Program PWSCF v.5.1.1 starts on 3Nov2015 at 0:35:36 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Na3SbSe4.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 76 62 17 2919 2177 323 Max 77 63 18 2922 2206 328 Sum 3669 3017 841 140153 105213 15587 bravais-lattice index = 14 lattice parameter (alat) = 12.2758 a.u. unit-cell volume = 1424.0460 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.275767 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.333333 celldm(5)= -0.333333 celldm(6)= -0.333333 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.333333 0.942809 0.000000 ) a(3) = ( -0.333333 -0.471405 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.353553 0.612372 ) b(2) = ( 0.000000 1.060660 0.612372 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Sb read from file: /home/autes/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. # 2 for Se read from file: /home/autes/Pseudo/Se_MT_PBE.UPF MD5 check sum: 8b5aa0a73ac3f20b8f2ba32420215307 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1211 points, 3 beta functions with: l(1) = 0 l(2) = 1 l(3) = 1 PseudoPot. # 3 for Na read from file: /home/autes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Sb 5.00 121.76000 Sb( 1.00) Se 6.00 78.96000 Se( 1.00) Na 9.00 22.98980 Na( 1.00) 2 Sym. Ops. (no 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 203 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 2) = ( 0.0119048 -0.0084179 0.0145803), wk = 0.0049261 k( 3) = ( 0.0238095 -0.0168359 0.0291606), wk = 0.0049261 k( 4) = ( 0.0357143 -0.0252538 0.0437409), wk = 0.0049261 k( 5) = ( 0.0476191 -0.0336718 0.0583212), wk = 0.0049261 k( 6) = ( 0.0595238 -0.0420897 0.0729015), wk = 0.0049261 k( 7) = ( 0.0714286 -0.0505076 0.0874818), wk = 0.0049261 k( 8) = ( 0.0833333 -0.0589256 0.1020621), wk = 0.0049261 k( 9) = ( 0.0952381 -0.0673435 0.1166424), wk = 0.0049261 k( 10) = ( 0.1071429 -0.0757614 0.1312227), wk = 0.0049261 k( 11) = ( 0.1190476 -0.0841794 0.1458030), wk = 0.0049261 k( 12) = ( 0.1309524 -0.0925973 0.1603833), wk = 0.0049261 k( 13) = ( 0.1428571 -0.1010153 0.1749635), wk = 0.0049261 k( 14) = ( 0.1547619 -0.1094332 0.1895438), wk = 0.0049261 k( 15) = ( 0.1666667 -0.1178511 0.2041241), wk = 0.0049261 k( 16) = ( 0.1785714 -0.1262691 0.2187044), wk = 0.0049261 k( 17) = ( 0.1904762 -0.1346870 0.2332847), wk = 0.0049261 k( 18) = ( 0.2023810 -0.1431049 0.2478650), wk = 0.0049261 k( 19) = ( 0.2142857 -0.1515229 0.2624453), wk = 0.0049261 k( 20) = ( 0.2261905 -0.1599408 0.2770256), wk = 0.0049261 k( 21) = ( 0.2380952 -0.1683588 0.2916059), wk = 0.0049261 k( 22) = ( 0.2500000 -0.1767767 0.3061862), wk = 0.0049261 k( 23) = ( 0.2619048 -0.1851946 0.3207665), wk = 0.0049261 k( 24) = ( 0.2738095 -0.1936126 0.3353468), wk = 0.0049261 k( 25) = ( 0.2857143 -0.2020305 0.3499271), wk = 0.0049261 k( 26) = ( 0.2976190 -0.2104484 0.3645074), wk = 0.0049261 k( 27) = ( 0.3095238 -0.2188664 0.3790877), wk = 0.0049261 k( 28) = ( 0.3214286 -0.2272843 0.3936680), wk = 0.0049261 k( 29) = ( 0.3333333 -0.2357023 0.4082483), wk = 0.0049261 k( 30) = ( 0.3452381 -0.2441202 0.4228286), wk = 0.0049261 k( 31) = ( 0.3571429 -0.2525381 0.4374089), wk = 0.0049261 k( 32) = ( 0.3690476 -0.2609561 0.4519892), wk = 0.0049261 k( 33) = ( 0.3809524 -0.2693740 0.4665695), wk = 0.0049261 k( 34) = ( 0.3928571 -0.2777919 0.4811498), wk = 0.0049261 k( 35) = ( 0.4047619 -0.2862099 0.4957301), wk = 0.0049261 k( 36) = ( 0.4166667 -0.2946278 0.5103104), wk = 0.0049261 k( 37) = ( 0.4285714 -0.3030458 0.5248907), wk = 0.0049261 k( 38) = ( 0.4404762 -0.3114637 0.5394710), wk = 0.0049261 k( 39) = ( 0.4523810 -0.3198816 0.5540512), wk = 0.0049261 k( 40) = ( 0.4642857 -0.3282996 0.5686315), wk = 0.0049261 k( 41) = ( 0.4761905 -0.3367175 0.5832118), wk = 0.0049261 k( 42) = ( 0.4880952 -0.3451355 0.5977921), wk = 0.0049261 k( 43) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0049261 k( 44) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0049261 k( 45) = ( 0.4833333 -0.3417683 0.6123724), wk = 0.0049261 k( 46) = ( 0.4666667 -0.3299832 0.6123724), wk = 0.0049261 k( 47) = ( 0.4500000 -0.3181981 0.6123724), wk = 0.0049261 k( 48) = ( 0.4333333 -0.3064129 0.6123724), wk = 0.0049261 k( 49) = ( 0.4166667 -0.2946278 0.6123724), wk = 0.0049261 k( 50) = ( 0.4000000 -0.2828427 0.6123724), wk = 0.0049261 k( 51) = ( 0.3833333 -0.2710576 0.6123724), wk = 0.0049261 k( 52) = ( 0.3666667 -0.2592725 0.6123724), wk = 0.0049261 k( 53) = ( 0.3500000 -0.2474874 0.6123724), wk = 0.0049261 k( 54) = ( 0.3333333 -0.2357023 0.6123724), wk = 0.0049261 k( 55) = ( 0.3166667 -0.2239171 0.6123724), wk = 0.0049261 k( 56) = ( 0.3000000 -0.2121320 0.6123724), wk = 0.0049261 k( 57) = ( 0.2833333 -0.2003469 0.6123724), wk = 0.0049261 k( 58) = ( 0.2666667 -0.1885618 0.6123724), wk = 0.0049261 k( 59) = ( 0.2500000 -0.1767767 0.6123724), wk = 0.0049261 k( 60) = ( 0.2333333 -0.1649916 0.6123724), wk = 0.0049261 k( 61) = ( 0.2166667 -0.1532065 0.6123724), wk = 0.0049261 k( 62) = ( 0.2000000 -0.1414214 0.6123724), wk = 0.0049261 k( 63) = ( 0.1833333 -0.1296362 0.6123724), wk = 0.0049261 k( 64) = ( 0.1666667 -0.1178511 0.6123724), wk = 0.0049261 k( 65) = ( 0.1500000 -0.1060660 0.6123724), wk = 0.0049261 k( 66) = ( 0.1333333 -0.0942809 0.6123724), wk = 0.0049261 k( 67) = ( 0.1166667 -0.0824958 0.6123724), wk = 0.0049261 k( 68) = ( 0.1000000 -0.0707107 0.6123724), wk = 0.0049261 k( 69) = ( 0.0833333 -0.0589256 0.6123724), wk = 0.0049261 k( 70) = ( 0.0666667 -0.0471405 0.6123724), wk = 0.0049261 k( 71) = ( 0.0500000 -0.0353553 0.6123724), wk = 0.0049261 k( 72) = ( 0.0333333 -0.0235702 0.6123724), wk = 0.0049261 k( 73) = ( 0.0166667 -0.0117851 0.6123724), wk = 0.0049261 k( 74) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0049261 k( 75) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0049261 k( 76) = ( 0.0000000 0.0000000 0.5919600), wk = 0.0049261 k( 77) = ( 0.0000000 0.0000000 0.5715476), wk = 0.0049261 k( 78) = ( 0.0000000 0.0000000 0.5511352), wk = 0.0049261 k( 79) = ( 0.0000000 0.0000000 0.5307228), wk = 0.0049261 k( 80) = ( 0.0000000 0.0000000 0.5103104), wk = 0.0049261 k( 81) = ( 0.0000000 0.0000000 0.4898979), wk = 0.0049261 k( 82) = ( 0.0000000 0.0000000 0.4694855), wk = 0.0049261 k( 83) = ( 0.0000000 0.0000000 0.4490731), wk = 0.0049261 k( 84) = ( 0.0000000 0.0000000 0.4286607), wk = 0.0049261 k( 85) = ( 0.0000000 0.0000000 0.4082483), wk = 0.0049261 k( 86) = ( 0.0000000 0.0000000 0.3878359), wk = 0.0049261 k( 87) = ( 0.0000000 0.0000000 0.3674235), wk = 0.0049261 k( 88) = ( 0.0000000 0.0000000 0.3470110), wk = 0.0049261 k( 89) = ( 0.0000000 0.0000000 0.3265986), wk = 0.0049261 k( 90) = ( 0.0000000 0.0000000 0.3061862), wk = 0.0049261 k( 91) = ( 0.0000000 0.0000000 0.2857738), wk = 0.0049261 k( 92) = ( 0.0000000 0.0000000 0.2653614), wk = 0.0049261 k( 93) = ( 0.0000000 0.0000000 0.2449490), wk = 0.0049261 k( 94) = ( 0.0000000 0.0000000 0.2245366), wk = 0.0049261 k( 95) = ( 0.0000000 0.0000000 0.2041241), wk = 0.0049261 k( 96) = ( 0.0000000 0.0000000 0.1837117), wk = 0.0049261 k( 97) = ( 0.0000000 0.0000000 0.1632993), wk = 0.0049261 k( 98) = ( 0.0000000 0.0000000 0.1428869), wk = 0.0049261 k( 99) = ( 0.0000000 0.0000000 0.1224745), wk = 0.0049261 k( 100) = ( 0.0000000 0.0000000 0.1020621), wk = 0.0049261 k( 101) = ( 0.0000000 0.0000000 0.0816497), wk = 0.0049261 k( 102) = ( 0.0000000 0.0000000 0.0612372), wk = 0.0049261 k( 103) = ( 0.0000000 0.0000000 0.0408248), wk = 0.0049261 k( 104) = ( 0.0000000 0.0000000 0.0204124), wk = 0.0049261 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 107) = ( 0.0067568 0.0095555 0.0165506), wk = 0.0049261 k( 108) = ( 0.0135135 0.0191110 0.0331012), wk = 0.0049261 k( 109) = ( 0.0202703 0.0286665 0.0496518), wk = 0.0049261 k( 110) = ( 0.0270270 0.0382220 0.0662024), wk = 0.0049261 k( 111) = ( 0.0337838 0.0477775 0.0827530), wk = 0.0049261 k( 112) = ( 0.0405405 0.0573330 0.0993036), wk = 0.0049261 k( 113) = ( 0.0472973 0.0668885 0.1158543), wk = 0.0049261 k( 114) = ( 0.0540540 0.0764440 0.1324048), wk = 0.0049261 k( 115) = ( 0.0608108 0.0859995 0.1489555), wk = 0.0049261 k( 116) = ( 0.0675676 0.0955550 0.1655061), wk = 0.0049261 k( 117) = ( 0.0743243 0.1051105 0.1820567), wk = 0.0049261 k( 118) = ( 0.0810811 0.1146660 0.1986073), wk = 0.0049261 k( 119) = ( 0.0878378 0.1242215 0.2151579), wk = 0.0049261 k( 120) = ( 0.0945946 0.1337770 0.2317085), wk = 0.0049261 k( 121) = ( 0.1013514 0.1433325 0.2482591), wk = 0.0049261 k( 122) = ( 0.1081081 0.1528880 0.2648097), wk = 0.0049261 k( 123) = ( 0.1148649 0.1624434 0.2813603), wk = 0.0049261 k( 124) = ( 0.1216216 0.1719989 0.2979109), wk = 0.0049261 k( 125) = ( 0.1283784 0.1815544 0.3144615), wk = 0.0049261 k( 126) = ( 0.1351351 0.1911099 0.3310121), wk = 0.0049261 k( 127) = ( 0.1418919 0.2006654 0.3475627), wk = 0.0049261 k( 128) = ( 0.1486486 0.2102209 0.3641133), wk = 0.0049261 k( 129) = ( 0.1554054 0.2197764 0.3806640), wk = 0.0049261 k( 130) = ( 0.1621622 0.2293319 0.3972145), wk = 0.0049261 k( 131) = ( 0.1689189 0.2388874 0.4137652), wk = 0.0049261 k( 132) = ( 0.1756757 0.2484429 0.4303158), wk = 0.0049261 k( 133) = ( 0.1824324 0.2579984 0.4468664), wk = 0.0049261 k( 134) = ( 0.1891892 0.2675539 0.4634170), wk = 0.0049261 k( 135) = ( 0.1959460 0.2771094 0.4799676), wk = 0.0049261 