1.5916 -0.9577 -0.9577 -0.8784 -0.8784 -0.7607 -0.7607 -0.5412 -0.5412 -0.4672 -0.4672 -0.3121 -0.3121 -0.2172 -0.2172 -0.0747 -0.0747 0.1736 0.1736 0.3405 0.3405 0.3895 0.3895 0.4820 0.4820 0.6070 0.6070 0.6680 0.6680 0.7125 0.7125 0.8463 0.8463 0.9092 0.9092 1.0683 1.0683 1.2897 1.2897 1.3844 1.3844 1.8480 1.8480 2.0814 2.0814 3.4369 3.4369 3.9655 3.9655 4.1914 4.1914 4.4511 4.4511 6.8521 6.8521 7.5726 7.5726 7.8597 7.8597 8.5491 8.5491 k = 0.0000 0.1463 0.1316 ( 13360 PWs) bands (ev): -13.6857 -13.6857 -13.2462 -13.2462 -13.0640 -13.0640 -12.5117 -12.5117 -12.2466 -12.2466 -12.2214 -12.2214 -12.0206 -12.0206 -11.7419 -11.7419 -10.3353 -10.3353 -9.9666 -9.9666 -8.7981 -8.7981 -6.6744 -6.6744 -3.2847 -3.2847 -2.9284 -2.9284 -2.7760 -2.7760 -2.6242 -2.6242 -2.4636 -2.4636 -2.2254 -2.2254 -1.5677 -1.5677 -0.9388 -0.9388 -0.8798 -0.8798 -0.7671 -0.7671 -0.5491 -0.5491 -0.4713 -0.4713 -0.3225 -0.3225 -0.2212 -0.2212 -0.0678 -0.0678 0.1844 0.1844 0.3453 0.3453 0.3910 0.3910 0.4659 0.4659 0.5953 0.5953 0.6596 0.6596 0.7125 0.7125 0.8514 0.8514 0.9179 0.9179 1.0771 1.0771 1.2832 1.2832 1.3867 1.3867 1.8330 1.8330 2.0813 2.0813 3.4410 3.4410 3.9630 3.9630 4.1949 4.1949 4.4516 4.4516 6.8570 6.8570 7.5661 7.5661 7.8506 7.8506 8.5940 8.5940 k = 0.0000 0.1625 0.1463 ( 13356 PWs) bands (ev): -13.6814 -13.6814 -13.2489 -13.2489 -13.0643 -13.0643 -12.5158 -12.5158 -12.2484 -12.2484 -12.2224 -12.2224 -12.0182 -12.0182 -11.7403 -11.7403 -10.3369 -10.3369 -9.9630 -9.9630 -8.7997 -8.7997 -6.6700 -6.6700 -3.2772 -3.2772 -2.9422 -2.9422 -2.7747 -2.7747 -2.6226 -2.6226 -2.4588 -2.4588 -2.2450 -2.2450 -1.5423 -1.5423 -0.9208 -0.9208 -0.8822 -0.8822 -0.7719 -0.7719 -0.5578 -0.5578 -0.4761 -0.4761 -0.3283 -0.3283 -0.2232 -0.2232 -0.0624 -0.0624 0.1920 0.1920 0.3470 0.3470 0.3938 0.3938 0.4516 0.4516 0.5824 0.5824 0.6512 0.6512 0.7116 0.7116 0.8573 0.8573 0.9267 0.9267 1.0858 1.0858 1.2760 1.2760 1.3895 1.3895 1.8171 1.8171 2.0810 2.0810 3.4456 3.4456 3.9605 3.9605 4.1986 4.1986 4.4521 4.4521 6.8626 6.8626 7.5591 7.5591 7.8423 7.8423 8.6416 8.6416 k = 0.0000 0.1788 0.1609 ( 13362 PWs) bands (ev): -13.6769 -13.6769 -13.2514 -13.2514 -13.0650 -13.0650 -12.5202 -12.5202 -12.2503 -12.2503 -12.2232 -12.2232 -12.0158 -12.0158 -11.7386 -11.7386 -10.3386 -10.3386 -9.9590 -9.9590 -8.8014 -8.8014 -6.6652 -6.6652 -3.2690 -3.2690 -2.9558 -2.9558 -2.7736 -2.7736 -2.6212 -2.6212 -2.4540 -2.4540 -2.2657 -2.2657 -1.5154 -1.5154 -0.9075 -0.9075 -0.8839 -0.8839 -0.7735 -0.7735 -0.5666 -0.5666 -0.4806 -0.4806 -0.3302 -0.3302 -0.2234 -0.2234 -0.0587 -0.0587 0.1960 0.1960 0.3458 0.3458 0.3947 0.3947 0.4421 0.4421 0.5691 0.5691 0.6426 0.6426 0.7099 0.7099 0.8638 0.8638 0.9357 0.9357 1.0941 1.0941 1.2680 1.2680 1.3929 1.3929 1.8006 1.8006 2.0806 2.0806 3.4506 3.4506 3.9580 3.9580 4.2027 4.2027 4.4525 4.4525 6.8687 6.8687 7.5515 7.5515 7.8353 7.8353 8.6911 8.6911 k = 0.0000 0.1950 0.1755 ( 13350 PWs) bands (ev): -13.6721 -13.6721 -13.2537 -13.2537 -13.0661 -13.0661 -12.5247 -12.5247 -12.2523 -12.2523 -12.2239 -12.2239 -12.0134 -12.0134 -11.7369 -11.7369 -10.3406 -10.3406 -9.9546 -9.9546 -8.8032 -8.8032 -6.6601 -6.6601 -3.2602 -3.2602 -2.9690 -2.9690 -2.7727 -2.7727 -2.6200 -2.6200 -2.4492 -2.4492 -2.2874 -2.2874 -1.4875 -1.4875 -0.9073 -0.9073 -0.8791 -0.8791 -0.7699 -0.7699 -0.5744 -0.5744 -0.4840 -0.4840 -0.3295 -0.3295 -0.2219 -0.2219 -0.0570 -0.0570 0.1964 0.1964 0.3418 0.3418 0.3902 0.3902 0.4408 0.4408 0.5562 0.5562 0.6340 0.6340 0.7078 0.7078 0.8706 0.8706 0.9446 0.9446 1.1019 1.1019 1.2592 1.2592 1.3968 1.3968 1.7838 1.7838 2.0801 2.0801 3.4559 3.4559 3.9555 3.9555 4.2071 4.2071 4.4528 4.4528 6.8754 6.8754 7.5437 7.5437 7.8297 7.8297 8.7421 8.7421 k = 0.0000 0.2113 0.1901 ( 13348 PWs) bands (ev): -13.6672 -13.6672 -13.2556 -13.2556 -13.0676 -13.0676 -12.5295 -12.5295 -12.2544 -12.2544 -12.2245 -12.2245 -12.0111 -12.0111 -11.7351 -11.7351 -10.3427 -10.3427 -9.9500 -9.9500 -8.8051 -8.8051 -6.6548 -6.6548 -3.2509 -3.2509 -2.9818 -2.9818 -2.7719 -2.7719 -2.6189 -2.6189 -2.4446 -2.4446 -2.3097 -2.3097 -1.4590 -1.4590 -0.9181 -0.9181 -0.8708 -0.8708 -0.7604 -0.7604 -0.5800 -0.5800 -0.4859 -0.4859 -0.3270 -0.3270 -0.2187 -0.2187 -0.0574 -0.0574 0.1933 0.1933 0.3343 0.3343 0.3823 0.3823 0.4455 0.4455 0.5447 0.5447 0.6253 0.6253 0.7054 0.7054 0.8774 0.8774 0.9534 0.9534 1.1090 1.1090 1.2497 1.2497 1.4011 1.4011 1.7669 1.7669 2.0794 2.0794 3.4616 3.4616 3.9533 3.9533 4.2118 4.2118 4.4529 4.4529 6.8825 6.8825 7.5356 7.5356 7.8257 7.8257 8.7940 8.7940 k = 0.0000 0.2275 0.2048 ( 13342 PWs) bands (ev): -13.6621 -13.6621 -13.2572 -13.2572 -13.0697 -13.0697 -12.5344 -12.5344 -12.2565 -12.2565 -12.2249 -12.2249 -12.0088 -12.0088 -11.7332 -11.7332 -10.3450 -10.3450 -9.9450 -9.9450 -8.8072 -8.8072 -6.6492 -6.6492 -3.2411 -3.2411 -2.9938 -2.9938 -2.7714 -2.7714 -2.6180 -2.6180 -2.4405 -2.4405 -2.3324 -2.3324 -1.4302 -1.4302 -0.9340 -0.9340 -0.8640 -0.8640 -0.7464 -0.7464 -0.5821 -0.5821 -0.4858 -0.4858 -0.3238 -0.3238 -0.2142 -0.2142 -0.0599 -0.0599 0.1867 0.1867 0.3226 0.3226 0.3752 0.3752 0.4516 0.4516 0.5358 0.5358 0.6168 0.6168 0.7028 0.7028 0.8838 0.8838 0.9619 0.9619 1.1152 1.1152 1.2398 1.2398 1.4057 1.4057 1.7501 1.7501 2.0787 2.0787 3.4675 3.4675 3.9513 3.9513 4.2167 4.2167 4.4528 4.4528 6.8899 6.8899 7.5275 7.5275 7.8231 7.8231 8.8462 8.8462 k = 0.0000 0.2438 0.2194 ( 13338 PWs) bands (ev): -13.6571 -13.6571 -13.2583 -13.2583 -13.0723 -13.0723 -12.5393 -12.5393 -12.2586 -12.2586 -12.2251 -12.2251 -12.0066 -12.0066 -11.7314 -11.7314 -10.3475 -10.3475 -9.9398 -9.9398 -8.8093 -8.8093 -6.6436 -6.6436 -3.2311 -3.2311 -3.0049 -3.0049 -2.7710 -2.7710 -2.6173 -2.6173 -2.4374 -2.4374 -2.3547 -2.3547 -1.4019 -1.4019 -0.9525 -0.9525 -0.8586 -0.8586 -0.7305 -0.7305 -0.5800 -0.5800 -0.4834 -0.4834 -0.3202 -0.3202 -0.2084 -0.2084 -0.0645 -0.0645 0.1773 0.1773 0.3073 0.3073 0.3691 0.3691 0.4568 0.4568 0.5303 0.5303 0.6091 0.6091 0.7002 0.7002 0.8898 0.8898 0.9700 0.9700 1.1201 1.1201 1.2296 1.2296 1.4106 1.4106 1.7338 1.7338 2.0779 2.0779 3.4735 3.4735 3.9496 3.9496 4.2220 4.2220 4.4524 4.4524 6.8974 6.8974 7.5196 7.5196 7.8220 7.8220 8.8982 8.8982 k = 0.0000 0.2600 0.2340 ( 13344 PWs) bands (ev): -13.6520 -13.6520 -13.2588 -13.2588 -13.0755 -13.0755 -12.5443 -12.5443 -12.2608 -12.2608 -12.2252 -12.2252 -12.0046 -12.0046 -11.7295 -11.7295 -10.3501 -10.3501 -9.9345 -9.9345 -8.8115 -8.8115 -6.6378 -6.6378 -3.2210 -3.2210 -3.0148 -3.0148 -2.7708 -2.7708 -2.6167 -2.6167 -2.4366 -2.4366 -2.3752 -2.3752 -1.3747 -1.3747 -0.9719 -0.9719 -0.8537 -0.8537 -0.7151 -0.7151 -0.5736 -0.5736 -0.4784 -0.4784 -0.3169 -0.3169 -0.2016 -0.2016 -0.0713 -0.0713 0.1655 0.1655 0.2901 0.2901 0.3626 0.3626 0.4604 0.4604 0.5283 0.5283 0.6030 0.6030 0.6975 0.6975 0.8952 0.8952 0.9777 0.9777 1.1231 1.1231 1.2197 1.2197 1.4156 1.4156 1.7182 1.7182 2.0771 2.0771 3.4796 3.4796 3.9483 3.9483 4.2275 4.2275 4.4517 4.4517 6.9049 6.9049 7.5121 7.5121 7.8223 7.8223 8.9494 8.9494 k = 0.0000 0.2763 0.2486 ( 13345 PWs) bands (ev): -13.6470 -13.6470 -13.2587 -13.2587 -13.0793 -13.0793 -12.5492 -12.5492 -12.2629 -12.2629 -12.2252 -12.2252 -12.0026 -12.0026 -11.7276 -11.7276 -10.3527 -10.3527 -9.9290 -9.9290 -8.8137 -8.8137 -6.6319 -6.6319 -3.2111 -3.2111 -3.0231 -3.0231 -2.7709 -2.7709 -2.6163 -2.6163 -2.4414 -2.4414 -2.3905 -2.3905 -1.3497 -1.3497 -0.9903 -0.9903 -0.8488 -0.8488 -0.7015 -0.7015 -0.5641 -0.5641 -0.4697 -0.4697 -0.3139 -0.3139 -0.1941 -0.1941 -0.0799 -0.0799 0.1519 0.1519 0.2721 0.2721 0.3541 0.3541 0.4632 0.4632 0.5280 0.5280 0.5995 0.5995 0.6950 0.6950 0.8998 0.8998 0.9847 0.9847 1.1236 1.1236 1.2107 1.2107 1.4206 1.4206 1.7035 1.7035 2.0765 2.0765 3.4857 3.4857 3.9475 3.9475 4.2333 4.2333 4.4506 4.4506 6.9123 6.9123 7.5053 7.5053 7.8237 7.8237 8.9994 8.9994 k = 0.0000 0.2925 0.2633 ( 13354 PWs) bands (ev): -13.6421 -13.6421 -13.2579 -13.2579 -13.0836 -13.0836 -12.5540 -12.5540 -12.2649 -12.2649 -12.2250 -12.2250 -12.0009 -12.0009 -11.7258 -11.7258 -10.3555 -10.3555 -9.9235 -9.9235 -8.8159 -8.8159 -6.6261 -6.6261 -3.2018 -3.2018 -3.0294 -3.0294 -2.7713 -2.7713 -2.6162 -2.6162 -2.4548 -2.4548 -2.3972 -2.3972 -1.3284 -1.3284 -1.0057 -1.0057 -0.8435 -0.8435 -0.6900 -0.6900 -0.5533 -0.5533 -0.4568 -0.4568 -0.3113 -0.3113 -0.1861 -0.1861 -0.0902 -0.0902 0.1370 0.1370 0.2541 0.2541 0.3429 0.3429 0.4662 0.4662 0.5277 0.5277 0.5995 0.5995 0.6928 0.6928 0.9035 0.9035 0.9912 0.9912 1.1207 1.1207 1.2034 1.2034 1.4257 1.4257 1.6898 1.6898 2.0759 2.0759 3.4916 3.4916 3.9471 3.9471 4.2393 4.2393 4.4491 4.4491 6.9194 6.9194 7.4992 7.4992 7.8261 7.8261 9.0475 9.0475 k = 0.0000 0.3088 0.2779 ( 13356 PWs) bands (ev): -13.6375 -13.6375 -13.2565 -13.2565 -13.0886 -13.0886 -12.5586 -12.5586 -12.2669 -12.2669 -12.2247 -12.2247 -11.9992 -11.9992 -11.7240 -11.7240 -10.3582 -10.3582 -9.9181 -9.9181 -8.8181 -8.8181 -6.6204 -6.6204 -3.1935 -3.1935 -3.0332 -3.0332 -2.7720 -2.7720 -2.6165 -2.6165 -2.4745 -2.4745 -2.3975 -2.3975 -1.3122 -1.3122 -1.0157 -1.0157 -0.8375 -0.8375 -0.6802 -0.6802 -0.5433 -0.5433 -0.4395 -0.4395 -0.3092 -0.3092 -0.1779 -0.1779 -0.1015 -0.1015 0.1215 0.1215 0.2364 0.2364 0.3290 0.3290 0.4698 0.4698 0.5263 0.5263 0.6029 0.6029 0.6908 0.6908 0.9062 0.9062 0.9970 0.9970 1.1141 1.1141 1.1982 1.1982 1.4309 1.4309 1.6773 1.6773 2.0755 2.0755 3.4974 3.4974 3.9472 3.9472 4.2454 4.2454 4.4474 4.4474 6.9261 6.9261 7.4941 7.4941 7.8293 7.8293 9.0931 9.0931 k = 0.0000 0.3250 0.2925 ( 13352 PWs) bands (ev): -13.6330 -13.6330 -13.2543 -13.2543 -13.0941 -13.0941 -12.5631 -12.5631 -12.2688 -12.2688 -12.2243 -12.2243 -11.9978 -11.9978 -11.7224 -11.7224 -10.3608 -10.3608 -9.9127 -9.9127 -8.8203 -8.8203 -6.6148 -6.6148 -3.1867 -3.1867 -3.0340 -3.0340 -2.7732 -2.7732 -2.6173 -2.6173 -2.4965 -2.4965 -2.3949 -2.3949 -1.3028 -1.3028 -1.0187 -1.0187 -0.8308 -0.8308 -0.6718 -0.6718 -0.5351 -0.5351 -0.4187 -0.4187 -0.3072 -0.3072 -0.1702 -0.1702 -0.1129 -0.1129 0.1060 0.1060 0.2190 0.2190 0.3128 0.3128 0.4734 0.4734 0.5244 0.5244 0.6090 0.6090 0.6891 0.6891 0.9081 0.9081 1.0022 1.0022 1.1041 1.1041 1.1949 1.1949 1.4362 1.4362 1.6660 1.6660 2.0754 2.0754 3.5028 3.5028 3.9477 3.9477 4.2515 4.2515 4.4453 4.4453 6.9323 6.9323 7.4899 7.4899 7.8332 7.8332 9.1351 9.1351 k = 0.0000 0.3413 0.3071 ( 13354 PWs) bands (ev): -13.6289 -13.6289 -13.2513 -13.2513 -13.1002 -13.1002 -12.5673 -12.5673 -12.2706 -12.2706 -12.2239 -12.2239 -11.9965 -11.9965 -11.7207 -11.7207 -10.3634 -10.3634 -9.9075 -9.9075 -8.8224 -8.8224 -6.6095 -6.6095 -3.1818 -3.1818 -3.0315 -3.0315 -2.7749 -2.7749 -2.6191 -2.6191 -2.5185 -2.5185 -2.3912 -2.3912 -1.3007 -1.3007 -1.0136 -1.0136 -0.8234 -0.8234 -0.6643 -0.6643 -0.5289 -0.5289 -0.3965 -0.3965 -0.3051 -0.3051 -0.1649 -0.1649 -0.1216 -0.1216 0.0913 0.0913 0.2018 0.2018 0.2949 0.2949 0.4763 0.4763 0.5229 0.5229 0.6168 0.6168 0.6879 0.6879 0.9091 0.9091 1.0067 1.0067 1.0915 1.0915 1.1927 1.1927 1.4417 1.4417 1.6559 1.6559 2.0754 2.0754 3.5079 3.5079 3.9486 3.9486 4.2576 4.2576 4.4429 4.4429 6.9380 6.9380 7.4867 7.4867 7.8374 7.8374 9.1716 9.1716 k = 0.0000 0.3575 0.3218 ( 13351 PWs) bands (ev): -13.6251 -13.6251 -13.2476 -13.2476 -13.1068 -13.1068 -12.5712 -12.5712 -12.2723 -12.2723 -12.2234 -12.2234 -11.9953 -11.9953 -11.7192 -11.7192 -10.3659 -10.3659 -9.9025 -9.9025 -8.8244 -8.8244 -6.6044 -6.6044 -3.1789 -3.1789 -3.0254 -3.0254 -2.7772 -2.7772 -2.6224 -2.6224 -2.5390 -2.5390 -2.3870 -2.3870 -1.3052 -1.3052 -1.0009 -1.0009 -0.8152 -0.8152 -0.6581 -0.6581 -0.5244 -0.5244 -0.3752 -0.3752 -0.3024 -0.3024 -0.1664 -0.1664 -0.1224 -0.1224 0.0778 0.0778 0.1847 0.1847 0.2759 0.2759 0.4779 0.4779 0.5227 0.5227 0.6252 0.6252 0.6870 0.6870 0.9095 0.9095 1.0105 1.0105 1.0772 1.0772 1.1910 1.1910 1.4474 1.4474 1.6470 1.6470 2.0756 2.0756 3.5126 3.5126 3.9497 3.9497 4.2636 4.2636 4.4404 4.4404 6.9431 6.9431 7.4844 7.4844 7.8419 7.8419 9.1983 9.1983 k = 0.0000 0.3738 0.3364 ( 13350 PWs) bands (ev): -13.6217 -13.6217 -13.2432 -13.2432 -13.1139 -13.1139 -12.5748 -12.5748 -12.2738 -12.2738 -12.2229 -12.2229 -11.9943 -11.9943 -11.7178 -11.7178 -10.3683 -10.3683 -9.8979 -9.8979 -8.8263 -8.8263 -6.5997 -6.5997 -3.1779 -3.1779 -3.0159 -3.0159 -2.7805 -2.7805 -2.6282 -2.6282 -2.5566 -2.5566 -2.3827 -2.3827 -1.3144 -1.3144 -0.9824 -0.9824 -0.8066 -0.8066 -0.6532 -0.6532 -0.5212 -0.5212 -0.3565 -0.3565 -0.2992 -0.2992 -0.1747 -0.1747 -0.1136 -0.1136 0.0659 0.0659 0.1675 0.1675 0.2564 0.2564 0.4778 0.4778 0.5242 0.5242 0.6337 0.6337 0.6865 0.6865 0.9096 0.9096 1.0133 1.0133 1.0622 1.0622 1.1895 1.1895 1.4534 1.4534 1.6392 1.6392 