k( 136) = ( 0.2027027 0.2866649 0.4965182), wk = 0.0049261 k( 137) = ( 0.2094595 0.2962204 0.5130688), wk = 0.0049261 k( 138) = ( 0.2162162 0.3057759 0.5296194), wk = 0.0049261 k( 139) = ( 0.2229730 0.3153314 0.5461700), wk = 0.0049261 k( 140) = ( 0.2297297 0.3248869 0.5627206), wk = 0.0049261 k( 141) = ( 0.2364865 0.3344424 0.5792712), wk = 0.0049261 k( 142) = ( 0.2432432 0.3439979 0.5958218), wk = 0.0049261 k( 143) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0049261 k( 144) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0049261 k( 145) = ( 0.2567568 0.3344424 0.6123724), wk = 0.0049261 k( 146) = ( 0.2635135 0.3153314 0.6123724), wk = 0.0049261 k( 147) = ( 0.2702703 0.2962204 0.6123724), wk = 0.0049261 k( 148) = ( 0.2770270 0.2771094 0.6123724), wk = 0.0049261 k( 149) = ( 0.2837838 0.2579984 0.6123724), wk = 0.0049261 k( 150) = ( 0.2905405 0.2388874 0.6123724), wk = 0.0049261 k( 151) = ( 0.2972973 0.2197764 0.6123724), wk = 0.0049261 k( 152) = ( 0.3040541 0.2006654 0.6123724), wk = 0.0049261 k( 153) = ( 0.3108108 0.1815544 0.6123724), wk = 0.0049261 k( 154) = ( 0.3175676 0.1624435 0.6123724), wk = 0.0049261 k( 155) = ( 0.3243243 0.1433325 0.6123724), wk = 0.0049261 k( 156) = ( 0.3310811 0.1242215 0.6123724), wk = 0.0049261 k( 157) = ( 0.3378378 0.1051105 0.6123724), wk = 0.0049261 k( 158) = ( 0.3445946 0.0859995 0.6123724), wk = 0.0049261 k( 159) = ( 0.3513514 0.0668885 0.6123724), wk = 0.0049261 k( 160) = ( 0.3581081 0.0477775 0.6123724), wk = 0.0049261 k( 161) = ( 0.3648649 0.0286665 0.6123724), wk = 0.0049261 k( 162) = ( 0.3716216 0.0095555 0.6123724), wk = 0.0049261 k( 163) = ( 0.3783784 -0.0095555 0.6123724), wk = 0.0049261 k( 164) = ( 0.3851351 -0.0286665 0.6123724), wk = 0.0049261 k( 165) = ( 0.3918919 -0.0477775 0.6123724), wk = 0.0049261 k( 166) = ( 0.3986486 -0.0668885 0.6123724), wk = 0.0049261 k( 167) = ( 0.4054054 -0.0859995 0.6123724), wk = 0.0049261 k( 168) = ( 0.4121622 -0.1051105 0.6123724), wk = 0.0049261 k( 169) = ( 0.4189189 -0.1242215 0.6123724), wk = 0.0049261 k( 170) = ( 0.4256757 -0.1433325 0.6123724), wk = 0.0049261 k( 171) = ( 0.4324324 -0.1624435 0.6123724), wk = 0.0049261 k( 172) = ( 0.4391892 -0.1815544 0.6123724), wk = 0.0049261 k( 173) = ( 0.4459459 -0.2006654 0.6123724), wk = 0.0049261 k( 174) = ( 0.4527027 -0.2197764 0.6123724), wk = 0.0049261 k( 175) = ( 0.4594595 -0.2388874 0.6123724), wk = 0.0049261 k( 176) = ( 0.4662162 -0.2579984 0.6123724), wk = 0.0049261 k( 177) = ( 0.4729730 -0.2771094 0.6123724), wk = 0.0049261 k( 178) = ( 0.4797297 -0.2962204 0.6123724), wk = 0.0049261 k( 179) = ( 0.4864865 -0.3153314 0.6123724), wk = 0.0049261 k( 180) = ( 0.4932432 -0.3344424 0.6123724), wk = 0.0049261 k( 181) = ( 0.5000000 -0.3535534 0.6123724), wk = 0.0049261 k( 182) = ( 0.2500000 0.3535534 0.6123724), wk = 0.0049261 k( 183) = ( 0.2380952 0.3367175 0.6123724), wk = 0.0049261 k( 184) = ( 0.2261905 0.3198816 0.6123724), wk = 0.0049261 k( 185) = ( 0.2142857 0.3030458 0.6123724), wk = 0.0049261 k( 186) = ( 0.2023810 0.2862099 0.6123724), wk = 0.0049261 k( 187) = ( 0.1904762 0.2693740 0.6123724), wk = 0.0049261 k( 188) = ( 0.1785714 0.2525381 0.6123724), wk = 0.0049261 k( 189) = ( 0.1666667 0.2357023 0.6123724), wk = 0.0049261 k( 190) = ( 0.1547619 0.2188664 0.6123724), wk = 0.0049261 k( 191) = ( 0.1428571 0.2020305 0.6123724), wk = 0.0049261 k( 192) = ( 0.1309524 0.1851946 0.6123724), wk = 0.0049261 k( 193) = ( 0.1190476 0.1683588 0.6123724), wk = 0.0049261 k( 194) = ( 0.1071429 0.1515229 0.6123724), wk = 0.0049261 k( 195) = ( 0.0952381 0.1346870 0.6123724), wk = 0.0049261 k( 196) = ( 0.0833333 0.1178511 0.6123724), wk = 0.0049261 k( 197) = ( 0.0714286 0.1010153 0.6123724), wk = 0.0049261 k( 198) = ( 0.0595238 0.0841794 0.6123724), wk = 0.0049261 k( 199) = ( 0.0476191 0.0673435 0.6123724), wk = 0.0049261 k( 200) = ( 0.0357143 0.0505076 0.6123724), wk = 0.0049261 k( 201) = ( 0.0238095 0.0336717 0.6123724), wk = 0.0049261 k( 202) = ( 0.0119048 0.0168359 0.6123724), wk = 0.0049261 k( 203) = ( 0.0000000 0.0000000 0.6123724), wk = 0.0049261 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 2) = ( 0.0119048 -0.0119048 0.0119048), wk = 0.0049261 k( 3) = ( 0.0238095 -0.0238095 0.0238095), wk = 0.0049261 k( 4) = ( 0.0357143 -0.0357143 0.0357143), wk = 0.0049261 k( 5) = ( 0.0476191 -0.0476190 0.0476190), wk = 0.0049261 k( 6) = ( 0.0595238 -0.0595238 0.0595238), wk = 0.0049261 k( 7) = ( 0.0714286 -0.0714286 0.0714286), wk = 0.0049261 k( 8) = ( 0.0833333 -0.0833333 0.0833333), wk = 0.0049261 k( 9) = ( 0.0952381 -0.0952381 0.0952381), wk = 0.0049261 k( 10) = ( 0.1071429 -0.1071429 0.1071429), wk = 0.0049261 k( 11) = ( 0.1190476 -0.1190476 0.1190476), wk = 0.0049261 k( 12) = ( 0.1309524 -0.1309524 0.1309524), wk = 0.0049261 k( 13) = ( 0.1428571 -0.1428571 0.1428571), wk = 0.0049261 k( 14) = ( 0.1547619 -0.1547619 0.1547619), wk = 0.0049261 k( 15) = ( 0.1666667 -0.1666667 0.1666667), wk = 0.0049261 k( 16) = ( 0.1785714 -0.1785714 0.1785714), wk = 0.0049261 k( 17) = ( 0.1904762 -0.1904762 0.1904762), wk = 0.0049261 k( 18) = ( 0.2023810 -0.2023809 0.2023809), wk = 0.0049261 k( 19) = ( 0.2142857 -0.2142857 0.2142857), wk = 0.0049261 k( 20) = ( 0.2261905 -0.2261905 0.2261905), wk = 0.0049261 k( 21) = ( 0.2380952 -0.2380952 0.2380952), wk = 0.0049261 k( 22) = ( 0.2500000 -0.2500000 0.2500000), wk = 0.0049261 k( 23) = ( 0.2619048 -0.2619048 0.2619048), wk = 0.0049261 k( 24) = ( 0.2738095 -0.2738095 0.2738095), wk = 0.0049261 k( 25) = ( 0.2857143 -0.2857143 0.2857143), wk = 0.0049261 k( 26) = ( 0.2976190 -0.2976190 0.2976190), wk = 0.0049261 k( 27) = ( 0.3095238 -0.3095238 0.3095238), wk = 0.0049261 k( 28) = ( 0.3214286 -0.3214286 0.3214286), wk = 0.0049261 k( 29) = ( 0.3333333 -0.3333333 0.3333333), wk = 0.0049261 k( 30) = ( 0.3452381 -0.3452381 0.3452381), wk = 0.0049261 k( 31) = ( 0.3571429 -0.3571429 0.3571429), wk = 0.0049261 k( 32) = ( 0.3690476 -0.3690476 0.3690476), wk = 0.0049261 k( 33) = ( 0.3809524 -0.3809524 0.3809524), wk = 0.0049261 k( 34) = ( 0.3928571 -0.3928571 0.3928571), wk = 0.0049261 k( 35) = ( 0.4047619 -0.4047619 0.4047619), wk = 0.0049261 k( 36) = ( 0.4166667 -0.4166667 0.4166667), wk = 0.0049261 k( 37) = ( 0.4285714 -0.4285714 0.4285714), wk = 0.0049261 k( 38) = ( 0.4404762 -0.4404762 0.4404762), wk = 0.0049261 k( 39) = ( 0.4523810 -0.4523809 0.4523810), wk = 0.0049261 k( 40) = ( 0.4642857 -0.4642857 0.4642857), wk = 0.0049261 k( 41) = ( 0.4761905 -0.4761905 0.4761905), wk = 0.0049261 k( 42) = ( 0.4880952 -0.4880952 0.4880952), wk = 0.0049261 k( 43) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0049261 k( 44) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0049261 k( 45) = ( 0.4833333 -0.4833333 0.5000000), wk = 0.0049261 k( 46) = ( 0.4666667 -0.4666667 0.5000000), wk = 0.0049261 k( 47) = ( 0.4500000 -0.4500000 0.5000000), wk = 0.0049261 k( 48) = ( 0.4333333 -0.4333333 0.5000000), wk = 0.0049261 k( 49) = ( 0.4166667 -0.4166667 0.5000000), wk = 0.0049261 k( 50) = ( 0.4000000 -0.4000000 0.5000000), wk = 0.0049261 k( 51) = ( 0.3833333 -0.3833333 0.5000000), wk = 0.0049261 k( 52) = ( 0.3666667 -0.3666667 0.5000000), wk = 0.0049261 k( 53) = ( 0.3500000 -0.3500000 0.5000000), wk = 0.0049261 k( 54) = ( 0.3333333 -0.3333333 0.5000000), wk = 0.0049261 k( 55) = ( 0.3166667 -0.3166667 0.5000000), wk = 0.0049261 k( 56) = ( 0.3000000 -0.3000000 0.5000000), wk = 0.0049261 k( 57) = ( 0.2833333 -0.2833333 0.5000000), wk = 0.0049261 k( 58) = ( 0.2666667 -0.2666667 0.5000000), wk = 0.0049261 k( 59) = ( 0.2500000 -0.2500000 0.5000000), wk = 0.0049261 k( 60) = ( 0.2333333 -0.2333333 0.5000000), wk = 0.0049261 k( 61) = ( 0.2166667 -0.2166667 0.5000000), wk = 0.0049261 k( 62) = ( 0.2000000 -0.2000000 0.5000000), wk = 0.0049261 k( 63) = ( 0.1833333 -0.1833333 0.5000000), wk = 0.0049261 k( 64) = ( 0.1666667 -0.1666667 0.5000000), wk = 0.0049261 k( 65) = ( 0.1500000 -0.1500000 0.5000000), wk = 0.0049261 k( 66) = ( 0.1333333 -0.1333333 0.5000000), wk = 0.0049261 k( 67) = ( 0.1166667 -0.1166667 0.5000000), wk = 0.0049261 k( 68) = ( 0.1000000 -0.1000000 0.5000000), wk = 0.0049261 k( 69) = ( 0.0833333 -0.0833333 0.5000000), wk = 0.0049261 k( 70) = ( 0.0666667 -0.0666667 0.5000000), wk = 0.0049261 k( 71) = ( 0.0500000 -0.0500000 0.5000000), wk = 0.0049261 k( 72) = ( 0.0333333 -0.0333333 0.5000000), wk = 0.0049261 k( 73) = ( 0.0166667 -0.0166667 0.5000000), wk = 0.0049261 k( 74) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049261 k( 75) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049261 k( 76) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0049261 k( 77) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0049261 k( 78) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0049261 k( 79) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0049261 k( 80) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0049261 k( 81) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0049261 k( 82) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0049261 k( 83) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0049261 k( 84) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0049261 k( 85) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0049261 k( 86) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0049261 k( 87) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0049261 k( 88) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0049261 k( 89) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0049261 k( 90) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0049261 k( 91) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0049261 k( 92) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0049261 k( 93) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0049261 k( 94) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0049261 k( 95) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0049261 k( 96) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0049261 k( 97) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0049261 k( 98) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0049261 k( 99) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0049261 k( 100) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0049261 k( 101) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0049261 k( 102) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0049261 k( 103) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0049261 k( 104) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0049261 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0049261 k( 107) = ( 0.0067568 0.0067568 0.0067568), wk = 0.0049261 k( 108) = ( 0.0135135 0.0135135 0.0135135), wk = 0.0049261 k( 109) = ( 0.0202703 0.0202703 0.0202703), wk = 0.0049261 k( 110) = ( 0.0270270 0.0270270 0.0270270), wk = 0.0049261 k( 111) = ( 0.0337838 0.0337838 0.0337838), wk = 0.0049261 k( 112) = ( 0.0405405 0.0405405 0.0405405), wk = 0.0049261 k( 113) = ( 0.0472973 0.0472973 0.0472973), wk = 0.0049261 k( 114) = ( 0.0540540 0.0540540 0.0540540), wk = 0.0049261 k( 115) = ( 0.0608108 0.0608108 0.0608108), wk = 0.0049261 k( 116) = ( 0.0675676 0.0675676 0.0675676), wk = 0.0049261 k( 117) = ( 0.0743243 0.0743243 0.0743243), wk = 0.0049261 k( 118) = ( 0.0810811 0.0810811 0.0810811), wk = 0.0049261 k( 119) = ( 0.0878378 0.0878378 0.0878378), wk = 0.0049261 k( 120) = ( 0.0945946 0.0945946 0.0945946), wk = 0.0049261 k( 121) = ( 0.1013514 0.1013514 0.1013514), wk = 0.0049261 k( 122) = ( 0.1081081 0.1081081 0.1081081), wk = 0.0049261 k( 123) = ( 0.1148649 0.1148649 0.1148649), wk = 0.0049261 k( 124) = ( 0.1216216 0.1216216 0.1216216), wk = 0.0049261 k( 125) = ( 0.1283784 0.1283784 0.1283784), wk = 0.0049261 k( 126) = ( 0.1351351 0.1351351 0.1351351), wk = 0.0049261 k( 127) = ( 0.1418919 0.1418919 0.1418919), wk = 0.0049261 k( 128) = ( 0.1486486 0.1486486 0.1486486), wk = 0.0049261 k( 129) = ( 0.1554054 0.1554054 0.1554054), wk = 0.0049261 k( 130) = ( 0.1621622 0.1621622 0.1621622), wk = 0.0049261 k( 131) = ( 0.1689189 0.1689189 0.1689189), wk = 0.0049261 k( 132) = ( 0.1756757 0.1756757 0.1756757), wk = 0.0049261 k( 133) = ( 0.1824324 0.1824324 0.1824324), wk = 0.0049261 k( 134) = ( 0.1891892 0.1891892 0.1891892), wk = 0.0049261 k( 135) = ( 0.1959460 0.1959460 0.1959459), wk = 0.0049261 k( 136) = ( 0.2027027 0.2027027 0.2027027), wk = 0.0049261 k( 137) = ( 0.2094595 0.2094595 0.2094595), wk = 0.0049261 k( 138) = ( 0.2162162 0.2162162 0.2162162), wk = 0.0049261 k( 139) = ( 0.2229730 0.2229730 0.2229730), wk = 0.0049261 k( 140) = ( 0.2297297 0.2297297 0.2297297), wk = 0.0049261 k( 141) = ( 0.2364865 0.2364865 0.2364865), wk = 0.0049261 k( 142) = ( 0.2432432 0.2432432 0.2432432), wk = 0.0049261 k( 143) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0049261 k( 144) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0049261 k( 145) = ( 0.2567568 0.2297297 0.2567568), wk = 0.0049261 k( 146) = ( 0.2635135 0.2094595 0.2635135), wk = 0.0049261 k( 147) = ( 0.2702703 0.1891892 0.2702703), wk = 0.0049261 k( 148) = ( 0.2770270 0.1689189 0.2770270), wk = 0.0049261 k( 149) = ( 0.2837838 0.1486486 0.2837838), wk = 0.0049261 k( 150) = ( 0.2905405 0.1283784 0.2905405), wk = 0.0049261 k( 151) = ( 0.2972973 0.1081081 0.2972973), wk = 0.0049261 k( 152) = ( 0.3040541 0.0878378 0.3040540), wk = 0.0049261 k( 153) = ( 0.3108108 0.0675676 0.3108108), wk = 0.0049261 k( 154) = ( 0.3175676 0.0472973 0.3175676), wk = 0.0049261 k( 155) = ( 0.3243243 0.0270270 0.3243243), wk = 0.0049261 k( 156) = ( 0.3310811 0.0067568 0.3310811), wk = 0.0049261 k( 157) = ( 0.3378378 -0.0135135 0.3378378), wk = 0.0049261 k( 158) = ( 0.3445946 -0.0337838 0.3445946), wk = 0.0049261 k( 159) = ( 0.3513514 -0.0540540 0.3513513), wk = 0.0049261 k( 160) = ( 0.3581081 -0.0743243 0.3581081), wk = 0.0049261 k( 161) = ( 0.3648649 -0.0945946 0.3648649), wk = 0.0049261 k( 162) = ( 0.3716216 -0.1148649 0.3716216), wk = 0.0049261 k( 163) = ( 0.3783784 -0.1351351 0.3783784), wk = 0.0049261 k( 164) = ( 0.3851351 -0.1554054 0.3851351), wk = 0.0049261 k( 165) = ( 0.3918919 -0.1756757 0.3918919), wk = 0.0049261 k( 166) = ( 0.3986486 -0.1959459 0.3986486), wk = 0.0049261 k( 167) = ( 0.4054054 -0.2162162 0.4054054), wk = 0.0049261 k( 168) = ( 0.4121622 -0.2364865 0.4121622), wk = 0.0049261 k( 169) = ( 0.4189189 -0.2567568 0.4189189), wk = 0.0049261 k( 170) = ( 0.4256757 -0.2770270 0.4256757), wk = 0.0049261 k( 171) = ( 0.4324324 -0.2972973 0.4324324), wk = 0.0049261 k( 172) = ( 0.4391892 -0.3175676 0.4391892), wk = 0.0049261 k( 173) = ( 0.4459459 -0.3378378 0.4459459), wk = 0.0049261 k( 174) = ( 0.4527027 -0.3581081 0.4527027), wk = 0.0049261 k( 175) = ( 0.4594595 -0.3783784 0.4594595), wk = 0.0049261 k( 176) = ( 0.4662162 -0.3986486 0.4662162), wk = 0.0049261 k( 177) = ( 0.4729730 -0.4189189 0.4729730), wk = 0.0049261 k( 178) = ( 0.4797297 -0.4391892 0.4797297), wk = 0.0049261 k( 179) = ( 0.4864865 -0.4594595 0.4864865), wk = 0.0049261 k( 180) = ( 0.4932432 -0.4797297 0.4932432), wk = 0.0049261 k( 181) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0049261 k( 182) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0049261 k( 183) = ( 0.2380952 0.2380952 0.2619048), wk = 0.0049261 k( 184) = ( 0.2261905 0.2261905 0.2738095), wk = 0.0049261 k( 185) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0049261 k( 186) = ( 0.2023810 0.2023810 0.2976190), wk = 0.0049261 k( 187) = ( 0.1904762 0.1904762 0.3095238), wk = 0.0049261 k( 188) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0049261 k( 189) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0049261 k( 190) = ( 0.1547619 0.1547619 0.3452381), wk = 0.0049261 k( 191) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0049261 k( 192) = ( 0.1309524 0.1309524 0.3690476), wk = 0.0049261 k( 193) = ( 0.1190476 0.1190476 0.3809524), wk = 0.0049261 k( 194) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0049261 k( 195) = ( 0.0952381 0.0952381 0.4047619), wk = 0.0049261 k( 196) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0049261 k( 197) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0049261 k( 198) = ( 0.0595238 0.0595238 0.4404762), wk = 0.0049261 k( 199) = ( 0.0476191 0.0476191 0.4523810), wk = 0.0049261 k( 200) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0049261 k( 201) = ( 0.0238095 0.0238095 0.4761905), wk = 0.0049261 k( 202) = ( 0.0119048 0.0119048 0.4880952), wk = 0.0049261 k( 203) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0049261 Dense grid: 140153 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 105213 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.56 Mb ( 544, 68) NL pseudopotentials 0.43 Mb ( 272, 104) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2921) G-vector shells 0.00 Mb ( 545) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.26 Mb ( 544, 272) Each subspace H/S matrix 1.13 Mb ( 272, 272) Each matrix 0.22 Mb ( 104, 2, 68) The potential is recalculated from file : ./Na3SbSe4.save/charge-density.dat Starting wfc are 70 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 46.8 secs Computing kpt #: 2 total cpu time spent up to now is 51.0 secs Computing kpt #: 3 total cpu time spent up to now is 55.3 secs Computing kpt #: 4 total cpu time spent up to now is 59.5 secs Computing kpt #: 5 total cpu time spent up to now is 63.7 secs Computing kpt #: 6 total cpu time spent up to now is 67.8 secs Computing kpt #: 7 total cpu time spent up to now is 72.5 secs Computing kpt #: 8 total cpu time spent up to now is 77.0 secs Computing kpt #: 9 total cpu time spent up to now is 81.2 secs Computing kpt #: 10 total cpu time spent up to now is 85.5 secs Computing kpt #: 11 total cpu time spent up to now is 89.8 secs Computing kpt #: 12 total cpu time spent up to now is 94.0 secs Computing kpt #: 13 total cpu time spent up to now is 98.2 secs Computing kpt #: 14 total cpu time spent up to now is 103.0 secs Computing kpt #: 15 total cpu time spent up to now is 107.4 secs Computing kpt #: 16 total cpu time spent up to now is 111.9 secs Computing kpt #: 17 total cpu time spent up to now is 116.2 secs Computing kpt #: 18 total cpu time spent up to now is 120.4 secs Computing kpt #: 19 total cpu time spent up to now is 124.6 secs Computing kpt #: 20 total cpu time spent up to now is 128.9 secs Computing kpt #: 21 total cpu time spent up to now is 133.4 secs Computing kpt #: 22 total cpu time spent up to now is 137.6 secs Computing kpt #: 23 total cpu time spent up to now is 142.0 secs Computing kpt #: 24 total cpu time spent up to now is 146.2 secs Computing kpt #: 25 total cpu time spent up to now is 150.4 secs Computing kpt #: 26 total cpu time spent up to now is 154.6 secs Computing kpt #: 27 total cpu time spent up to now is 158.9 secs Computing kpt #: 28 total cpu time spent up to now is 163.3 secs Computing kpt #: 29 total cpu time spent up to now is 167.5 secs Computing kpt #: 30 total cpu time spent up to now is 171.6 secs Computing kpt #: 31 total cpu time spent up to now is 175.8 secs Computing kpt #: 32 total cpu time spent up to now is 180.0 secs Computing kpt #: 33 total cpu time spent up to now is 184.2 secs Computing kpt #: 34 total cpu time spent up to now is 188.4 secs Computing kpt #: 35 total cpu time spent up to now is 193.0 secs Computing kpt #: 36 total cpu time spent up to now is 199.3 secs Computing kpt #: 37 total cpu time spent up to now is 206.5 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 215.4 secs Computing kpt #: 39 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 224.3 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 233.6 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 244.0 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 253.9 secs Computing kpt #: 43 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 263.0 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 273.3 secs Computing kpt #: 45 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 283.7 secs Computing kpt #: 46 total cpu time spent up to now is 290.7 secs Computing kpt #: 47 total cpu time spent up to now is 298.3 secs Computing kpt #: 48 total cpu time spent up to now is 304.8 secs Computing kpt #: 49 total cpu time spent up to now is 310.3 secs Computing kpt #: 50 total cpu time spent up to now is 315.7 secs Computing kpt #: 51 total cpu time spent up to now is 321.1 secs Computing kpt #: 52 total cpu time spent up to now is 325.9 secs Computing kpt #: 53 total cpu time spent up to now is 330.5 secs Computing kpt #: 54 total cpu time spent up to now is 335.2 secs Computing kpt #: 55 total cpu time spent up to now is 340.1 secs Computing kpt #: 56 total cpu time spent up to now is 344.7 secs Computing kpt #: 57 total cpu time spent up to now is 349.3 secs Computing kpt #: 58 total cpu time spent up to now is 353.8 secs Computing kpt #: 59 total cpu time spent up to now is 358.4 secs Computing kpt #: 60 total cpu time spent up to now is 362.8 secs Computing kpt #: 61 total cpu time spent up to now is 367.4 secs Computing kpt #: 62 total cpu time spent up to now is 372.1 secs Computing kpt #: 63 total cpu time spent up to now is 376.6 secs Computing kpt #: 64 total cpu time spent up to now is 381.2 secs Computing kpt #: 65 total cpu time spent up to now is 386.7 secs Computing kpt #: 66 total cpu time spent up to now is 391.2 secs Computing kpt #: 67 total cpu time spent up to now is 395.6 secs Computing kpt #: 68 total cpu time spent up to now is 400.1 secs Computing kpt #: 69 total cpu time spent up to now is 404.6 secs Computing kpt #: 70 total cpu time spent up to now is 409.1 secs Computing kpt #: 71 total cpu time spent up to now is 413.3 secs Computing kpt #: 72 total cpu time spent up to now is 417.7 secs Computing kpt #: 73 total cpu time spent up to now is 422.0 secs Computing kpt #: 74 total cpu time spent up to now is 426.4 secs Computing kpt #: 75 total cpu time spent up to now is 430.6 secs Computing kpt #: 76 total cpu time spent up to now is 435.0 secs Computing kpt #: 77 total cpu time spent up to now is 439.5 secs Computing kpt #: 78 total cpu time spent up to now is 444.1 secs Computing kpt #: 79 total cpu time spent up to now is 448.3 secs Computing kpt #: 80 total cpu time spent up to now is 452.5 secs Computing kpt #: 81 total cpu time spent up to now is 456.6 secs Computing kpt #: 82 total cpu time spent up to now is 460.8 secs Computing kpt #: 83 total cpu time spent up to now is 464.9 secs Computing kpt #: 84 total cpu time spent up to now is 469.1 secs Computing kpt #: 85 total cpu time spent up to now is 473.2 secs Computing kpt #: 86 total cpu time spent up to now is 477.4 secs Computing kpt #: 87 total cpu time spent up to now is 481.5 secs Computing kpt #: 88 total cpu time spent up to now is 485.7 secs Computing kpt #: 89 total cpu time spent up to now is 490.0 secs Computing kpt #: 90 total cpu time spent up to now is 494.6 secs Computing kpt #: 91 total cpu time spent up to now is 499.0 secs Computing kpt #: 92 total cpu time spent up to now is 504.2 secs Computing kpt #: 93 total cpu time spent up to now is 508.9 secs Computing kpt #: 94 total cpu time spent up to now is 513.8 secs Computing kpt #: 95 total cpu time spent up to now is 519.6 secs Computing kpt #: 96 total cpu time spent up to now is 524.1 secs Computing kpt #: 97 total cpu time spent up to now is 528.8 secs Computing kpt #: 98 total cpu time spent up to now is 533.2 secs Computing kpt #: 99 total cpu time spent up to now is 538.9 secs Computing kpt #: 100 total cpu time spent up to now is 544.3 secs Computing kpt #: 101 total cpu time spent up to now is 548.6 secs Computing kpt #: 102 total cpu time spent up to now is 553.1 secs Computing kpt #: 103 total cpu time spent up to now is 557.7 secs Computing kpt #: 104 total cpu time spent up to now is 562.0 secs Computing kpt #: 105 total cpu time spent up to now is 566.7 secs Computing kpt #: 106 total cpu time spent up to now is 571.1 secs Computing kpt #: 107 total cpu time spent up to now is 575.3 secs Computing kpt #: 108 total cpu time spent up to now is 579.8 secs Computing kpt #: 109 total cpu time spent up to now is 584.0 secs Computing kpt #: 110 total cpu time spent up to now is 588.4 secs Computing kpt #: 111 total cpu time spent up to now is 592.7 secs Computing kpt #: 112 total cpu time spent up to now is 597.1 secs Computing kpt #: 113 total cpu time spent up to now is 601.5 secs Computing kpt #: 114 total cpu time spent up to now is 605.8 secs Computing kpt #: 115 total cpu time spent up to now is 610.2 secs Computing kpt #: 116 total cpu time spent up to now is 614.5 secs Computing kpt #: 117 total cpu time spent up to now is 619.0 secs Computing kpt #: 118 total cpu time spent up to now is 623.3 secs Computing kpt #: 119 total cpu time spent up to now is 627.6 secs Computing kpt #: 120 total cpu time spent up to now is 632.2 secs Computing kpt #: 121 total cpu time spent up to now is 636.4 secs Computing kpt #: 122 total cpu time spent up to now is 640.7 secs Computing kpt #: 123 total cpu time spent up to now is 644.8 secs Computing kpt #: 124 total cpu time spent up to now is 649.2 secs Computing kpt #: 125 total cpu time spent up to now is 653.5 secs Computing kpt #: 126 total cpu time spent up to now is 658.7 secs Computing kpt #: 127 total cpu time spent up to now is 662.9 secs Computing kpt #: 128 total cpu time spent up to now is 667.2 secs Computing kpt #: 129 total cpu time spent up to now is 671.7 secs Computing kpt #: 130 total cpu time spent up to now is 676.1 secs Computing kpt #: 131 total cpu time spent up to now is 680.6 secs Computing kpt #: 132 total cpu time spent up to now is 685.0 secs Computing kpt #: 133 total cpu time spent up to now is 689.5 secs Computing kpt #: 134 total cpu time spent up to now is 694.1 secs Computing kpt #: 135 total cpu time spent up to now is 698.5 secs Computing kpt #: 136 total cpu time spent up to now is 703.5 secs Computing kpt #: 137 total cpu time spent up to now is 708.0 secs Computing kpt #: 138 total cpu time spent up to now is 712.7 secs Computing kpt #: 139 total cpu time spent up to now is 717.3 secs Computing kpt #: 140 total cpu time spent up to now is 722.1 secs Computing kpt #: 141 total cpu time spent up to now is 726.7 secs Computing kpt #: 142 total cpu time spent up to now is 731.2 secs Computing kpt #: 143 total cpu time spent up to now is 735.2 secs Computing kpt #: 144 total cpu time spent up to now is 739.5 secs Computing kpt #: 145 total cpu time spent up to now is 744.0 secs Computing kpt #: 146 total cpu time spent up to now is 748.6 secs Computing kpt #: 147 total cpu time spent up to now is 753.0 secs Computing kpt #: 148 total cpu time spent up to now is 757.4 secs Computing kpt #: 149 total cpu time spent up to now is 761.7 secs Computing kpt #: 150 total cpu time spent up to now is 766.0 secs Computing kpt #: 151 total cpu time spent up to now is 770.2 secs Computing kpt #: 152 total cpu time spent up to now is 774.6 secs Computing kpt #: 153 total cpu time spent up to now is 780.1 secs Computing kpt #: 154 total cpu time spent up to now is 784.3 secs Computing kpt #: 155 total cpu time spent up to now is 788.5 secs Computing kpt #: 156 total cpu time spent up to now is 792.7 secs Computing kpt #: 157 total cpu time spent up to now is 796.9 secs Computing kpt #: 158 total cpu time spent up to now is 801.1 secs Computing kpt #: 159 total cpu time spent up to now is 805.2 secs Computing kpt #: 160 total cpu time spent up to now is 809.4 secs Computing kpt #: 161 total cpu time spent up to now is 813.5 secs Computing kpt #: 162 total cpu time spent up to now is 817.7 secs Computing kpt #: 163 total cpu time spent up to now is 821.9 secs Computing kpt #: 164 total cpu time spent up to now is 826.1 secs Computing kpt #: 165 total cpu time spent up to now is 830.4 secs Computing kpt #: 166 total