2.0760 2.0760 3.5168 3.5168 3.9512 3.9512 4.2694 4.2694 4.4378 4.4378 6.9475 6.9475 7.4829 7.4829 7.8465 7.8465 9.2094 9.2094 k = 0.0000 0.3900 0.3510 ( 13352 PWs) bands (ev): -13.6186 -13.6186 -13.2381 -13.2381 -13.1213 -13.1213 -12.5780 -12.5780 -12.2752 -12.2752 -12.2223 -12.2223 -11.9935 -11.9935 -11.7166 -11.7166 -10.3704 -10.3704 -9.8936 -9.8936 -8.8280 -8.8280 -6.5953 -6.5953 -3.1782 -3.1782 -3.0036 -3.0036 -2.7850 -2.7850 -2.6371 -2.6371 -2.5699 -2.5699 -2.3785 -2.3785 -1.3263 -1.3263 -0.9601 -0.9601 -0.7975 -0.7975 -0.6504 -0.6504 -0.5190 -0.5190 -0.3416 -0.3416 -0.2962 -0.2962 -0.1847 -0.1847 -0.0989 -0.0989 0.0557 0.0557 0.1498 0.1498 0.2371 0.2371 0.4762 0.4762 0.5270 0.5270 0.6418 0.6418 0.6862 0.6862 0.9097 0.9097 1.0145 1.0145 1.0478 1.0478 1.1878 1.1878 1.4595 1.4595 1.6322 1.6322 2.0766 2.0766 3.5205 3.5205 3.9528 3.9528 4.2749 4.2749 4.4351 4.4351 6.9513 6.9513 7.4821 7.4821 7.8509 7.8509 9.2043 9.2043 k = 0.0000 0.4063 0.3656 ( 13350 PWs) bands (ev): -13.6160 -13.6160 -13.2323 -13.2323 -13.1292 -13.1292 -12.5809 -12.5809 -12.2764 -12.2764 -12.2218 -12.2218 -11.9928 -11.9928 -11.7155 -11.7155 -10.3724 -10.3724 -9.8898 -9.8898 -8.8296 -8.8296 -6.5915 -6.5915 -3.1795 -3.1795 -2.9888 -2.9888 -2.7910 -2.7910 -2.6488 -2.6488 -2.5786 -2.5786 -2.3745 -2.3745 -1.3392 -1.3392 -0.9355 -0.9355 -0.7883 -0.7883 -0.6502 -0.6502 -0.5172 -0.5172 -0.3304 -0.3304 -0.2950 -0.2950 -0.1922 -0.1922 -0.0807 -0.0807 0.0473 0.0473 0.1317 0.1317 0.2185 0.2185 0.4736 0.4736 0.5306 0.5306 0.6492 0.6492 0.6860 0.6860 0.9102 0.9102 1.0116 1.0116 1.0368 1.0368 1.1860 1.1860 1.4656 1.4656 1.6262 1.6262 2.0772 2.0772 3.5236 3.5236 3.9544 3.9544 4.2799 4.2799 4.4324 4.4324 6.9545 6.9545 7.4819 7.4819 7.8551 7.8551 9.1907 9.1907 k = 0.0000 0.4225 0.3803 ( 13348 PWs) bands (ev): -13.6137 -13.6137 -13.2260 -13.2260 -13.1373 -13.1373 -12.5834 -12.5834 -12.2774 -12.2774 -12.2214 -12.2214 -11.9922 -11.9922 -11.7145 -11.7145 -10.3741 -10.3741 -9.8864 -9.8864 -8.8310 -8.8310 -6.5881 -6.5881 -3.1812 -3.1812 -2.9722 -2.9722 -2.7992 -2.7992 -2.6617 -2.6617 -2.5837 -2.5837 -2.3708 -2.3708 -1.3518 -1.3518 -0.9104 -0.9104 -0.7789 -0.7789 -0.6532 -0.6532 -0.5154 -0.5154 -0.3227 -0.3227 -0.2969 -0.2969 -0.1952 -0.1952 -0.0608 -0.0608 0.0408 0.0408 0.1136 0.1136 0.2008 0.2008 0.4705 0.4705 0.5344 0.5344 0.6557 0.6557 0.6859 0.6859 0.9115 0.9115 1.0020 1.0020 1.0323 1.0323 1.1842 1.1842 1.4715 1.4715 1.6209 1.6209 2.0779 2.0779 3.5263 3.5263 3.9560 3.9560 4.2844 4.2844 4.4300 4.4300 6.9571 6.9571 7.4821 7.4821 7.8589 7.8589 9.1750 9.1750 k = 0.0000 0.4388 0.3949 ( 13351 PWs) bands (ev): -13.6119 -13.6119 -13.2192 -13.2192 -13.1455 -13.1455 -12.5854 -12.5854 -12.2783 -12.2783 -12.2210 -12.2210 -11.9917 -11.9917 -11.7137 -11.7137 -10.3755 -10.3755 -9.8836 -9.8836 -8.8321 -8.8321 -6.5853 -6.5853 -3.1830 -3.1830 -2.9541 -2.9541 -2.8097 -2.8097 -2.6737 -2.6737 -2.5867 -2.5867 -2.3677 -2.3677 -1.3631 -1.3631 -0.8861 -0.8861 -0.7696 -0.7696 -0.6597 -0.6597 -0.5132 -0.5132 -0.3194 -0.3194 -0.3002 -0.3002 -0.1930 -0.1930 -0.0415 -0.0415 0.0366 0.0366 0.0965 0.0965 0.1841 0.1841 0.4674 0.4674 0.5379 0.5379 0.6611 0.6611 0.6858 0.6858 0.9140 0.9140 0.9888 0.9888 1.0317 1.0317 1.1824 1.1824 1.4769 1.4769 1.6165 1.6165 2.0786 2.0786 3.5285 3.5285 3.9575 3.9575 4.2883 4.2883 4.4278 4.4278 6.9591 6.9591 7.4825 7.4825 7.8621 7.8621 9.1601 9.1601 k = 0.0000 0.4550 0.4095 ( 13345 PWs) bands (ev): -13.6104 -13.6104 -13.2122 -13.2122 -13.1536 -13.1536 -12.5870 -12.5870 -12.2790 -12.2790 -12.2206 -12.2206 -11.9914 -11.9914 -11.7131 -11.7131 -10.3766 -10.3766 -9.8814 -9.8814 -8.8330 -8.8330 -6.5830 -6.5830 -3.1846 -3.1846 -2.9351 -2.9351 -2.8229 -2.8229 -2.6835 -2.6835 -2.5885 -2.5885 -2.3650 -2.3650 -1.3725 -1.3725 -0.8640 -0.8640 -0.7601 -0.7601 -0.6695 -0.6695 -0.5103 -0.5103 -0.3224 -0.3224 -0.3008 -0.3008 -0.1873 -0.1873 -0.0267 -0.0267 0.0366 0.0366 0.0818 0.0818 0.1683 0.1683 0.4646 0.4646 0.5409 0.5409 0.6653 0.6653 0.6858 0.6858 0.9179 0.9179 0.9750 0.9750 1.0321 1.0321 1.1808 1.1808 1.4815 1.4815 1.6129 1.6129 2.0792 2.0792 3.5301 3.5301 3.9587 3.9587 4.2914 4.2914 4.4259 4.4259 6.9607 6.9607 7.4829 7.4829 7.8648 7.8648 9.1476 9.1476 k = 0.0000 0.4713 0.4241 ( 13345 PWs) bands (ev): -13.6094 -13.6094 -13.2054 -13.2054 -13.1612 -13.1612 -12.5881 -12.5881 -12.2794 -12.2794 -12.2204 -12.2204 -11.9911 -11.9911 -11.7126 -11.7126 -10.3774 -10.3774 -9.8798 -9.8798 -8.8337 -8.8337 -6.5814 -6.5814 -3.1860 -3.1860 -2.9154 -2.9154 -2.8385 -2.8385 -2.6906 -2.6906 -2.5895 -2.5895 -2.3631 -2.3631 -1.3796 -1.3796 -0.8460 -0.8460 -0.7504 -0.7504 -0.6815 -0.6815 -0.5074 -0.5074 -0.3287 -0.3287 -0.2993 -0.2993 -0.1802 -0.1802 -0.0197 -0.0197 0.0425 0.0425 0.0709 0.0709 0.1539 0.1539 0.4623 0.4623 0.5432 0.5432 0.6682 0.6682 0.6858 0.6858 0.9234 0.9234 0.9619 0.9619 1.0326 1.0326 1.1796 1.1796 1.4851 1.4851 1.6102 1.6102 2.0797 2.0797 3.5313 3.5313 3.9596 3.9596 4.2937 4.2937 4.4246 4.4246 6.9618 6.9618 7.4834 7.4834 7.8667 7.8667 9.1382 9.1382 k = 0.0000 0.4875 0.4388 ( 13347 PWs) bands (ev): -13.6088 -13.6088 -13.1996 -13.1996 -13.1675 -13.1675 -12.5888 -12.5888 -12.2797 -12.2797 -12.2202 -12.2202 -11.9910 -11.9910 -11.7123 -11.7123 -10.3779 -10.3779 -9.8788 -9.8788 -8.8341 -8.8341 -6.5804 -6.5804 -3.1868 -3.1868 -2.8957 -2.8957 -2.8560 -2.8560 -2.6948 -2.6948 -2.5900 -2.5900 -2.3619 -2.3619 -1.3839 -1.3839 -0.8341 -0.8341 -0.7409 -0.7409 -0.6934 -0.6934 -0.5052 -0.5052 -0.3339 -0.3339 -0.2979 -0.2979 -0.1744 -0.1744 -0.0190 -0.0190 0.0509 0.0509 0.0647 0.0647 0.1426 0.1426 0.4609 0.4609 0.5446 0.5446 0.6699 0.6699 0.6859 0.6859 0.9306 0.9306 0.9499 0.9499 1.0330 1.0330 1.1789 1.1789 1.4874 1.4874 1.6085 1.6085 2.0800 2.0800 3.5320 3.5320 3.9602 3.9602 4.2951 4.2951 4.4237 4.4237 6.9624 6.9624 7.4837 7.4837 7.8679 7.8679 9.1324 9.1324 k = 0.0000 0.5038 0.4534 ( 13344 PWs) bands (ev): -13.6086 -13.6086 -13.1970 -13.1970 -13.1702 -13.1702 -12.5891 -12.5891 -12.2798 -12.2798 -12.2202 -12.2202 -11.9909 -11.9909 -11.7122 -11.7122 -10.3781 -10.3781 -9.8785 -9.8785 -8.8342 -8.8342 -6.5801 -6.5801 -3.1871 -3.1871 -2.8798 -2.8798 -2.8711 -2.8711 -2.6962 -2.6962 -2.5901 -2.5901 -2.3615 -2.3615 -1.3853 -1.3853 -0.8299 -0.8299 -0.7360 -0.7360 -0.6993 -0.6993 -0.5044 -0.5044 -0.3359 -0.3359 -0.2974 -0.2974 -0.1722 -0.1722 -0.0195 -0.0195 0.0546 0.0546 0.0633 0.0633 0.1379 0.1379 0.4604 0.4604 0.5451 0.5451 0.6705 0.6705 0.6860 0.6860 0.9389 0.9389 0.9400 0.9400 1.0331 1.0331 1.1786 1.1786 1.4882 1.4882 1.6079 1.6079 2.0801 2.0801 3.5323 3.5323 3.9604 3.9604 4.2956 4.2956 4.4234 4.4234 6.9626 6.9626 7.4838 7.4838 7.8683 7.8683 9.1305 9.1305 k = 0.5000 0.4298 0.3913 ( 13348 PWs) bands (ev): -13.5819 -13.5819 -13.1782 -13.1782 -13.1723 -13.1723 -12.5843 -12.5843 -12.2992 -12.2992 -12.2401 -12.2401 -12.0505 -12.0505 -11.6970 -11.6970 -10.4005 -10.4005 -9.8739 -9.8739 -8.7797 -8.7797 -6.5510 -6.5510 -3.2248 -3.2248 -2.9103 -2.9103 -2.8630 -2.8630 -2.7087 -2.7087 -2.4543 -2.4543 -2.1010 -2.1010 -1.2449 -1.2449 -1.1272 -1.1272 -1.0328 -1.0328 -0.7506 -0.7506 -0.3343 -0.3343 -0.2844 -0.2844 -0.1884 -0.1884 -0.1564 -0.1564 -0.0583 -0.0583 -0.0192 -0.0192 -0.0091 -0.0091 0.1906 0.1906 0.3487 0.3487 0.4373 0.4373 0.6602 0.6602 0.6982 0.6982 0.7746 0.7746 0.9609 0.9609 1.1257 1.1257 1.2540 1.2540 1.4804 1.4804 1.6174 1.6174 1.9091 1.9091 3.7404 3.7404 3.9448 3.9448 4.2702 4.2702 4.4467 4.4467 7.0745 7.0745 7.6618 7.6618 7.8931 7.8931 8.8911 8.8911 k = 0.4857 0.4175 0.3801 ( 13360 PWs) bands (ev): -13.5820 -13.5820 -13.1807 -13.1807 -13.1699 -13.1699 -12.5841 -12.5841 -12.2991 -12.2991 -12.2400 -12.2400 -12.0502 -12.0502 -11.6972 -11.6972 -10.4004 -10.4004 -9.8743 -9.8743 -8.7798 -8.7798 -6.5511 -6.5511 -3.2239 -3.2239 -2.9170 -2.9170 -2.8566 -2.8566 -2.7076 -2.7076 -2.4552 -2.4552 -2.1029 -2.1029 -1.2467 -1.2467 -1.1348 -1.1348 -1.0223 -1.0223 -0.7479 -0.7479 -0.3403 -0.3403 -0.2865 -0.2865 -0.1881 -0.1881 -0.1583 -0.1583 -0.0566 -0.0566 -0.0204 -0.0204 -0.0016 -0.0016 0.1924 0.1924 0.3486 0.3486 0.4361 0.4361 0.6595 0.6595 0.6987 0.6987 0.7748 0.7748 0.9615 0.9615 1.1251 1.1251 1.2539 1.2539 1.4793 1.4793 1.6185 1.6185 1.9093 1.9093 3.7389 3.7389 3.9453 3.9453 4.2694 4.2694 4.4474 4.4474 7.0735 7.0735 7.6610 7.6610 7.8924 7.8924 8.8932 8.8932 k = 0.4714 0.4052 0.3689 ( 13351 PWs) bands (ev): -13.5825 -13.5825 -13.1853 -13.1853 -13.1658 -13.1658 -12.5834 -12.5834 -12.2987 -12.2987 -12.2400 -12.2400 -12.0494 -12.0494 -11.6975 -11.6975 -10.4000 -10.4000 -9.8754 -9.8754 -8.7799 -8.7799 -6.5514 -6.5514 -3.2211 -3.2211 -2.9315 -2.9315 -2.8435 -2.8435 -2.7042 -2.7042 -2.4579 -2.4579 -2.1085 -2.1085 -1.2527 -1.2527 -1.1502 -1.1502 -0.9979 -0.9979 -0.7400 -0.7400 -0.3561 -0.3561 -0.2944 -0.2944 -0.1882 -0.1882 -0.1608 -0.1608 -0.0553 -0.0553 -0.0170 -0.0170 0.0151 0.0151 0.1976 0.1976 0.3484 0.3484 0.4327 0.4327 0.6578 0.6578 0.6998 0.6998 0.7754 0.7754 0.9635 0.9635 1.1235 1.1235 1.2535 1.2535 1.4764 1.4764 1.6218 1.6218 1.9098 1.9098 3.7347 3.7347 3.9469 3.9469 4.2671 4.2671 4.4495 4.4495 7.0707 7.0707 7.6587 7.6587 7.8906 7.8906 8.8995 8.8995 k = 0.4571 0.3929 0.3577 ( 13351 PWs) bands (ev): -13.5832 -13.5832 -13.1904 -13.1904 -13.1613 -13.1613 -12.5823 -12.5823 -12.2981 -12.2981 -12.2398 -12.2398 -12.0480 -12.0480 -11.6982 -11.6982 -10.3995 -10.3995 -9.8771 -9.8771 -8.7801 -8.7801 -6.5520 -6.5520 -3.2166 -3.2166 -2.9481 -2.9481 -2.8294 -2.8294 -2.6984 -2.6984 -2.4624 -2.4624 -2.1175 -2.1175 -1.2640 -1.2640 -1.1642 -1.1642 -0.9676 -0.9676 -0.7273 -0.7273 -0.3780 -0.3780 -0.3095 -0.3095 -0.1912 -0.1912 -0.1592 -0.1592 -0.0571 -0.0571 -0.0075 -0.0075 0.0382 0.0382 0.2056 0.2056 0.3479 0.3479 0.4273 0.4273 0.6553 0.6553 0.7014 0.7014 0.7763 0.7763 0.9665 0.9665 1.1212 1.1212 1.2528 1.2528 1.4718 1.4718 1.6267 1.6267 1.9106 1.9106 3.7279 3.7279 3.9494 3.9494 4.2634 4.2634 4.4528 4.4528 7.0662 7.0662 7.6549 7.6549 7.8877 7.8877 8.9098 8.9098 k = 0.4429 0.3807 0.3465 ( 13346 PWs) bands (ev): -13.5843 -13.5843 -13.1959 -13.1959 -13.1566 -13.1566 -12.5809 -12.5809 -12.2972 -12.2972 -12.2395 -12.2395 -12.0462 -12.0462 -11.6990 -11.6990 -10.3987 -10.3987 -9.8795 -9.8795 -8.7804 -8.7804 -6.5527 -6.5527 -3.2105 -3.2105 -2.9649 -2.9649 -2.8165 -2.8165 -2.6898 -2.6898 -2.4688 -2.4688 -2.1292 -2.1292 -1.2807 -1.2807 -1.1731 -1.1731 -0.9351 -0.9351 -0.7106 -0.7106 -0.4036 -0.4036 -0.3304 -0.3304 -0.1970 -0.1970 -0.1544 -0.1544 -0.0596 -0.0596 0.0055 0.0055 0.0655 0.0655 0.2160 0.2160 0.3470 0.3470 0.4207 0.4207 0.6525 0.6525 0.7028 0.7028 0.7772 0.7772 0.9704 0.9704 1.1186 1.1186 1.2517 1.2517 1.4660 1.4660 1.6330 1.6330 1.9119 1.9119 3.7188 3.7188 3.9525 3.9525 4.2586 4.2586 4.4570 4.4570 7.0601 7.0601 7.6500 7.6500 7.8839 7.8839 8.9236 8.9236 k = 0.4286 0.3684 0.3354 ( 13341 PWs) bands (ev): -13.5856 -13.5856 -13.2020 -13.2020 -13.1516 -13.1516 -12.5791 -12.5791 -12.2961 -12.2961 -12.2392 -12.2392 -12.0439 -12.0439 -11.7001 -11.7001 -10.3977 -10.3977 -9.8825 -9.8825 -8.7808 -8.7808 -6.5538 -6.5538 -3.2029 -3.2029 -2.9809 -2.9809 -2.8057 -2.8057 -2.6786 -2.6786 -2.4772 -2.4772 -2.1431 -2.1431 -1.3012 -1.3012 -1.1770 -1.1770 -0.9020 -0.9020 -0.6908 -0.6908 -0.4311 -0.4311 -0.3551 -0.3551 -0.2042 -0.2042 -0.1493 -0.1493 -0.0607 -0.0607 0.0208 0.0208 0.0946 0.0946 0.2280 0.2280 0.3455 0.3455 0.4137 0.4137 0.6497 0.6497 0.7038 0.7038 0.7781 0.7781 0.9748 0.9748 1.1161 1.1161 1.2501 1.2501 1.4595 1.4595 1.6402 1.6402 1.9136 1.9136 3.7076 3.7076 3.9559 3.9559 4.2530 4.2530 4.4618 4.4618 7.0525 7.0525 7.6441 7.6441 7.8794 7.8794 8.9404 8.9404 k = 0.4143 0.3561 0.3242 ( 13330 PWs) bands (ev): -13.5873 -13.5873 -13.2083 -13.2083 -13.1463 -13.1463 -12.5770 -12.5770 -12.2948 -12.2948 -12.2387 -12.2387 -12.0413 -12.0413 -11.7015 -11.7015 -10.3966 -10.3966 -9.8861 -9.8861 -8.7812 -8.7812 -6.5551 -6.5551 -3.1942 -3.1942 -2.9957 -2.9957 -2.7972 -2.7972 -2.6649 -2.6649 -2.4875 -2.4875 -2.1583 -2.1583 -1.3234 -1.3234 -1.1772 -1.1772 -0.8693 -0.8693 -0.6688 -0.6688 -0.4594 -0.4594 -0.3820 -0.3820 -0.2123 -0.2123 -0.1455 -0.1455 -0.0597 -0.0597 0.0381 0.0381 0.1237 0.1237 0.2411 0.2411 0.3434 0.3434 0.4073 0.4073 0.6472 0.6472 0.7037 0.7037 0.7793 0.7793 0.9792 0.9792 1.1141 1.1141 1.2482 1.2482 1.4525 1.4525 1.6480 1.6480 1.9158 1.9158 3.6947 3.6947 3.9594 3.9594 4.2468 4.2468 4.4670 4.4670 7.0438 7.0438 7.6376 7.6376 7.8744 7.8744 8.9598 8.9598 k = 0.4000 0.3438 0.3130 ( 13321 PWs) bands (ev): -13.5893 -13.5893 -13.2150 -13.2150 -13.1407 -13.1407 -12.5747 -12.5747 -12.2933 -12.2933 -12.2380 -12.2380 -12.0385 -12.0385 -11.7029 -11.7029 -10.3952 -10.3952 -9.8901 -9.8901 -8.7817 -8.7817 -6.5568 -6.5568 -3.1848 -3.1848 -3.0086 -3.0086 -2.7909 -2.7909 -2.6495 -2.6495 -2.4996 -2.4996 -2.1742 -2.1742 -1.3458 -1.3458 -1.1749 -1.1749 -0.8382 -0.8382 -0.6457 -0.6457 -0.4870 -0.4870 -0.4103 -0.4103 -0.2208 -0.2208 -0.1433 -0.1433 -0.0567 -0.0567 0.0572 0.0572 0.1509 0.1509 0.2544 0.2544 0.3413 0.3413 0.4024 0.4024 0.6450 0.6450 0.7022 0.7022 0.7810 0.7810 0.9833 0.9833 1.1129 1.1129 1.2460 1.2460 1.4453 1.4453 1.6561 1.6561 1.9186 1.9186 3.6803 3.6803 3.9627 3.9627 4.2402 4.2402 4.4721 4.4721 7.0342 7.0342 7.6306 7.6306 7.8692 7.8692 8.9812 8.9812 k = 0.3857 0.3316 0.3018 ( 13319 PWs) bands (ev): -13.5916 -13.5916 -13.2219 -13.2219 -13.1347 -13.1347 -12.5722 -12.5722 -12.2915 -12.2915 -12.2373 -12.2373 -12.0355 -12.0355 -11.7046 -11.7046 -10.3936 -10.3936 -9.8946 -9.8946 -8.7822 -8.7822 -6.5589 -6.5589 -3.1753 -3.1753 -3.0191 -3.0191 -2.7864 -2.7864 -2.6333 -2.6333 -2.5132 -2.5132 -2.1900 -2.1900 -1.3673 -1.3673 -1.1708 -1.1708 -0.8100 -0.8100 -0.6228 -0.6228 -0.5123 -0.5123 -0.4393 -0.4393 -0.2294 -0.2294 -0.1422 -0.1422 -0.0524 -0.0524 0.0778 0.0778 0.1747 0.1747 0.2670 0.2670 0.3406 0.3406 0.3998 0.3998 0.6434 0.6434 0.6990 0.6990 0.7836 0.7836 0.9865 0.9865 1.1124 1.1124 1.2438 1.2438 1.4381 1.4381 1.6643 1.6643 1.9219 1.9219 3.6647 3.6647 3.9658 3.9658 4.2333 4.2333 4.4771 4.4771 7.0240 7.0240 7.6237 7.6237 7.8639 7.8639 9.0040 9.0040 k = 0.3714 0.3193 0.2906 ( 13314 PWs) bands (ev): -13.5942 -13.5942 -13.2288 -13.2288 -13.1286 -13.1286 -12.5696 -12.5696 -12.2896 -12.2896 -12.2363 -12.2363 -12.0326 -12.0326 -11.7064 -11.7064 -10.3918 -10.3918 -9.8994 -9.8994 -8.7828 -8.7828 -6.5614 -6.5614 -3.1663 -3.1663 -3.0265 -3.0265 -2.7836 -2.7836 -2.6176 -2.6176 -2.5272 -2.5272 -2.2051 -2.2051 -1.3874 -1.3874 -1.1651 -1.1651 -0.7867 -0.7867 -0.6025 -0.6025 -0.5320 -0.5320 -0.4684 -0.4684 -0.2375 -0.2375 -0.1416 -0.1416 -0.0478 -0.0478 0.0993 0.0993 0.1937 0.1937 0.2780 0.2780 0.3434 0.3434 0.3995 0.3995 0.6422 0.6422 0.6941 0.6941 0.7874 0.7874 0.9886 0.9886 1.1127 1.1127 1.2419 1.2419 1.4310 1.4310 1.6727 1.6727 1.9258 1.9258 3.6481 3.6481 3.9685 3.9685 4.2264 4.2264 4.4816 4.4816 7.0133 7.0133 7.6169 7.6169 7.8587 7.8587 9.0279 9.0279 k = 0.3571 0.3070 0.2795 ( 13305 PWs) bands (ev): -13.5972 -13.5972 -13.2356 -13.2356 -13.1222 -13.1222 -12.5668 -12.5668 -12.2876 -12.2876 -12.2353 -12.2353 -12.0296 -12.0296 -11.7083 -11.7083 -10.3899 -10.3899 -9.9044 -9.9044 -8.7834 -8.7834 -6.5644 -6.5644 -3.1589 -3.1589 -3.0302 -3.0302 -2.7823 -2.7823 -2.6049 -2.6049 -2.5392 -2.5392 -2.2192 -2.2192 -1.4057 -1.4057 -1.1582 -1.1582 -0.7704 -0.7704 -0.5911 -0.5911 -0.5397 -0.5397 -0.4958 -0.4958 -0.2446 -0.2446 -0.1412 -0.1412 -0.0439 -0.0439 0.1213 0.1213 0.2070 0.2070 0.2872 0.2872 0.3506 0.3506 0.4019 0.4019 0.6417 0.6417 0.6878 0.6878 0.7925 0.7925 0.9891 0.9891 1.1135 1.1135 1.2405 1.2405 1.4241 1.4241 1.6811 1.6811 1.9302 1.9302 3.6307 3.6307 3.9709 3.9709 4.2194 4.2194 4.4857 4.4857 7.0023 7.0023 7.6106 7.6106 7.8537 7.8537 9.0523 9.0523 k = 0.3429 0.2947 0.2683 ( 13305 PWs) bands (ev): -13.6005 -13.6005 -13.2422 -13.2422 -13.1157 -13.1157 -12.5639 -12.5639 -12.2853 -12.2853 -12.2341 -12.2341 -12.0268 -12.0268 -11.7103 -11.7103 -10.3878 -10.3878 -9.9097 -9.9097 -8.7840 -8.7840 -6.5679 -6.5679 -3.1537 -3.1537 -3.0296 -3.0296 -2.7822 -2.7822 -2.6006 -2.6006 -2.5438 -2.5438 -2.2318 -2.2318 -1.4223 -1.4223 -1.1502 -1.1502 -0.7634 -0.7634 -0.5927 -0.5927 -0.5410 -0.5410 -0.5102 -0.5102 -0.2500 -0.2500 -0.1409 -0.1409 -0.0418 -0.0418 0.1429 0.1429 0.2154 0.2154 0.2955 0.2955 0.3606 0.3606 0.4075 0.4075 0.6419 0.6419 0.6806 0.6806 0.7989 0.7989 0.9879 0.9879 1.1144 1.1144 1.2401 1.2401 1.4176 1.4176 1.6897 1.6897 1.9352 1.9352 3.6128 3.6128 3.9730 3.9730 4.2126 4.2126 4.4891 4.4891 6.9914 6.9914 7.6051 7.6051 7.8490 7.8490 9.0770 9.0770 k = 0.3286 0.2824 0.2571 ( 13304 PWs) bands (ev): -13.6042 -13.6042 -13.2484 -13.2484 -13.1092 -13.1092 -12.5610 -12.5610 -12.2830 -12.2830 -12.2328 -12.2328 -12.0242 -12.0242 -11.7123 -11.7123 -10.3856 -10.3856 -9.9150 -9.9150 -8.7846 -8.7846 -6.5718 -6.5718 -3.1509 -3.1509 -3.0250 -3.0250 -2.7836 -2.7836 -2.6075 -2.6075 -2.5376 -2.5376 -2.2429 -2.2429 -1.4370 -1.4370 -1.1411 -1.1411 -0.7661 -0.7661 -0.5995 -0.5995 -0.5597 -0.5597 -0.4954 -0.4954 -0.2531 -0.2531 -0.1408 -0.1408 -0.0423 -0.0423 0.1628 0.1628 0.2217 0.2217 0.3036 0.3036 0.3705 0.3705 0.4168 0.4168 0.6426 0.6426 0.6734 0.6734 0.8063 0.8063 0.9852 0.9852 1.1153 1.1153 1.2405 1.2405 1.4113 1.4113 1.6984 1.6984 1.9407 1.9407 3.5944 3.5944 3.9747 3.9747 4.2058 4.2058 4.4918 4.4918 6.9806 6.9806 7.6004 7.6004 7.8447 7.8447 9.1016 9.1016 k = 0.3143 0.2702 0.2459 ( 13316 PWs) bands (ev): -13.6082 -13.6082 -13.2541 -13.2541 -13.1028 -13.1028 -12.5579 -12.5579 -12.2805 -12.2805 -12.2315 -12.2315 -12.0219 -12.0219 -11.7144 -11.7144 -10.3832 -10.3832 -9.9203 -9.9203 -8.7853 -8.7853 -6.5763 -6.5763 -3.1503 -3.1503 -3.0172 -3.0172 -2.7863 -2.7863 -2.6200 -2.6200 -2.5255 -2.5255 -2.2524 -2.2524 -1.4500 -1.4500 -1.1310 -1.1310 -0.7768 -0.7768 -0.6132 -0.6132 -0.5748 -0.5748 -0.4726 -0.4726 -0.2532 -0.2532 -0.1411 -0.1411 -0.0460 -0.0460 0.1789 0.1789 0.2299 0.2299 0.3114 0.3114 0.3790 0.3790 0.4291 0.4291 0.6437 0.6437 0.6667 0.6667 0.8146 0.8146 0.9813 0.9813 1.1156 1.1156 1.2421 1.2421 1.4055 1.4055 1.7074 1.7074 1.9467 1.9467 3.5759 3.5759 3.9762 3.9762 4.1993 4.1993 4.4937 4.4937 6.9700 6.9700 7.5968 7.5968 7.8407 7.8407 9.1259 9.1259 k = 0.3000 0.2579 0.2348 ( 13315 PWs) bands (ev): -13.6126 -13.6126 -13.2592 -13.2592 -13.0965 -13.0965 -12.5548 -12.5548 -12.2779 -12.2779 -12.2302 -12.2302 -12.0200 -12.0200 -11.7165 -11.7165 -10.3806 -10.3806 -9.9256 -9.9256 -8.7859 -8.7859 -6.5812 -6.5812 -3.1511 -3.1511 -3.0079 -3.0079 -2.7902 -2.7902 -2.6329 -2.6329 -2.5120 -2.5120 -2.2603 -2.2603 -1.4616 -1.4616 -1.1199 -1.1199 -0.7925 -0.7925 -0.6365 -0.6365 -0.5789 -0.5789 -0.4498 -0.4498 -0.2495 -0.2495 -0.1423 -0.1423 -0.0533 -0.0533 0.1897 0.1897 0.2426 0.2426 0.3184 0.3184 0.3865 0.3865 0.4429 0.4429 0.6442 0.6442 0.6618 0.6618 0.8237 0.8237 0.9766 0.9766 1.1149 1.1149 1.2446 1.2446 1.4000 1.4000 1.7168 1.7168 1.9531 1.9531 3.5575 3.5575 3.9774 3.9774 4.1930 4.1930 