cpu time spent up to now is 834.6 secs Computing kpt #: 167 total cpu time spent up to now is 841.6 secs Computing kpt #: 168 total cpu time spent up to now is 846.1 secs Computing kpt #: 169 total cpu time spent up to now is 850.6 secs Computing kpt #: 170 total cpu time spent up to now is 855.3 secs Computing kpt #: 171 total cpu time spent up to now is 860.8 secs Computing kpt #: 172 total cpu time spent up to now is 867.1 secs Computing kpt #: 173 total cpu time spent up to now is 872.6 secs Computing kpt #: 174 total cpu time spent up to now is 879.5 secs Computing kpt #: 175 total cpu time spent up to now is 886.3 secs Computing kpt #: 176 total cpu time spent up to now is 893.0 secs Computing kpt #: 177 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 902.2 secs Computing kpt #: 178 total cpu time spent up to now is 909.4 secs Computing kpt #: 179 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 918.8 secs Computing kpt #: 180 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 929.2 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 938.1 secs Computing kpt #: 182 total cpu time spent up to now is 942.4 secs Computing kpt #: 183 total cpu time spent up to now is 947.0 secs Computing kpt #: 184 total cpu time spent up to now is 952.3 secs Computing kpt #: 185 total cpu time spent up to now is 957.0 secs Computing kpt #: 186 total cpu time spent up to now is 961.7 secs Computing kpt #: 187 total cpu time spent up to now is 968.3 secs Computing kpt #: 188 total cpu time spent up to now is 973.7 secs Computing kpt #: 189 total cpu time spent up to now is 978.4 secs Computing kpt #: 190 total cpu time spent up to now is 983.0 secs Computing kpt #: 191 total cpu time spent up to now is 987.7 secs Computing kpt #: 192 total cpu time spent up to now is 992.3 secs Computing kpt #: 193 total cpu time spent up to now is 996.8 secs Computing kpt #: 194 total cpu time spent up to now is 1001.2 secs Computing kpt #: 195 total cpu time spent up to now is 1005.5 secs Computing kpt #: 196 total cpu time spent up to now is 1009.9 secs Computing kpt #: 197 total cpu time spent up to now is 1014.4 secs Computing kpt #: 198 total cpu time spent up to now is 1020.9 secs Computing kpt #: 199 total cpu time spent up to now is 1025.2 secs Computing kpt #: 200 total cpu time spent up to now is 1029.5 secs Computing kpt #: 201 total cpu time spent up to now is 1033.8 secs Computing kpt #: 202 total cpu time spent up to now is 1038.2 secs Computing kpt #: 203 total cpu time spent up to now is 1042.3 secs ethr = 1.79E-11, avg # of iterations = 36.6 total cpu time spent up to now is 1042.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8023 -9.8023 -8.0047 -8.0047 -7.9754 -7.9754 -7.9754 -7.9754 -4.2060 -4.2060 -0.6673 -0.6673 -0.5149 -0.5149 -0.5149 -0.5149 1.7859 1.7859 1.9276 1.9276 1.9276 1.9276 2.9070 2.9070 2.9268 2.9268 2.9268 2.9268 3.3003 3.3003 3.3003 3.3003 5.2016 5.2016 7.3085 7.3085 8.0779 8.0779 8.0779 8.0779 8.1263 8.1263 8.5585 8.5585 k = 0.0119-0.0084 0.0146 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5670 -19.5670 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8018 -9.8018 -8.0050 -8.0050 -7.9758 -7.9758 -7.9757 -7.9757 -4.2061 -4.2061 -0.6660 -0.6660 -0.5140 -0.5140 -0.5132 -0.5132 1.7861 1.7861 1.9232 1.9232 1.9321 1.9321 2.8959 2.8959 2.9263 2.9263 2.9366 2.9366 3.2962 3.2962 3.2999 3.2999 5.2074 5.2074 7.3069 7.3069 8.0692 8.0692 8.0812 8.0812 8.1289 8.1289 8.5513 8.5513 k = 0.0238-0.0168 0.0292 ( 13155 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5553 -19.5553 -19.5553 -19.5553 -19.5464 -19.5464 -19.5464 -19.5464 -19.5428 -19.5428 -9.8003 -9.8003 -8.0061 -8.0061 -7.9769 -7.9769 -7.9767 -7.9767 -4.2064 -4.2064 -0.6623 -0.6623 -0.5108 -0.5108 -0.5090 -0.5090 1.7860 1.7860 1.9177 1.9177 1.9384 1.9384 2.8734 2.8734 2.9310 2.9310 2.9486 2.9486 3.2851 3.2851 3.2979 3.2979 5.2244 5.2244 7.3022 7.3022 8.0482 8.0482 8.0905 8.0905 8.1320 8.1320 8.5368 8.5368 k = 0.0357-0.0253 0.0437 ( 13167 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5554 -19.5554 -19.5552 -19.5552 -19.5465 -19.5465 -19.5464 -19.5464 -19.5428 -19.5428 -9.7978 -9.7978 -8.0078 -8.0078 -7.9787 -7.9787 -7.9782 -7.9782 -4.2070 -4.2070 -0.6562 -0.6562 -0.5054 -0.5054 -0.5020 -0.5020 1.7844 1.7844 1.9117 1.9117 1.9476 1.9476 2.8437 2.8437 2.9369 2.9369 2.9617 2.9617 3.2681 3.2681 3.2947 3.2947 5.2514 5.2514 7.2947 7.2947 8.0202 8.0202 8.1059 8.1059 8.1311 8.1311 8.5148 8.5148 k = 0.0476-0.0337 0.0583 ( 13179 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7342 -19.7264 -19.7264 -19.5671 -19.5671 -19.5554 -19.5554 -19.5552 -19.5552 -19.5466 -19.5466 -19.5464 -19.5464 -19.5428 -19.5428 -9.7944 -9.7944 -8.0101 -8.0101 -7.9813 -7.9813 -7.9804 -7.9804 -4.2077 -4.2077 -0.6477 -0.6477 -0.4978 -0.4978 -0.4923 -0.4923 1.7789 1.7789 1.9079 1.9079 1.9599 1.9599 2.8067 2.8067 2.9414 2.9414 2.9779 2.9779 3.2468 3.2468 3.2902 3.2902 5.2868 5.2868 7.2853 7.2853 7.9878 7.9878 8.1210 8.1210 8.1307 8.1307 8.4854 8.4854 k = 0.0595-0.0421 0.0729 ( 13175 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7341 -19.7341 -19.7265 -19.7265 -19.5670 -19.5670 -19.5555 -19.5555 -19.5551 -19.5551 -19.5466 -19.5466 -19.5464 -19.5464 -19.5428 -19.5428 -9.7899 -9.7899 -8.0132 -8.0132 -7.9845 -7.9845 -7.9832 -7.9832 -4.2087 -4.2087 -0.6368 -0.6368 -0.4879 -0.4879 -0.4799 -0.4799 1.7668 1.7668 1.9090 1.9090 1.9754 1.9754 2.7618 2.7618 2.9434 2.9434 2.9979 2.9979 3.2231 3.2231 3.2844 3.2844 5.3285 5.3285 7.2747 7.2747 7.9522 7.9522 8.1101 8.1101 8.1565 8.1565 8.4491 8.4491 k = 0.0714-0.0505 0.0875 ( 13175 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7340 -19.7340 -19.7265 -19.7265 -19.5669 -19.5669 -19.5556 -19.5556 -19.5550 -19.5550 -19.5468 -19.5468 -19.5463 -19.5463 -19.5428 -19.5428 -9.7845 -9.7845 -8.0169 -8.0169 -7.9884 -7.9884 -7.9865 -7.9865 -4.2098 -4.2098 -0.6235 -0.6235 -0.4760 -0.4760 -0.4648 -0.4648 1.7473 1.7473 1.9166 1.9166 1.9942 1.9942 2.7089 2.7089 2.9428 2.9428 3.0213 3.0213 3.1985 3.1985 3.2774 3.2774 5.3743 5.3743 7.2642 7.2642 7.9141 7.9141 8.0919 8.0919 8.1899 8.1899 8.4068 8.4068 k = 0.0833-0.0589 0.1021 ( 13175 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7339 -19.7339 -19.7266 -19.7266 -19.5668 -19.5668 -19.5557 -19.5557 -19.5549 -19.5549 -19.5468 -19.5468 -19.5463 -19.5463 -19.5429 -19.5429 -9.7782 -9.7782 -8.0212 -8.0212 -7.9930 -7.9930 -7.9904 -7.9904 -4.2110 -4.2110 -0.6080 -0.6080 -0.4619 -0.4619 -0.4470 -0.4470 1.7211 1.7211 1.9304 1.9304 2.0160 2.0160 2.6484 2.6484 2.9397 2.9397 3.0475 3.0475 3.1739 3.1739 3.2692 3.2692 5.4218 5.4218 7.2552 7.2552 7.8741 7.8741 8.0687 8.0687 8.2286 8.2286 8.3599 8.3599 k = 0.0952-0.0673 0.1166 ( 13179 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6907 -47.6907 -19.7343 -19.7343 -19.7339 -19.7339 -19.7267 -19.7267 -19.5667 -19.5667 -19.5559 -19.5559 -19.5549 -19.5549 -19.5469 -19.5469 -19.5463 -19.5463 -19.5429 -19.5429 -9.7709 -9.7709 -8.0261 -8.0261 -7.9981 -7.9981 -7.9949 -7.9949 -4.2123 -4.2123 -0.5903 -0.5903 -0.4456 -0.4456 -0.4267 -0.4267 1.6898 1.6898 1.9493 1.9493 2.0407 2.0407 2.5811 2.5811 2.9344 2.9344 3.0757 3.0757 3.1499 3.1499 3.2598 3.2598 5.4691 5.4691 7.2491 7.2491 7.8323 7.8323 8.0410 8.0410 8.2674 8.2674 8.3139 8.3139 k = 0.1071-0.0758 0.1312 ( 13159 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6907 -47.6907 -19.7344 -19.7344 -19.7337 -19.7337 -19.7268 -19.7268 -19.5665 -19.5665 -19.5560 -19.5560 -19.5547 -19.5547 -19.5470 -19.5470 -19.5462 -19.5462 -19.5429 -19.5429 -9.7628 -9.7628 -8.0317 -8.0317 -8.0039 -8.0039 -7.9999 -7.9999 -4.2137 -4.2137 -0.5704 -0.5704 -0.4273 -0.4273 -0.4037 -0.4037 1.6548 1.6548 1.9721 1.9721 2.0682 2.0682 2.5081 2.5081 2.9269 2.9269 3.1053 3.1053 3.1264 3.1264 3.2494 3.2494 5.5140 5.5140 7.2472 7.2472 7.7893 7.7893 8.0094 8.0094 8.2442 8.2442 8.3303 8.3303 k = 0.1190-0.0842 0.1458 ( 13163 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6907 -47.6907 -19.7344 -19.7344 -19.7336 -19.7336 -19.7269 -19.7269 -19.5664 -19.5664 -19.5562 -19.5562 -19.5546 -19.5546 -19.5472 -19.5472 -19.5462 -19.5462 -19.5430 -19.5430 -9.7538 -9.7538 -8.0377 -8.0377 -8.0102 -8.0102 -8.0053 -8.0053 -4.2151 -4.2151 -0.5485 -0.5485 -0.4070 -0.4070 -0.3783 -0.3783 1.6171 1.6171 1.9981 1.9981 2.0982 2.0982 2.4307 2.4307 2.9174 2.9175 3.1031 3.1031 3.1359 3.1359 3.2380 3.2380 5.5550 5.5550 7.2508 7.2508 7.7452 7.7452 7.9746 7.9746 8.1874 8.1874 8.3766 8.3766 k = 0.1310-0.0926 0.1604 ( 13167 PWs) bands (ev): -47.6916 -47.6916 -47.6909 -47.6909 -47.6907 -47.6907 -19.7344 -19.7344 -19.7335 -19.7335 -19.7269 -19.7269 -19.5663 -19.5663 -19.5564 -19.5564 -19.5545 -19.5545 -19.5473 -19.5473 -19.5461 -19.5461 -19.5430 -19.5430 -9.7440 -9.7440 -8.0443 -8.0443 -8.0170 -8.0170 -8.0113 -8.0113 -4.2165 -4.2165 -0.5245 -0.5245 -0.3846 -0.3846 -0.3505 -0.3505 1.5775 1.5775 2.0265 2.0265 2.1304 2.1304 2.3503 2.3503 2.9059 2.9059 3.0802 3.0802 3.1666 3.1666 3.2260 3.2260 5.5907 5.5907 7.2604 7.2604 7.7007 7.7007 7.9369 7.9369 8.1266 8.1266 8.3983 8.3983 k = 0.1429-0.1010 0.1750 ( 13203 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6907 -47.6907 -19.7345 -19.7345 -19.7334 -19.7334 -19.7271 -19.7271 -19.5662 -19.5662 -19.5566 -19.5566 -19.5544 -19.5544 -19.5475 -19.5475 -19.5461 -19.5461 -19.5431 -19.5431 -9.7335 -9.7335 -8.0514 -8.0514 -8.0243 -8.0243 -8.0177 -8.0177 -4.2179 -4.2179 -0.4985 -0.4985 -0.3602 -0.3602 -0.3204 -0.3204 1.5366 1.5366 2.0560 2.0560 2.1643 2.1643 2.2684 2.2684 2.8921 2.8921 3.0573 3.0573 3.1947 3.1947 3.2161 3.2161 5.6202 5.6202 7.2760 7.2760 7.6569 7.6569 7.8970 7.8970 8.0639 8.0639 8.3920 8.3920 k = 0.1548-0.1094 0.1895 ( 13203 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6907 -47.6907 -19.7346 -19.7346 -19.7333 -19.7333 -19.7271 -19.7271 -19.5661 -19.5661 -19.5568 -19.5568 -19.5543 -19.5543 -19.5476 -19.5476 -19.5460 -19.5460 -19.5432 -19.5432 -9.7222 -9.7222 -8.0589 -8.0589 -8.0320 -8.0320 -8.0245 -8.0245 -4.2192 -4.2192 -0.4707 -0.4707 -0.3339 -0.3339 -0.2881 -0.2881 1.4950 1.4950 2.0833 2.0833 2.1863 2.1863 2.2022 2.2022 2.8761 2.8761 3.0347 3.0347 3.1955 3.1955 3.2330 3.2330 5.6430 5.6430 7.2960 7.2960 7.6155 7.6155 7.8555 7.8555 8.0001 8.0001 8.3816 8.3816 k = 0.1667-0.1179 0.2041 ( 13187 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6907 -47.6907 -19.7346 -19.7346 -19.7331 -19.7331 -19.7272 -19.7272 -19.5659 -19.5659 -19.5570 -19.5570 -19.5541 -19.5541 -19.5477 -19.5477 -19.5459 -19.5459 -19.5432 -19.5432 -9.7103 -9.7103 -8.0668 -8.0668 -8.0401 -8.0401 -8.0317 -8.0317 -4.2204 -4.2204 -0.4411 -0.4411 -0.3057 -0.3057 -0.2537 -0.2537 1.4528 1.4528 2.0750 2.0750 2.1440 2.1440 2.2370 2.2370 2.8574 2.8574 3.0127 3.0127 3.1829 3.1829 3.2628 3.2628 5.6589 5.6589 7.3167 7.3167 7.5799 7.5799 7.8138 7.8138 7.9360 7.9360 8.3726 8.3726 k = 0.1786-0.1263 0.2187 ( 13179 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6907 -47.6907 -19.7346 -19.7346 -19.7329 -19.7329 -19.7273 -19.7273 -19.5657 -19.5657 -19.5572 -19.5572 -19.5539 -19.5539 -19.5479 -19.5479 -19.5459 -19.5459 -19.5432 -19.5432 -9.6977 -9.6977 -8.0750 -8.0750 -8.0485 -8.0485 -8.0393 -8.0393 -4.2215 -4.2215 -0.4097 -0.4097 -0.2756 -0.2756 -0.2173 -0.2173 1.4106 1.4106 2.0016 2.0016 2.1650 2.1650 2.2737 2.2737 2.8358 2.8358 2.9920 2.9920 3.1697 3.1697 3.2930 3.2930 5.6681 5.6681 7.3309 7.3309 7.5558 7.5558 7.7739 7.7739 7.8721 7.8721 8.3662 8.3662 k = 0.1905-0.1347 0.2333 ( 13175 PWs) bands (ev): -47.6915 -47.6915 -47.6910 -47.6910 -47.6907 -47.6907 -19.7346 -19.7346 -19.7328 -19.7328 -19.7275 -19.7275 -19.5656 -19.5656 -19.5575 -19.5575 -19.5537 -19.5537 -19.5480 -19.5480 -19.5458 -19.5458 -19.5433 -19.5433 -9.6845 -9.6845 -8.0836 -8.0836 -8.0571 -8.0571 -8.0472 -8.0472 -4.2224 -4.2224 -0.3766 -0.3766 -0.2437 -0.2437 -0.1791 -0.1791 1.3686 1.3686 1.9191 1.9191 2.1946 2.1946 2.3100 2.3100 2.8110 2.8110 2.9735 2.9735 3.1571 3.1571 3.3228 3.3228 5.6709 5.6709 7.3294 7.3294 7.5476 7.5476 7.7404 7.7404 7.8094 7.8094 8.3631 8.3631 k = 0.2024-0.1431 0.2479 ( 13195 PWs) bands (ev): -47.6915 -47.6915 -47.6910 -47.6910 -47.6907 -47.6907 -19.7347 -19.7347 -19.7327 -19.7327 -19.7276 -19.7276 -19.5654 -19.5654 -19.5577 -19.5577 -19.5536 -19.5536 -19.5482 -19.5482 -19.5457 -19.5457 -19.5433 -19.5433 -9.6708 -9.6708 -8.0924 -8.0924 -8.0660 -8.0660 -8.0554 -8.0554 -4.2231 -4.2231 -0.3419 -0.3419 -0.2100 -0.2100 -0.1393 -0.1393 1.3269 1.3269 1.8364 1.8364 2.2233 2.2233 2.3449 2.3449 2.7825 2.7825 2.9586 2.9586 3.1462 3.1462 3.3518 3.3518 5.6679 5.6679 7.3101 7.3101 7.5473 7.5473 7.7195 7.7195 7.7525 7.7525 8.3634 8.3634 k = 0.2143-0.1515 0.2624 ( 13207 PWs) bands (ev): -47.6915 -47.6915 -47.6910 -47.6910 -47.6907 -47.6907 -19.7348 -19.7348 -19.7325 -19.7325 -19.7278 -19.7278 -19.5653 -19.5653 -19.5580 -19.5580 -19.5534 -19.5534 -19.5484 -19.5484 -19.5457 -19.5457 -19.5434 -19.5434 -9.6567 -9.6567 -8.1013 -8.1013 -8.0750 -8.0750 -8.0639 -8.0639 -4.2237 -4.2237 -0.3057 -0.3057 -0.1746 -0.1746 -0.0980 -0.0980 1.2859 1.2859 1.7548 1.7548 2.2488 2.2488 2.3772 2.3772 2.7506 2.7506 2.9483 2.9483 3.1377 3.1377 3.3801 3.3801 5.6594 5.6594 7.2793 7.2793 7.5355 7.5355 7.6790 7.6790 7.7472 7.7472 8.3675 8.3675 k = 0.2262-0.1599 0.2770 ( 13191 PWs) bands (ev): -47.6915 -47.6915 -47.6910 -47.6910 -47.6907 -47.6907 -19.7348 -19.7348 -19.7323 -19.7323 -19.7279 -19.7279 -19.5651 -19.5651 -19.5583 -19.5583 -19.5531 -19.5531 -19.5486 -19.5486 -19.5456 -19.5456 -19.5434 -19.5434 -9.6422 -9.6422 -8.1105 -8.1105 -8.0842 -8.0842 -8.0726 -8.0726 -4.2240 -4.2240 -0.2681 -0.2681 -0.1376 -0.1376 -0.0554 -0.0554 1.2456 1.2456 1.6750 1.6750 2.2693 2.2693 2.4056 2.4056 2.7153 2.7153 2.9438 2.9438 3.1329 3.1329 3.4074 3.4074 5.6458 5.6458 7.2434 7.2434 7.5076 7.5076 7.6217 7.6217 7.7896 7.7896 8.3756 8.3756 k = 0.2381-0.1684 0.2916 ( 13226 PWs) bands (ev): -47.6915 -47.6915 -47.6911 -47.6911 -47.6907 -47.6907 -19.7349 -19.7349 -19.7321 -19.7321 -19.7281 -19.7281 -19.5650 -19.5650 -19.5586 -19.5586 -19.5529 -19.5529 -19.5488 -19.5488 -19.5455 -19.5455 -19.5435 -19.5435 -9.6274 -9.6274 -8.1197 -8.1197 -8.0934 -8.0934 -8.0815 -8.0815 -4.2242 -4.2242 -0.2291 -0.2291 -0.0990 -0.0990 -0.0116 -0.0116 1.2063 1.2063 1.5974 1.5974 2.2833 2.2833 2.4286 2.4286 2.6773 2.6773 2.9461 2.9461 3.1330 3.1330 3.4337 3.4337 5.6275 5.6275 7.2062 7.2062 7.4711 7.4711 7.5652 7.5652 7.8514 7.8514 8.3880 8.3880 k = 0.2500-0.1768 0.3062 ( 13226 PWs) bands (ev): -47.6914 -47.6914 -47.6911 -47.6911 -47.6907 -47.6907 -19.7350 -19.7350 -19.7320 -19.7320 -19.7282 -19.7282 -19.5648 -19.5648 -19.5590 -19.5590 -19.5527 -19.5527 -19.5490 -19.5490 -19.5454 -19.5454 -19.5435 -19.5435 -9.6123 -9.6123 -8.1289 -8.1289 -8.1026 -8.1026 -8.0905 -8.0905 -4.2241 -4.2241 -0.1889 -0.1889 -0.0590 -0.0590 0.0331 0.0331 1.1681 1.1681 1.5224 1.5224 2.2893 2.2893 2.4449 2.4449 2.6371 2.6371 2.9558 2.9558 3.1391 3.1391 3.4590 3.4590 5.6048 5.6048 7.1697 7.1697 7.4319 7.4319 7.5108 7.5108 7.9237 7.9237 8.4050 8.4050 k = 0.2619-0.1852 0.3208 ( 13242 PWs) bands (ev): -47.6914 -47.6914 -47.6911 -47.6911 -47.6907 -47.6907 -19.7351 -19.7351 -19.7318 -19.7318 -19.7283 -19.7283 -19.5647 -19.5647 -19.5593 -19.5593 -19.5525 -19.5525 -19.5491 -19.5491 -19.5453 -19.5453 -19.5435 -19.5435 -9.5971 -9.5971 -8.1381 -8.1381 -8.1118 -8.1118 -8.0997 -8.0997 -4.2239 -4.2239 -0.1476 -0.1476 -0.0175 -0.0175 0.0785 0.0785 1.1311 1.1311 1.4502 1.4502 2.2868 2.2868 2.4534 2.4534 2.5954 2.5954 2.9731 2.9731 3.1519 3.1519 3.4833 3.4833 5.5777 5.5777 7.1347 7.1347 7.3924 7.3924 7.4593 7.4593 8.0028 8.0028 8.4268 8.4268 k = 0.2738-0.1936 0.3353 ( 13238 PWs) bands (ev): -47.6914 -47.6914 -47.6911 -47.6911 -47.6906 -47.6906 -19.7351 -19.7351 -19.7317 -19.7317 -19.7285 -19.7285 -19.5646 -19.5646 -19.5595 -19.5595 -19.5523 -19.5523 -19.5493 -19.5493 -19.5452 -19.5452 -19.5435 -19.5435 -9.5818 -9.5818 -8.1473 -8.1473 -8.1209 -8.1209 -8.1088 -8.1088 -4.2235 -4.2235 -0.1053 -0.1053 0.0252 0.0252 0.1244 0.1244 1.0954 1.0954 1.3810 1.3810 2.2756 2.2756 2.4537 2.4537 2.5529 2.5529 2.9975 2.9975 3.1719 3.1719 3.5065 3.5065 5.5467 5.5467 7.1020 7.1020 7.3542 7.3542 7.4108 7.4108 8.0867 8.0867 8.4536 8.4536 k = 0.2857-0.2020 0.3499 ( 13226 PWs) bands (ev): -47.6914 -47.6914 -47.6911 -47.6911 -47.6906 -47.6906 -19.7351 -19.7351 -19.7315 -19.7315 -19.7286 -19.7286 -19.5644 -19.5644 -19.5598 -19.5598 -19.5520 -19.5520 -19.5495 -19.5495 -19.5451 -19.5451 -19.5436 -19.5436 -9.5664 -9.5664 -8.1563 -8.1563 -8.1298 -8.1298 -8.1180 -8.1180 -4.2229 -4.2229 -0.0622 -0.0622 0.0692 0.0692 0.1706 0.1706 1.0612 1.0612 1.3151 1.3151 2.2563 2.2563 2.4457 2.4457 2.5100 2.5100 3.0282 3.0282 3.1985 3.1986 3.5287 3.5287 5.5121 5.5121 7.0718 7.0718 7.3177 7.3177 7.3659 7.3659 8.1744 8.1744 8.4856 8.4856 k = 0.2976-0.2104 0.3645 ( 13214 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7352 -19.7352 -19.7313 -19.7313 -19.7287 -19.7287 -19.5643 -19.5643 -19.5601 -19.5601 -19.5518 -19.5518 -19.5496 -19.5496 -19.5450 -19.5450 -19.5436 -19.5436 -9.5512 -9.5512 -8.1652 -8.1652 -8.1385 -8.1385 -8.1272 -8.1272 -4.2222 -4.2222 -0.0184 -0.0184 0.1142 0.1142 0.2167 0.2167 1.0285 1.0285 1.2527 1.2527 2.2299 2.2299 2.4299 2.4299 2.4673 2.4673 3.0638 3.0638 3.2312 3.2312 3.5499 3.5499 5.4741 5.4741 7.0441 7.0441 7.2835 7.2835 7.3248 7.3248 8.2653 8.2653 8.5227 8.5227 k = 0.3095-0.2189 0.3791 ( 13230 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7353 -19.7353 -19.7312 -19.7312 -19.7288 -19.7288 -19.5642 -19.5642 -19.5604 -19.5604 -19.5516 -19.5516 -19.5498 -19.5498 -19.5449 -19.5449 -19.5436 -19.5436 -9.5362 -9.5362 -8.1739 -8.1738 -8.1470 -8.1470 -8.1362 -8.1362 -4.2213 -4.2213 0.0259 0.0259 0.1601 0.1601 0.2626 0.2626 0.9975 0.9975 1.1939 1.1939 2.1977 2.1977 2.4064 2.4064 2.4259 2.4259 3.1031 3.1031 3.2686 3.2686 3.5702 3.5702 5.4334 5.4334 7.0190 7.0190 7.2516 7.2516 7.2877 7.2877 8.3590 8.3590 8.5649 8.5649 k = 0.3214-0.2273 0.3937 ( 13242 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7354 -19.7354 -19.7311 -19.7311 -19.7290 -19.7290 -19.5641 -19.5641 -19.5607 -19.5607 -19.5514 -19.5514 -19.5499 -19.5499 -19.5448 -19.5448 -19.5436 -19.5436 -9.5214 -9.5214 -8.1823 -8.1823 -8.1553 -8.1553 -8.1450 -8.1450 -4.2204 -4.2204 0.0705 0.0705 0.2067 0.2067 0.3080 0.3080 0.9682 0.9682 1.1388 1.1388 2.1609 2.1609 2.3735 2.3735 2.3886 2.3886 3.1448 3.1448 3.3096 3.3096 3.5894 3.5894 5.3905 5.3905 6.9963 6.9963 7.2220 7.2220 7.2548 7.2548 8.4556 8.4556 8.6120 8.6120 k = 0.3333-0.2357 0.4082 ( 13222 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7354 -19.7354 -19.7309 -19.7309 -19.7291 -19.7291 -19.5639 -19.5639 -19.5610 -19.5610 -19.5511 -19.5511 -19.5500 -19.5500 -19.5447 -19.5447 -19.5436 -19.5436 -9.5069 -9.5069 -8.1904 -8.1904 -8.1632 -8.1632 -8.1537 -8.1537 -4.2193 -4.2193 0.1152 0.1152 0.2539 0.2539 0.3525 0.3525 0.9409 0.9409 1.0876 1.0876 2.1209 2.1209 2.3336 2.3336 2.3543 2.3543 3.1878 3.1878 3.3529 3.3529 3.6078 3.6078 5.3459 5.3459 6.9760 6.9760 7.1948 7.1948 7.2261 7.2261 8.5550 8.5550 8.6636 8.6636 k = 0.3452-0.2441 0.4228 ( 13230 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7355 -19.7355 -19.7307 -19.7307 -19.7291 -19.7291 -19.5638 -19.5638 -19.5613 -19.5613 -19.5510 -19.5510 -19.5501 -19.5501 -19.5446 -19.5446 -19.5437 -19.5437 -9.4929 -9.4929 -8.1982 -8.1982 -8.1707 -8.1707 -8.1620 -8.1620 -4.2182 -4.2182 0.1596 0.1596 0.3013 0.3013 0.3957 0.3957 0.9155 0.9155 1.0405 1.0405 2.0788 2.0788 2.2921 2.2921 2.3187 2.3187 3.2309 3.2309 3.3974 3.3974 3.6254 3.6254 5.3003 5.3003 6.9580 6.9580 7.1702 7.1702 7.2013 7.2013 8.6572 8.6572 8.7192 8.7192 k = 0.3571-0.2525 0.4374 ( 13222 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7356 -19.7356 -19.7306 -19.7306 -19.7292 -19.7292 -19.5637 -19.5637 -19.5616 -19.5616 -19.5507 -19.5507 -19.5503 -19.5503 -19.5445 -19.5445 -19.5437 -19.5437 -9.4795 -9.4795 -8.2056 -8.2056 -8.1778 -8.1778 -8.1701 -8.1701 -4.2170 -4.2170 0.2035 0.2035 0.3487 0.3487 0.4374 0.4374 0.8921 0.8921 0.9975 0.9975 2.0355 2.0355 2.2505 2.2505 2.2812 2.2812 3.2734 3.2734 3.4421 3.4421 3.6422 3.6422 5.2545 5.2545 6.9421 6.9421 7.1485 7.1485 7.1801 7.1801 8.7614 8.7614 8.7790 8.7790 k = 0.3690-0.2610 0.4520 ( 13226 PWs) bands (ev): -47.6914 -47.6914 -47.6913 -47.6913 -47.6906 -47.6906 -19.7356 -19.7356 -19.7305 -19.7305 -19.7293 -19.7293 -19.5636 -19.5636 -19.5618 -19.5618 -19.5506 -19.5506 -19.5504 -19.5504 -19.5444 -19.5444 -19.5437 -19.5437 -9.4667 -9.4667 -8.2126 -8.2126 -8.1845 -8.1845 -8.1777 -8.1777 -4.2159 -4.2159 0.2465 0.2465 0.3957 0.3957 0.4771 0.4771 0.8711 0.8711 0.9589 0.9589 1.9919 1.9919 2.2096 2.2096 2.2423 2.2423 3.3144 3.3144 3.4863 3.4863 3.6583 3.6583 5.2092 5.2092 6.9284 6.9284 7.1297 7.1297 7.1618 7.1618 8.8376 8.8376 8.8726 8.8726 k = 0.3810-0.2694 0.4666 ( 13218 PWs) bands (ev): -47.6914 -47.6914 -47.6913 -47.6913 -47.6905 -47.6905 -19.7357 -19.7357 -19.7304 -19.7304 -19.7294 -19.7294 -19.5636 -19.5636 -19.5620 -19.5620 -19.5505 -19.5505 -19.5504 -19.5504 -19.5443 -19.5443 -19.5437 -19.5437 -9.4546 -9.4546 -8.2191 -8.2191 -8.1907 -8.1907 -8.1849 -8.1849 -4.2147 -4.2147 0.2882 0.2882 0.4416 0.4416 0.5144 0.5144 0.8524 0.8524 0.9248 0.9248 1.9485 1.9485 2.1697 2.1697 2.2027 2.2027 3.3531 3.3531 3.5290 3.5290 3.6738 3.6738 5.1650 5.1650 6.9168 6.9168 7.1141 7.1141 7.1461 7.1461 8.9005 8.9005 8.9840 8.9840 k = 0.3929-0.2778 0.4811 ( 13206 PWs) bands (ev): -47.6914 -47.6914 -47.6913 -47.6913 -47.6905 -47.6905 -19.7357 -19.7357 -19.7302 -19.7302 -19.7295 -19.7295 -19.5635 -19.5635 -19.5622 -19.5622 -19.5506 -19.5506 -19.5502 -19.5502 -19.5442 -19.5442 -19.5437 -19.5437 -9.4433 -9.4433 -8.2252 -8.2252 -8.1965 -8.1965 -8.1916 -8.1916 -4.2136 -4.2136 0.3282 0.3282 0.4859 0.4859 0.5487 0.5487 0.8363 0.8363 0.8957 0.8957 1.9060 1.9060 2.1314 2.1314 2.1631 2.1631 3.3890 3.3890 3.5696 3.5696 3.6886 3.6886 5.1226 5.1226 6.9070 6.9070 7.1014 7.1014 7.1328 7.1328 8.9636 8.9636 9.0989 9.0989 k = 0.4048-0.2862 0.4957 ( 13198 PWs) bands (ev): -47.6914 -47.6914 -47.6913 -47.6913 -47.6905 -47.6905 -19.7358 -19.7358 -19.7301 -19.7301 -19.7295 -19.7295 -19.5634 -19.5634 -19.5624 -19.5624 -19.5506 -19.5506 -19.5501 -19.5501 -19.5441 -19.5441 -19.5437 -19.5437 -9.4330 -9.4330 -8.2307 -8.2307 -8.2017 -8.2017 -8.1977 -8.1977 -4.2125 -4.2125 0.3660 0.3660 0.5275 0.5275 0.5794 0.5794 0.8231 0.8231 0.8720 0.8720 1.8649 1.8649 2.0951 2.0951 2.1244 2.1244 3.4215 3.4215 3.6076 3.6076 3.7028 3.7028 5.0827 5.0827 6.8990 6.8990 7.0915 7.0915 7.1213 7.1213 9.0259 9.0259 9.2164 9.2164 k = 0.4167-0.2946 0.5103 ( 13190 PWs) bands (ev): -47.6914 -47.6914 -47.6913 -47.6913 -47.6905 -47.6905 -19.7358 -19.7358 -19.7301 -19.7301 -19.7296 -19.7296 -19.5633 -19.5633 -19.5625 -19.5625 -19.5507 -19.5507 -19.5499 -19.5499 -19.5440 -19.5440 -19.5437 -19.5437 -9.4237 -9.4237 -8.2357 -8.2357 -8.2063 -8.2063 -8.2032 -8.2032 -4.2115 -4.2115 0.4010 0.4010 0.5651 0.5651 0.6060 0.6060 0.8132 0.8132 0.8542 0.8542 1.8256 1.8256 2.0615 2.0615 2.0873 2.0873 3.4503 3.4503 3.6423 3.6423 3.7163 3.7163 5.0459 5.0459 6.8927 6.8927 7.0842 7.0842 7.1117 7.1117 9.0863 9.0863 9.3344 9.3344 k = 0.4286-0.3030 0.5249 ( 13190 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7359 -19.7359 -19.7300 -19.7300 -19.7296 -19.7296 -19.5633 -19.5633 -19.5627 -19.5627 -19.5508 -19.5508 -19.5498 -19.5498 -19.5439 -19.5439 -19.5437 -19.5437 -9.4154 -9.4154 -8.2401 -8.2401 -8.2104 -8.2104 -8.2080 -8.2080 -4.2106 -4.2106 0.4328 0.4328 0.5971 0.5971 0.6279 0.6279 0.8073 0.8073 0.8427 0.8427 1.7888 1.7888 2.0311 2.0311 2.0526 2.0526 3.4751 3.4751 3.6734 3.6734 3.7288 3.7288 5.0128 5.0128 6.8878 6.8878 7.0792 7.0792 7.1035 7.1035 9.1435 9.1435 9.4155 9.4155 k = 0.4405-0.3115 0.5395 ( 13202 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7360 -19.7360 -19.7299 -19.7299 -19.7297 -19.7297 -19.5633 -19.5633 -19.5628 -19.5628 -19.5508 -19.5508 -19.5497 -19.5497 -19.5439 -19.5439 -19.5437 -19.5437 -9.4082 -9.4082 -8.2439 -8.2439 -8.2139 -8.2139 -8.2122 -8.2122 -4.2098 -4.2098 0.4608 0.4608 0.6217 0.6217 0.6446 0.6446 0.8067 0.8067 0.8372 0.8372 1.7550 1.7550 2.0044 2.0044 2.0212 2.0212 3.4959 3.4959 3.7004 3.7004 3.7402 3.7402 4.9838 4.9838 6.8841 6.8841 7.0760 7.0760 7.0968 7.0968 9.1960 9.1960 9.3995 9.3995 k = 0.4524-0.3199 0.5541 ( 13210 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7360 -19.7360 -19.7299 -19.7299 -19.7297 -19.7297 -19.5633 -19.5633 -19.5630 -19.5630 -19.5509 -19.5509 -19.5497 -19.5497 -19.5438 -19.5438 -19.5437 -19.5437 -9.4023 -9.4023 -8.2471 -8.2471 -8.2167 -8.2167 -8.2156 -8.2156 -4.2092 -4.2092 0.4845 0.4846 0.6386 0.6386 0.6557 0.6557 0.8116 0.8116 0.8364 0.8364 1.7252 1.7252 1.9820 1.9820 1.9939 1.9939 3.5127 3.5127 3.7230 3.7230 3.7501 3.7502 4.9595 4.9595 6.8814 6.8814 7.0744 7.0744 7.0912 7.0912 9.2422 9.2422 9.3775 9.3775 k = 0.4643-0.3283 0.5686 ( 13234 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7298 -19.7298 -19.7297 -19.7297 -19.5633 -19.5633 -19.5631 -19.5631 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5437 -19.5437 -9.3976 -9.3976 -8.2496 -8.2496 -8.2190 -8.2190 -8.2184 -8.2184 -4.2087 -4.2087 0.5035 0.5035 0.6492 0.6492 0.6616 0.6616 0.8206 0.8206 0.8385 0.8385 1.7003 1.7003 1.9642 1.9642 1.9716 1.9716 3.5255 3.5255 3.7410 3.7410 3.7582 3.7582 4.9402 4.9402 6.8796 6.8796 7.0739 7.0739 7.0866 7.0866 9.2805 9.2805 9.3587 9.3587 k = 0.4762-0.3367 0.5832 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5632 -19.5632 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3943 -9.3943 -8.2514 -8.2514 -8.2206 -8.2206 -8.2203 -8.2203 -4.2083 -4.2083 0.5173 0.5173 0.6556 0.6556 0.6637 0.6637 0.8306 0.8306 0.8414 0.8414 1.6814 1.6814 1.9513 1.9513 1.9550 1.9550 3.5345 3.5345 3.7542 3.7542 3.7640 3.7640 4.9262 4.9262 6.8785 6.8785 7.0744 7.0744 7.0829 7.0829 9.3092 9.3092 9.3444 9.3451 k = 0.4881-0.3451 0.5978 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5633 -19.5633 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3922 -9.3922 -8.2524 -8.2524 -8.2216 -8.2216 -8.2215 -8.2215 -4.2080 -4.2080 0.5257 0.5257 0.6595 0.6595 0.6635 0.6635 0.8385 0.8385 0.8434 0.8434 1.6696 1.6696 1.9435 1.9435 1.9448 1.9448 3.5398 3.5398 3.7628 3.7628 3.7671 3.7671 4.9177 4.9177 6.8778 6.8778 7.0756 7.0757 7.0799 7.0799 9.3269 9.3269 9.3356 9.3356 k = 0.5000-0.3536 0.6124 ( 13078 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7295 -19.7295 -19.7295 -19.7295 -19.5631 -19.5631 -19.5631 -19.5631 -19.5507 -19.5507 -19.5493 -19.5493 -19.5436 -19.5436 -19.5436 -19.5436 -9.3915 -9.3915 -8.2528 -8.2528 -8.2219 -8.2219 -8.2219 -8.2219 -4.2080 -4.2080 0.5286 0.5286 0.6620 0.6620 0.6620 0.6620 0.8428 0.8428 0.8428 0.8428 1.6656 1.6656 1.9411 1.9411 1.9411 1.9411 3.5416 3.5416 3.7669 3.7669 3.7669 3.7669 4.9148 4.9148 6.8776 6.8776 7.0775 7.0775 7.0775 7.0775 9.3313 9.3314 9.3342 9.3342 k = 0.5000-0.3536 0.6124 ( 13078 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7295 -19.7295 -19.7295 -19.7295 -19.5631 -19.5631 -19.5631 -19.5631 -19.5507 -19.5507 -19.5493 -19.5493 -19.5436 -19.5436 -19.5436 -19.5436 -9.3915 -9.3915 -8.2528 -8.2528 -8.2219 -8.2219 -8.2219 -8.2219 -4.2080 -4.2080 0.5286 0.5286 0.6620 0.6620 0.6620 0.6620 0.8428 0.8428 0.8428 0.8428 1.6656 1.6656 1.9411 1.9411 1.9411 1.9411 3.5416 3.5416 3.7669 3.7669 3.7669 3.7669 4.9148 4.9148 6.8776 6.8776 7.0775 7.0775 7.0775 7.0775 9.3313 9.3314 9.3342 9.3342 k = 0.4833-0.3418 0.6124 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5633 -19.5633 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3922 -9.3922 -8.2525 -8.2524 -8.2218 -8.2218 -8.2213 -8.2213 -4.2080 -4.2080 0.5257 0.5258 0.6591 0.6606 0.6619 0.6644 0.8382 0.8398 0.8400 0.8459 1.6695 1.6695 1.9423 1.9436 1.9450 1.9454 3.5398 3.5398 3.7617 3.7647 3.7661 3.7674 4.9176 4.9176 6.8777 6.8779 7.0754 7.0766 7.0779 7.0811 9.3297 9.3305 9.3328 9.3335 k = 0.4667-0.3300 0.6124 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5632 -19.5632 