4.4948 4.4948 6.9597 6.9597 7.5941 7.5941 7.8373 7.8373 9.1486 9.1486 k = 0.2857 0.2456 0.2236 ( 13325 PWs) bands (ev): -13.6174 -13.6174 -13.2635 -13.2635 -13.0904 -13.0904 -12.5515 -12.5515 -12.2752 -12.2752 -12.2289 -12.2289 -12.0183 -12.0183 -11.7187 -11.7187 -10.3780 -10.3780 -9.9308 -9.9308 -8.7865 -8.7865 -6.5867 -6.5867 -3.1527 -3.1527 -2.9986 -2.9986 -2.7950 -2.7950 -2.6437 -2.6437 -2.4989 -2.4989 -2.2666 -2.2666 -1.4720 -1.4720 -1.1079 -1.1079 -0.8105 -0.8105 -0.6634 -0.6634 -0.5782 -0.5782 -0.4294 -0.4294 -0.2414 -0.2414 -0.1447 -0.1447 -0.0638 -0.0638 0.1965 0.1965 0.2582 0.2582 0.3250 0.3250 0.3940 0.3940 0.4570 0.4570 0.6428 0.6428 0.6601 0.6601 0.8334 0.8334 0.9718 0.9718 1.1127 1.1127 1.2480 1.2480 1.3950 1.3950 1.7267 1.7267 1.9599 1.9599 3.5394 3.5394 3.9786 3.9786 4.1871 4.1871 4.4950 4.4950 6.9497 6.9497 7.5926 7.5926 7.8343 7.8343 9.1539 9.1539 k = 0.2714 0.2333 0.2124 ( 13329 PWs) bands (ev): -13.6225 -13.6225 -13.2671 -13.2671 -13.0847 -13.0847 -12.5482 -12.5482 -12.2724 -12.2724 -12.2276 -12.2276 -12.0171 -12.0171 -11.7208 -11.7208 -10.3752 -10.3752 -9.9358 -9.9358 -8.7870 -8.7870 -6.5926 -6.5926 -3.1547 -3.1547 -2.9911 -2.9911 -2.7995 -2.7995 -2.6514 -2.6514 -2.4870 -2.4870 -2.2714 -2.2714 -1.4815 -1.4815 -1.0949 -1.0949 -0.8290 -0.8290 -0.6907 -0.6907 -0.5760 -0.5760 -0.4129 -0.4129 -0.2285 -0.2285 -0.1487 -0.1487 -0.0767 -0.0767 0.2011 0.2011 0.2734 0.2734 0.3320 0.3320 0.4019 0.4019 0.4707 0.4707 0.6395 0.6395 0.6612 0.6612 0.8436 0.8436 0.9674 0.9674 1.1089 1.1089 1.2522 1.2522 1.3905 1.3905 1.7370 1.7370 1.9670 1.9670 3.5218 3.5218 3.9797 3.9797 4.1817 4.1817 4.4945 4.4945 6.9401 6.9401 7.5921 7.5921 7.8320 7.8320 9.1143 9.1143 k = 0.2571 0.2210 0.2012 ( 13326 PWs) bands (ev): -13.6279 -13.6279 -13.2697 -13.2697 -13.0794 -13.0794 -12.5447 -12.5447 -12.2696 -12.2696 -12.2264 -12.2264 -12.0163 -12.0163 -11.7229 -11.7229 -10.3723 -10.3723 -9.9406 -9.9406 -8.7876 -8.7876 -6.5989 -6.5989 -3.1571 -3.1571 -2.9865 -2.9865 -2.8027 -2.8027 -2.6556 -2.6556 -2.4768 -2.4768 -2.2744 -2.2744 -1.4907 -1.4907 -1.0812 -1.0812 -0.8467 -0.8467 -0.7174 -0.7174 -0.5730 -0.5730 -0.4009 -0.4009 -0.2116 -0.2116 -0.1548 -0.1548 -0.0908 -0.0908 0.2039 0.2039 0.2862 0.2862 0.3401 0.3401 0.4106 0.4106 0.4840 0.4840 0.6358 0.6358 0.6634 0.6634 0.8541 0.8541 0.9638 0.9638 1.1031 1.1031 1.2569 1.2569 1.3864 1.3864 1.7479 1.7479 1.9743 1.9743 3.5050 3.5050 3.9807 3.9807 4.1768 4.1768 4.4932 4.4932 6.9308 6.9308 7.5925 7.5925 7.8302 7.8302 9.0652 9.0652 k = 0.2429 0.2088 0.1900 ( 13334 PWs) bands (ev): -13.6336 -13.6336 -13.2714 -13.2714 -13.0746 -13.0746 -12.5411 -12.5411 -12.2668 -12.2668 -12.2253 -12.2253 -12.0158 -12.0158 -11.7250 -11.7250 -10.3693 -10.3693 -9.9452 -9.9452 -8.7881 -8.7881 -6.6056 -6.6056 -3.1599 -3.1599 -2.9854 -2.9854 -2.8035 -2.8035 -2.6564 -2.6564 -2.4685 -2.4685 -2.2758 -2.2758 -1.4999 -1.4999 -1.0668 -1.0668 -0.8628 -0.8628 -0.7427 -0.7427 -0.5694 -0.5694 -0.3932 -0.3932 -0.1930 -0.1930 -0.1625 -0.1625 -0.1043 -0.1043 0.2047 0.2047 0.2962 0.2962 0.3487 0.3487 0.4207 0.4207 0.4971 0.4971 0.6323 0.6323 0.6656 0.6656 0.8647 0.8647 0.9610 0.9610 1.0954 1.0954 1.2619 1.2619 1.3829 1.3829 1.7594 1.7594 1.9820 1.9820 3.4891 3.4891 3.9816 3.9816 4.1725 4.1725 4.4913 4.4913 6.9218 6.9218 7.5936 7.5936 7.8293 7.8293 9.0124 9.0124 k = 0.2286 0.1965 0.1789 ( 13338 PWs) bands (ev): -13.6395 -13.6395 -13.2723 -13.2723 -13.0703 -13.0703 -12.5374 -12.5374 -12.2640 -12.2640 -12.2243 -12.2243 -12.0158 -12.0158 -11.7271 -11.7271 -10.3663 -10.3663 -9.9495 -9.9495 -8.7885 -8.7885 -6.6126 -6.6126 -3.1635 -3.1635 -2.9872 -2.9872 -2.8017 -2.8017 -2.6543 -2.6543 -2.4623 -2.4623 -2.2753 -2.2753 -1.5096 -1.5096 -1.0519 -1.0519 -0.8767 -0.8767 -0.7663 -0.7663 -0.5649 -0.5649 -0.3894 -0.3894 -0.1842 -0.1842 -0.1629 -0.1629 -0.1154 -0.1154 0.2031 0.2031 0.3046 0.3046 0.3561 0.3561 0.4324 0.4324 0.5100 0.5100 0.6292 0.6292 0.6679 0.6679 0.8751 0.8751 0.9590 0.9590 1.0859 1.0859 1.2670 1.2670 1.3800 1.3800 1.7714 1.7714 1.9898 1.9898 3.4745 3.4745 3.9825 3.9825 4.1689 4.1689 4.4889 4.4889 6.9132 6.9132 7.5952 7.5952 7.8293 7.8293 8.9575 8.9575 k = 0.2143 0.1842 0.1677 ( 13343 PWs) bands (ev): -13.6455 -13.6455 -13.2722 -13.2722 -13.0666 -13.0666 -12.5337 -12.5337 -12.2612 -12.2612 -12.2235 -12.2235 -12.0161 -12.0161 -11.7292 -11.7292 -10.3631 -10.3631 -9.9535 -9.9535 -8.7889 -8.7889 -6.6198 -6.6198 -3.1686 -3.1686 -2.9904 -2.9904 -2.7979 -2.7979 -2.6497 -2.6497 -2.4585 -2.4585 -2.2728 -2.2728 -1.5201 -1.5201 -1.0369 -1.0369 -0.8880 -0.8880 -0.7876 -0.7876 -0.5594 -0.5594 -0.3888 -0.3888 -0.1944 -0.1944 -0.1521 -0.1521 -0.1189 -0.1189 0.1991 0.1991 0.3126 0.3126 0.3611 0.3611 0.4455 0.4455 0.5228 0.5228 0.6267 0.6267 0.6702 0.6702 0.8851 0.8851 0.9573 0.9573 1.0749 1.0749 1.2721 1.2721 1.3777 1.3777 1.7838 1.7838 1.9978 1.9978 3.4612 3.4612 3.9833 3.9833 4.1661 4.1661 4.4860 4.4860 6.9049 6.9049 7.5971 7.5971 7.8304 7.8304 8.9014 8.9014 k = 0.2000 0.1719 0.1565 ( 13343 PWs) bands (ev): -13.6516 -13.6516 -13.2713 -13.2713 -13.0635 -13.0635 -12.5298 -12.5298 -12.2584 -12.2584 -12.2227 -12.2227 -12.0167 -12.0167 -11.7312 -11.7312 -10.3600 -10.3600 -9.9573 -9.9573 -8.7893 -8.7893 -6.6271 -6.6271 -3.1757 -3.1757 -2.9931 -2.9931 -2.7930 -2.7930 -2.6432 -2.6432 -2.4570 -2.4570 -2.2683 -2.2683 -1.5317 -1.5317 -1.0224 -1.0224 -0.8963 -0.8963 -0.8062 -0.8062 -0.5529 -0.5529 -0.3912 -0.3912 -0.2079 -0.2079 -0.1533 -0.1533 -0.1075 -0.1075 0.1930 0.1930 0.3205 0.3205 0.3635 0.3635 0.4593 0.4593 0.5355 0.5355 0.6248 0.6248 0.6732 0.6732 0.8943 0.8943 0.9554 0.9554 1.0628 1.0628 1.2770 1.2770 1.3760 1.3760 1.7965 1.7965 2.0059 2.0059 3.4495 3.4495 3.9839 3.9839 4.1641 4.1641 4.4827 4.4827 6.8969 6.8969 7.5990 7.5990 7.8327 7.8327 8.8450 8.8450 k = 0.1857 0.1596 0.1453 ( 13347 PWs) bands (ev): -13.6577 -13.6577 -13.2696 -13.2696 -13.0611 -13.0611 -12.5259 -12.5259 -12.2557 -12.2557 -12.2220 -12.2220 -12.0176 -12.0176 -11.7332 -11.7332 -10.3568 -10.3568 -9.9608 -9.9608 -8.7896 -8.7896 -6.6345 -6.6345 -3.1851 -3.1851 -2.9938 -2.9938 -2.7878 -2.7878 -2.6354 -2.6354 -2.4576 -2.4576 -2.2617 -2.2617 -1.5444 -1.5444 -1.0093 -1.0093 -0.9012 -0.9012 -0.8215 -0.8215 -0.5454 -0.5454 -0.3965 -0.3965 -0.2205 -0.2205 -0.1620 -0.1620 -0.0900 -0.0900 0.1855 0.1855 0.3281 0.3281 0.3640 0.3640 0.4725 0.4725 0.5479 0.5479 0.6239 0.6239 0.6770 0.6770 0.9023 0.9023 0.9527 0.9527 1.0503 1.0503 1.2816 1.2816 1.3749 1.3749 1.8093 1.8093 2.0141 2.0141 3.4395 3.4395 3.9843 3.9843 4.1628 4.1628 4.4792 4.4792 6.8892 6.8892 7.6008 7.6008 7.8363 7.8363 8.7890 8.7890 k = 0.1714 0.1474 0.1341 ( 13341 PWs) bands (ev): -13.6637 -13.6637 -13.2672 -13.2672 -13.0594 -13.0594 -12.5220 -12.5220 -12.2532 -12.2532 -12.2214 -12.2214 -12.0188 -12.0188 -11.7351 -11.7351 -10.3536 -10.3536 -9.9639 -9.9639 -8.7899 -8.7899 -6.6419 -6.6419 -3.1966 -3.1966 -2.9916 -2.9916 -2.7831 -2.7831 -2.6272 -2.6272 -2.4601 -2.4601 -2.2532 -2.2532 -1.5583 -1.5583 -0.9993 -0.9993 -0.9021 -0.9021 -0.8331 -0.8331 -0.5372 -0.5372 -0.4041 -0.4041 -0.2305 -0.2305 -0.1725 -0.1725 -0.0734 -0.0734 0.1772 0.1772 0.3342 0.3342 0.3640 0.3640 0.4843 0.4843 0.5598 0.5598 0.6245 0.6245 0.6818 0.6818 0.9084 0.9084 0.9488 0.9488 1.0382 1.0382 1.2860 1.2860 1.3743 1.3743 1.8221 1.8221 2.0222 2.0222 3.4312 3.4312 3.9845 3.9845 4.1622 4.1622 4.4757 4.4757 6.8819 6.8819 7.6021 7.6021 7.8411 7.8411 8.7342 8.7342 k = 0.1571 0.1351 0.1230 ( 13355 PWs) bands (ev): -13.6695 -13.6695 -13.2642 -13.2642 -13.0583 -13.0583 -12.5181 -12.5181 -12.2508 -12.2508 -12.2208 -12.2208 -12.0201 -12.0201 -11.7371 -11.7371 -10.3505 -10.3505 -9.9668 -9.9668 -8.7902 -8.7902 -6.6491 -6.6491 -3.2099 -3.2099 -2.9861 -2.9861 -2.7789 -2.7789 -2.6193 -2.6193 -2.4640 -2.4640 -2.2429 -2.2429 -1.5731 -1.5731 -0.9940 -0.9940 -0.8981 -0.8981 -0.8406 -0.8406 -0.5291 -0.5291 -0.4131 -0.4131 -0.2372 -0.2372 -0.1834 -0.1834 -0.0600 -0.0600 0.1685 0.1685 0.3372 0.3372 0.3656 0.3656 0.4941 0.4941 0.5711 0.5711 0.6271 0.6271 0.6875 0.6875 0.9119 0.9119 0.9434 0.9434 1.0275 1.0275 1.2900 1.2900 1.3742 1.3742 1.8346 1.8346 2.0301 2.0301 3.4247 3.4247 3.9845 3.9845 4.1624 4.1624 4.4721 4.4721 6.8750 6.8750 7.6030 7.6030 7.8472 7.8472 8.6811 8.6811 k = 0.1429 0.1228 0.1118 ( 13360 PWs) bands (ev): -13.6752 -13.6752 -13.2607 -13.2607 -13.0578 -13.0578 -12.5143 -12.5143 -12.2486 -12.2486 -12.2202 -12.2202 -12.0216 -12.0216 -11.7389 -11.7389 -10.3475 -10.3475 -9.9694 -9.9694 -8.7904 -8.7904 -6.6560 -6.6560 -3.2242 -3.2242 -2.9776 -2.9776 -2.7755 -2.7755 -2.6126 -2.6126 -2.4689 -2.4689 -2.2311 -2.2311 -1.5886 -1.5886 -0.9938 -0.9938 -0.8899 -0.8899 -0.8435 -0.8435 -0.5218 -0.5218 -0.4223 -0.4223 -0.2405 -0.2405 -0.1938 -0.1938 -0.0509 -0.0509 0.1597 0.1597 0.3360 0.3360 0.3700 0.3700 0.5020 0.5020 0.5818 0.5818 0.6318 0.6318 0.6937 0.6937 0.9116 0.9116 0.9368 0.9368 1.0192 1.0192 1.2939 1.2939 1.3745 1.3745 1.8467 1.8467 2.0377 2.0377 3.4199 3.4199 3.9842 3.9842 4.1632 4.1632 4.4685 4.4685 6.8685 6.8685 7.6034 7.6034 7.8544 7.8544 8.6303 8.6303 k = 0.1286 0.1105 0.1006 ( 13359 PWs) bands (ev): -13.6805 -13.6805 -13.2568 -13.2568 -13.0579 -13.0579 -12.5107 -12.5107 -12.2465 -12.2465 -12.2195 -12.2195 -12.0233 -12.0233 -11.7407 -11.7407 -10.3445 -10.3445 -9.9718 -9.9718 -8.7906 -8.7906 -6.6626 -6.6626 -3.2390 -3.2390 -2.9665 -2.9665 -2.7729 -2.7729 -2.6078 -2.6078 -2.4742 -2.4742 -2.2181 -2.2181 -1.6043 -1.6043 -0.9978 -0.9978 -0.8801 -0.8801 -0.8413 -0.8413 -0.5164 -0.5164 -0.4301 -0.4301 -0.2408 -0.2408 -0.2027 -0.2027 -0.0463 -0.0463 0.1506 0.1506 0.3319 0.3319 0.3760 0.3760 0.5084 0.5084 0.5919 0.5919 0.6384 0.6384 0.7000 0.7000 0.9066 0.9066 0.9298 0.9298 1.0139 1.0139 1.2975 1.2975 1.3749 1.3749 1.8583 1.8583 2.0450 2.0450 3.4168 3.4168 3.9836 3.9836 4.1644 4.1644 4.4652 4.4652 6.8624 6.8624 7.6033 7.6033 7.8624 7.8624 8.5824 8.5824 k = 0.1143 0.0982 0.0894 ( 13368 PWs) bands (ev): -13.6854 -13.6854 -13.2527 -13.2527 -13.0585 -13.0585 -12.5073 -12.5073 -12.2447 -12.2447 -12.2189 -12.2189 -12.0249 -12.0249 -11.7423 -11.7423 -10.3417 -10.3417 -9.9739 -9.9739 -8.7908 -8.7908 -6.6688 -6.6688 -3.2535 -3.2535 -2.9532 -2.9532 -2.7712 -2.7712 -2.6055 -2.6055 -2.4790 -2.4790 -2.2044 -2.2044 -1.6199 -1.6199 -1.0041 -1.0041 -0.8728 -0.8728 -0.8326 -0.8326 -0.5137 -0.5137 -0.4356 -0.4356 -0.2392 -0.2392 -0.2087 -0.2087 -0.0463 -0.0463 0.1409 0.1409 0.3265 0.3265 0.3821 0.3821 0.5144 0.5144 0.6013 0.6013 0.6465 0.6465 0.7059 0.7059 0.8977 0.8977 0.9224 0.9224 1.0114 1.0114 1.3009 1.3009 1.3754 1.3754 1.8690 1.8690 2.0518 2.0518 3.4151 3.4151 3.9829 3.9829 4.1661 4.1661 4.4620 4.4620 6.8569 6.8569 7.6030 7.6030 7.8709 7.8709 8.5378 8.5378 k = 0.1000 0.0860 0.0783 ( 13366 PWs) bands (ev): -13.6899 -13.6899 -13.2485 -13.2485 -13.0594 -13.0594 -12.5041 -12.5041 -12.2431 -12.2431 -12.2182 -12.2182 -12.0266 -12.0266 -11.7439 -11.7439 -10.3391 -10.3391 -9.9758 -9.9758 -8.7909 -8.7909 -6.6745 -6.6745 -3.2672 -3.2672 -2.9382 -2.9382 -2.7704 -2.7704 -2.6061 -2.6061 -2.4831 -2.4831 -2.1904 -2.1904 -1.6348 -1.6348 -1.0115 -1.0115 -0.8695 -0.8695 -0.8182 -0.8182 -0.5133 -0.5133 -0.4389 -0.4389 -0.2370 -0.2370 -0.2098 -0.2098 -0.0505 -0.0505 0.1303 0.1303 0.3208 0.3208 0.3875 0.3875 0.5208 0.5208 0.6101 0.6101 0.6554 0.6554 0.7109 0.7109 0.8868 0.8868 0.9141 0.9141 1.0112 1.0112 1.3041 1.3041 1.3760 1.3760 1.8789 1.8789 2.0579 2.0579 3.4146 3.4146 3.9819 3.9819 4.1679 4.1679 4.4592 4.4592 6.8520 6.8520 7.6024 7.6024 7.8795 7.8795 8.4971 8.4971 k = 0.0857 0.0737 0.0671 ( 13363 PWs) bands (ev): -13.6939 -13.6939 -13.2443 -13.2443 -13.0607 -13.0607 -12.5012 -12.5012 -12.2417 -12.2417 -12.2176 -12.2176 -12.0282 -12.0282 -11.7453 -11.7453 -10.3367 -10.3367 -9.9774 -9.9774 -8.7910 -8.7910 -6.6796 -6.6796 -3.2798 -3.2798 -2.9220 -2.9220 -2.7707 -2.7707 -2.6094 -2.6094 -2.4859 -2.4859 -2.1767 -2.1767 -1.6487 -1.6487 -1.0190 -1.0190 -0.8690 -0.8690 -0.8009 -0.8009 -0.5141 -0.5141 -0.4416 -0.4416 -0.2348 -0.2348 -0.2050 -0.2050 -0.0582 -0.0582 0.1182 0.1182 0.3153 0.3153 0.3918 0.3918 0.5282 0.5282 0.6184 0.6184 0.6642 0.6642 0.7145 0.7145 0.8758 0.8758 0.9046 0.9046 1.0124 1.0124 1.3070 1.3070 1.3765 1.3765 1.8876 1.8876 2.0634 2.0634 3.4150 3.4150 3.9809 3.9809 4.1699 4.1699 4.4566 4.4566 6.8476 6.8476 7.6017 7.6017 7.8880 7.8880 8.4607 8.4607 k = 0.0714 0.0614 0.0559 ( 13358 PWs) bands (ev): -13.6974 -13.6974 -13.2404 -13.2404 -13.0620 -13.0620 -12.4987 -12.4987 -12.2406 -12.2406 -12.2169 -12.2169 -12.0296 -12.0296 -11.7465 -11.7465 -10.3346 -10.3346 -9.9787 -9.9787 -8.7911 -8.7911 -6.6840 -6.6840 -3.2909 -3.2909 -2.9050 -2.9050 -2.7721 -2.7721 -2.6150 -2.6150 -2.4876 -2.4876 -2.1638 -2.1638 -1.6612 -1.6612 -1.0260 -1.0260 -0.8702 -0.8702 -0.7829 -0.7829 -0.5151 -0.5151 -0.4447 -0.4447 -0.2313 -0.2313 -0.1960 -0.1960 -0.0684 -0.0684 0.1047 0.1047 0.3105 0.3105 0.3948 0.3948 0.5367 0.5367 0.6259 0.6259 0.6723 0.6723 0.7166 0.7166 0.8661 0.8661 0.8945 0.8945 1.0142 1.0142 1.3097 1.3097 1.3769 1.3769 1.8952 1.8952 2.0682 2.0682 3.4161 3.4161 3.9798 3.9798 4.1718 4.1718 4.4544 4.4544 6.8438 6.8438 7.6009 7.6009 7.8959 7.8959 8.4290 8.4290 k = 0.0571 0.0491 0.0447 ( 13357 PWs) bands (ev): -13.7003 -13.7003 -13.2369 -13.2369 -13.0634 -13.0634 -12.4967 -12.4967 -12.2397 -12.2397 -12.2163 -12.2163 -12.0309 -12.0309 -11.7475 -11.7475 -10.3328 -10.3328 -9.9799 -9.9799 -8.7911 -8.7911 -6.6877 -6.6877 -3.3002 -3.3002 -2.8879 -2.8879 -2.7749 -2.7749 -2.6218 -2.6218 -2.4884 -2.4884 -2.1523 -2.1523 -1.6719 -1.6719 -1.0321 -1.0321 -0.8725 -0.8725 -0.7657 -0.7657 -0.5159 -0.5159 -0.4487 -0.4487 -0.2252 -0.2252 -0.1852 -0.1852 -0.0799 -0.0799 0.0901 0.0901 0.3065 0.3065 0.3968 0.3968 0.5459 0.5459 0.6328 0.6328 0.6786 0.6786 0.7176 0.7176 0.8585 0.8585 0.8841 0.8841 1.0162 1.0162 1.3119 1.3119 1.3772 1.3772 1.9016 1.9016 2.0721 2.0721 3.4175 3.4175 3.9787 3.9787 4.1736 4.1736 4.4526 4.4526 6.8407 6.8407 7.6003 7.6003 7.9029 7.9029 8.4024 8.4024 k = 0.0429 0.0368 0.0335 ( 13361 PWs) bands (ev): -13.7026 -13.7026 -13.2339 -13.2339 -13.0647 -13.0647 -12.4950 -12.4950 -12.2389 -12.2389 -12.2158 -12.2158 -12.0319 -12.0319 -11.7484 -11.7484 -10.3314 -10.3314 -9.9807 -9.9807 -8.7912 -8.7912 -6.6906 -6.6906 -3.3077 -3.3077 -2.8713 -2.8713 -2.7792 -2.7792 -2.6287 -2.6287 -2.4886 -2.4886 -2.1428 -2.1428 -1.6805 -1.6805 -1.0371 -1.0371 -0.8752 -0.8752 -0.7504 -0.7504 -0.5166 -0.5166 -0.4529 -0.4529 -0.2163 -0.2163 -0.1754 -0.1754 -0.0911 -0.0911 0.0754 0.0754 0.3033 0.3033 0.3979 0.3979 0.5551 0.5551 0.6389 0.6389 0.6819 0.6819 0.7186 0.7186 0.8533 0.8533 0.8741 0.8741 1.0181 1.0181 1.3138 1.3138 1.3774 1.3774 1.9066 1.9066 2.0752 2.0752 3.4190 3.4190 3.9778 3.9778 4.1751 4.1751 4.4511 4.4511 6.8383 6.8383 7.5998 7.5998 7.9087 7.9087 8.3813 8.3813 k = 0.0286 0.0246 0.0224 ( 13359 PWs) bands (ev): -13.7043 -13.7043 -13.2317 -13.2317 -13.0658 -13.0658 -12.4938 -12.4938 -12.2384 -12.2384 -12.2154 -12.2154 -12.0327 -12.0327 -11.7490 -11.7490 -10.3303 -10.3303 -9.9814 -9.9814 -8.7912 -8.7912 -6.6928 -6.6928 -3.3131 -3.3131 -2.8562 -2.8562 -2.7847 -2.7847 -2.6347 -2.6347 -2.4885 -2.4885 -2.1356 -2.1356 -1.6868 -1.6868 -1.0407 -1.0407 -0.8777 -0.8777 -0.7383 -0.7383 -0.5173 -0.5173 -0.4567 -0.4567 -0.2052 -0.2052 -0.1701 -0.1701 -0.0993 -0.0993 0.0622 0.0622 0.3011 0.3011 0.3985 0.3985 0.5631 0.5631 0.6441 0.6441 0.6817 0.6817 0.7202 0.7202 0.8508 0.8508 0.8653 0.8653 1.0195 1.0195 1.3151 1.3151 1.3776 1.3776 1.9102 1.9102 2.0774 2.0774 3.4203 3.4203 3.9771 3.9771 4.1763 4.1763 4.4500 4.4500 6.8365 6.8365 7.5994 7.5994 7.9130 7.9130 8.3660 8.3660 k = 0.0143 0.0123 0.0112 ( 13360 PWs) bands (ev): -13.7053 -13.7053 -13.2303 -13.2303 -13.0664 -13.0664 -12.4931 -12.4931 -12.2381 -12.2381 -12.2151 -12.2151 -12.0332 -12.0332 -11.7493 -11.7493 -10.3297 -10.3297 -9.9817 -9.9817 -8.7912 -8.7912 -6.6941 -6.6941 -3.3164 -3.3164 -2.8445 -2.8445 -2.7903 -2.7903 -2.6387 -2.6387 -2.4884 -2.4884 -2.1312 -2.1312 -1.6907 -1.6907 -1.0429 -1.0429 -0.8795 -0.8795 -0.7305 -0.7305 -0.5180 -0.5180 -0.4591 -0.4591 -0.1929 -0.1929 -0.1723 -0.1723 -0.1029 -0.1029 0.0528 0.0528 0.2997 0.2997 0.3988 0.3988 0.5686 0.5686 0.6481 0.6481 0.6797 0.6797 0.7220 0.7220 0.8508 0.8508 0.8582 0.8582 1.0204 1.0204 1.3160 1.3160 1.3777 1.3777 1.9124 1.9124 2.0787 2.0787 3.4211 3.4211 3.9767 3.9767 4.1770 4.1770 4.4494 4.4494 6.8355 6.8355 7.5992 7.5992 7.9157 7.9157 8.3567 8.3567 k = 0.0000 0.0000 0.0000 ( 13355 PWs) bands (ev): -13.7056 -13.7056 -13.2299 -13.2299 -13.0666 -13.0666 -12.4928 -12.4928 -12.2380 -12.2380 -12.2151 -12.2151 -12.0334 -12.0334 -11.7495 -11.7495 -10.3295 -10.3295 -9.9819 -9.9819 -8.7912 -8.7912 -6.6945 -6.6945 -3.3175 -3.3175 -2.8397 -2.8397 -2.7929 -2.7929 -2.6401 -2.6401 -2.4884 -2.4884 -2.1297 -2.1297 -1.6920 -1.6920 -1.0437 -1.0437 -0.8801 -0.8801 -0.7277 -0.7277 -0.5183 -0.5183 -0.4600 -0.4600 -0.1814 -0.1814 -0.1807 -0.1807 -0.1035 -0.1035 0.0493 0.0493 0.2993 0.2993 0.3988 0.3988 0.5706 0.5706 0.6497 0.6497 0.6785 0.6785 0.7228 0.7228 0.8529 0.8529 0.8537 0.8537 1.0207 1.0207 1.3163 1.3163 1.3777 1.3777 1.9131 1.9131 2.0792 2.0792 3.4214 3.4214 3.9765 3.9765 4.1772 4.1772 4.4492 4.4492 6.8351 6.8351 7.5991 7.5991 7.9166 7.9166 8.3536 8.3536 Writing output data file SbI3Cl8.save init_run : 0.96s CPU 1.19s WALL ( 1 calls) electrons : 458.51s CPU 462.32s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.09s WALL ( 1 calls) potinit : 0.04s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 458.50s CPU 462.31s 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 : 0.20s CPU 0.22s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.15s WALL ( 199 calls) cegterg : 422.88s CPU 425.99s WALL ( 324 calls) Called by sum_band: Called by *egterg: h_psi : 225.16s CPU 228.00s WALL ( 5608 calls) s_psi : 26.41s CPU 26.41s WALL ( 5608 calls) g_psi : 0.42s CPU 0.41s WALL ( 5085 calls) cdiaghg : 146.81s CPU 147.00s WALL ( 5284 calls) cegterg:over : 20.58s CPU 20.73s WALL ( 5085 calls) cegterg:upda : 14.50s CPU 14.66s WALL ( 5085 calls) cegterg:last : 8.33s CPU 8.44s WALL ( 722 calls) cdiaghg:chol : 5.86s CPU 5.81s WALL ( 5284 calls) cdiaghg:inve : 4.51s CPU 4.47s WALL ( 5284 calls) cdiaghg:para : 9.49s CPU 9.65s WALL ( 10568 calls) Called by h_psi: h_psi:vloc : 177.86s CPU 180.65s WALL ( 5608 calls) h_psi:vnl : 46.85s CPU 46.87s WALL ( 5608 calls) add_vuspsi : 25.09s CPU 25.04s WALL ( 5608 calls) General routines calbec : 21.73s CPU 21.82s WALL ( 5608 calls) fft : 0.01s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 170.46s CPU 173.03s WALL ( 868048 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.29s CPU 0.40s WALL ( 398 calls) Parallel routines fft_scatter : 116.59s CPU 118.56s WALL ( 868071 calls) PWSCF : 8m41.17s CPU 8m59.16s WALL This run was terminated on: 10:18:59 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=