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3942 -9.3942 -8.2515 -8.2514 -8.2215 -8.2215 -8.2194 -8.2194 -4.2083 -4.2083 0.5168 0.5176 0.6557 0.6576 0.6595 0.6665 0.8274 0.8311 0.8373 0.8494 1.6805 1.6811 1.9473 1.9497 1.9568 1.9579 3.5346 3.5347 3.7518 3.7598 3.7614 3.7641 4.9259 4.9260 6.8778 6.8790 7.0746 7.0760 7.0774 7.0863 9.3219 9.3235 9.3316 9.3328 k = 0.4500-0.3182 0.6124 ( 13228 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5632 -19.5631 -19.5631 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5437 -9.3975 -9.3975 -8.2500 -8.2499 -8.2209 -8.2209 -8.2163 -8.2162 -4.2086 -4.2086 0.5010 0.5035 0.6507 0.6526 0.6534 0.6682 0.8137 0.8191 0.8359 0.8537 1.6974 1.6989 1.9560 1.9595 1.9760 1.9783 3.5258 3.5260 3.7371 3.7520 3.7523 3.7582 4.9394 4.9397 6.8774 6.8812 7.0751 7.0756 7.0765 7.0933 9.3086 9.3115 9.3299 9.3318 k = 0.4333-0.3064 0.6124 ( 13216 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7360 -19.7360 -19.7299 -19.7298 -19.7298 -19.7297 -19.5632 -19.5632 -19.5631 -19.5630 -19.5509 -19.5509 -19.5497 -19.5497 -19.5438 -19.5438 -19.5437 -19.5437 -9.4019 -9.4019 -8.2484 -8.2482 -8.2200 -8.2199 -8.2119 -8.2116 -4.2091 -4.2091 0.4777 0.4834 0.6378 0.6395 0.6507 0.6698 0.8023 0.8081 0.8366 0.8595 1.7183 1.7212 1.9686 1.9728 2.0021 2.0058 3.5134 3.5139 3.7179 3.7378 3.7425 3.7499 4.9579 4.9585 6.8761 6.8851 7.0721 7.0766 7.0787 7.1018 9.2906 9.2954 9.3275 9.3301 k = 0.4167-0.2946 0.6124 ( 13200 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7359 -19.7359 -19.7299 -19.7298 -19.7298 -19.7297 -19.5632 -19.5632 -19.5630 -19.5629 -19.5508 -19.5508 -19.5498 -19.5498 -19.5438 -19.5438 -19.5437 -19.5437 -9.4076 -9.4076 -8.2468 -8.2465 -8.2187 -8.2184 -8.2061 -8.2056 -4.2097 -4.2097 0.4465 0.4568 0.6125 0.6208 0.6492 0.6715 0.7979 0.8021 0.8399 0.8673 1.7417 1.7459 1.9847 1.9895 2.0346 2.0396 3.4972 3.4982 3.6943 3.7189 3.7305 3.7395 4.9810 4.9821 6.8736 6.8908 7.0671 7.0789 7.0835 7.1119 9.2682 9.2759 9.3238 9.3275 k = 0.4000-0.2828 0.6124 ( 13202 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7359 -19.7359 -19.7299 -19.7299 -19.7298 -19.7297 -19.5632 -19.5631 -19.5629 -19.5628 -19.5508 -19.5508 -19.5499 -19.5499 -19.5439 -19.5439 -19.5438 -19.5437 -9.4142 -9.4142 -8.2455 -8.2451 -8.2167 -8.2163 -8.1990 -8.1982 -4.2104 -4.2104 0.4079 0.4237 0.5777 0.5944 0.6489 0.6735 0.8017 0.8032 0.8465 0.8776 1.7662 1.7711 2.0038 2.0092 2.0730 2.0787 3.4773 3.4789 3.6666 3.6958 3.7167 3.7271 5.0080 5.0098 6.8698 6.8988 7.0605 7.0818 7.0914 7.1232 9.2422 9.2534 9.3179 9.3233 k = 0.3833-0.2711 0.6124 ( 13204 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7359 -19.7359 -19.7300 -19.7299 -19.7297 -19.7297 -19.5632 -19.5631 -19.5628 -19.5627 -19.5507 -19.5507 -19.5500 -19.5500 -19.5440 -19.5439 -19.5438 -19.5437 -9.4218 -9.4218 -8.2446 -8.2441 -8.2140 -8.2133 -8.1906 -8.1896 -4.2112 -4.2112 0.3627 0.3839 0.5369 0.5619 0.6496 0.6755 0.8110 0.8124 0.8566 0.8906 1.7908 1.7958 2.0253 2.0314 2.1167 2.1222 3.4536 3.4560 3.6352 3.6686 3.7013 3.7130 5.0385 5.0411 6.8647 6.9090 7.0530 7.0850 7.1031 7.1357 9.2130 9.2286 9.3071 9.3153 k = 0.3667-0.2593 0.6124 ( 13196 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7358 -19.7358 -19.7300 -19.7299 -19.7297 -19.7297 -19.5632 -19.5631 -19.5627 -19.5626 -19.5506 -19.5506 -19.5501 -19.5500 -19.5440 -19.5440 -19.5438 -19.5437 -9.4301 -9.4301 -8.2441 -8.2437 -8.2106 -8.2097 -8.1812 -8.1798 -4.2120 -4.2120 0.3119 0.3376 0.4938 0.5256 0.6511 0.6777 0.8245 0.8283 0.8703 0.9063 1.8152 1.8193 2.0482 2.0555 2.1650 2.1691 3.4262 3.4297 3.6002 3.6376 3.6846 3.6975 5.0717 5.0753 6.8586 6.9213 7.0450 7.0881 7.1189 7.1490 9.1813 9.2020 9.2846 9.2974 k = 0.3500-0.2475 0.6124 ( 13196 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7357 -19.7357 -19.7301 -19.7300 -19.7297 -19.7296 -19.5632 -19.5631 -19.5625 -19.5625 -19.5506 -19.5506 -19.5502 -19.5502 -19.5441 -19.5440 -19.5438 -19.5437 -9.4392 -9.4391 -8.2441 -8.2437 -8.2065 -8.2053 -8.1707 -8.1691 -4.2128 -4.2127 0.2566 0.2853 0.4508 0.4873 0.6532 0.6799 0.8426 0.8482 0.8876 0.9248 1.8391 1.8417 2.0717 2.0806 2.2171 2.2184 3.3954 3.4001 3.5622 3.6031 3.6666 3.6806 5.1071 5.1116 6.8520 6.9349 7.0378 7.0907 7.1391 7.1631 9.1474 9.1740 9.2410 9.2570 k = 0.3333-0.2357 0.6124 ( 13200 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7356 -19.7356 -19.7301 -19.7300 -19.7297 -19.7296 -19.5631 -19.5631 -19.5624 -19.5624 -19.5505 -19.5505 -19.5503 -19.5503 -19.5442 -19.5441 -19.5438 -19.5438 -9.4487 -9.4487 -8.2445 -8.2441 -8.2017 -8.2003 -8.1596 -8.1577 -4.2136 -4.2135 0.1980 0.2279 0.4093 0.4483 0.6557 0.6820 0.8643 0.8714 0.9084 0.9459 1.8626 1.8630 2.0949 2.1060 2.2693 2.2720 3.3612 3.3674 3.5214 3.5656 3.6477 3.6625 5.1438 5.1495 6.8453 6.9480 7.0332 7.0921 7.1641 7.1783 9.1119 9.1449 9.1805 9.1960 k = 0.3167-0.2239 0.6124 ( 13198 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7356 -19.7356 -19.7302 -19.7301 -19.7297 -19.7296 -19.5631 -19.5631 -19.5622 -19.5622 -19.5506 -19.5505 -19.5504 -19.5504 -19.5443 -19.5442 -19.5438 -19.5438 -9.4587 -9.4586 -8.2452 -8.2448 -8.1965 -8.1948 -8.1478 -8.1457 -4.2143 -4.2142 0.1371 0.1668 0.3697 0.4095 0.6586 0.6840 0.8893 0.8975 0.9325 0.9698 1.8836 1.8858 2.1173 2.1310 2.3209 2.3285 3.3242 3.3319 3.4783 3.5253 3.6277 3.6432 5.1814 5.1880 6.8390 6.9573 7.0337 7.0919 7.1941 7.1954 9.0744 9.1126 9.1188 9.1312 k = 0.3000-0.2121 0.6124 ( 13212 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7355 -19.7355 -19.7303 -19.7302 -19.7297 -19.7296 -19.5632 -19.5631 -19.5621 -19.5620 -19.5507 -19.5507 -19.5503 -19.5503 -19.5444 -19.5443 -19.5439 -19.5438 -9.4689 -9.4688 -8.2461 -8.2458 -8.1908 -8.1888 -8.1357 -8.1334 -4.2150 -4.2149 0.0748 0.1035 0.3321 0.3714 0.6616 0.6860 0.9171 0.9261 0.9596 0.9961 1.9037 1.9087 2.1384 2.1551 2.3722 2.3857 3.2845 3.2941 3.4333 3.4827 3.6069 3.6230 5.2190 5.2266 6.8337 6.9606 7.0401 7.0897 7.2159 7.2292 9.0342 9.0539 9.0725 9.0865 k = 0.2833-0.2003 0.6124 ( 13212 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7354 -19.7354 -19.7304 -19.7303 -19.7297 -19.7295 -19.5631 -19.5631 -19.5619 -19.5618 -19.5509 -19.5509 -19.5502 -19.5502 -19.5445 -19.5444 -19.5439 -19.5438 -9.4792 -9.4792 -8.2471 -8.2469 -8.1847 -8.1826 -8.1233 -8.1209 -4.2155 -4.2154 0.0120 0.0390 0.2966 0.3345 0.6647 0.6878 0.9474 0.9569 0.9897 1.0249 1.9233 1.9314 2.1579 2.1779 2.4225 2.4428 3.2427 3.2545 3.3869 3.4381 3.5853 3.6017 5.2563 5.2646 6.8296 6.9589 7.0496 7.0850 7.2420 7.2694 8.9904 8.9988 9.0242 9.0571 k = 0.2667-0.1886 0.6124 ( 13208 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6906 -47.6906 -19.7353 -19.7353 -19.7304 -19.7303 -19.7296 -19.7295 -19.5631 -19.5631 -19.5617 -19.5616 -19.5511 -19.5511 -19.5501 -19.5501 -19.5446 -19.5445 -19.5439 -19.5438 -9.4896 -9.4896 -8.2483 -8.2481 -8.1784 -8.1760 -8.1110 -8.1083 -4.2160 -4.2158 -0.0506 -0.0256 0.2630 0.2991 0.6679 0.6895 0.9799 0.9897 1.0225 1.0560 1.9425 1.9540 2.1756 2.1988 2.4709 2.4989 3.1993 3.2137 3.3397 3.3921 3.5628 3.5795 5.2926 5.3015 6.8272 6.9547 7.0575 7.0779 7.2753 7.3144 8.9467 8.9510 8.9841 9.0282 k = 0.2500-0.1768 0.6124 ( 13202 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6906 -47.6906 -19.7352 -19.7352 -19.7305 -19.7304 -19.7296 -19.7295 -19.5631 -19.5631 -19.5615 -19.5614 -19.5513 -19.5513 -19.5500 -19.5499 -19.5447 -19.5446 -19.5439 -19.5438 -9.4999 -9.4998 -8.2496 -8.2494 -8.1718 -8.1693 -8.0987 -8.0960 -4.2162 -4.2160 -0.1124 -0.0895 0.2313 0.2654 0.6710 0.6911 1.0143 1.0243 1.0577 1.0893 1.9611 1.9762 2.1913 2.2177 2.5165 2.5533 3.1547 3.1723 3.2922 3.3451 3.5397 3.5564 5.3276 5.3368 6.8265 6.9496 7.0618 7.0686 7.3166 7.3638 8.9081 8.9110 8.9483 9.0003 k = 0.2333-0.1650 0.6124 ( 13204 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6906 -47.6906 -19.7351 -19.7351 -19.7306 -19.7305 -19.7296 -19.7295 -19.5631 -19.5631 -19.5613 -19.5612 -19.5516 -19.5515 -19.5498 -19.5498 -19.5448 -19.5448 -19.5439 -19.5438 -9.5100 -9.5099 -8.2510 -8.2508 -8.1651 -8.1625 -8.0867 -8.0839 -4.2164 -4.2161 -0.1727 -0.1519 0.2016 0.2334 0.6740 0.6927 1.0505 1.0605 1.0952 1.1246 1.9791 1.9980 2.2047 2.2341 2.5584 2.6054 3.1095 3.1310 3.2453 3.2976 3.5158 3.5324 5.3609 5.3703 6.8273 6.9438 7.0578 7.0625 7.3650 7.4170 8.8763 8.8788 8.9152 8.9735 k = 0.2167-0.1532 0.6124 ( 13212 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6906 -47.6906 -19.7350 -19.7350 -19.7307 -19.7306 -19.7296 -19.7294 -19.5631 -19.5631 -19.5610 -19.5610 -19.5518 -19.5518 -19.5497 -19.5497 -19.5450 -19.5449 -19.5439 -19.5439 -9.5198 -9.5197 -8.2523 -8.2521 -8.1583 -8.1557 -8.0751 -8.0722 -4.2163 -4.2161 -0.2310 -0.2122 0.1740 0.2034 0.6770 0.6941 1.0880 1.0979 1.1348 1.1618 1.9961 2.0190 2.2158 2.2477 2.5957 2.6545 3.0646 3.0908 3.2000 3.2503 3.4914 3.5076 5.3924 5.4018 6.8290 6.9367 7.0466 7.0616 7.4193 7.4730 8.8515 8.8540 8.8845 8.9482 k = 0.2000-0.1414 0.6124 ( 13216 PWs) bands (ev): -47.6914 -47.6914 -47.6912 -47.6912 -47.6906 -47.6906 -19.7349 -19.7349 -19.7308 -19.7307 -19.7295 -19.7294 -19.5631 -19.5631 -19.5608 -19.5607 -19.5521 -19.5520 -19.5496 -19.5496 -19.5451 -19.5451 -19.5440 -19.5439 -9.5292 -9.5291 -8.2537 -8.2535 -8.1516 -8.1489 -8.0639 -8.0610 -4.2161 -4.2159 -0.2869 -0.2701 0.1484 0.1754 0.6798 0.6954 1.1266 1.1364 1.1763 1.2007 2.0119 2.0389 2.2243 2.2582 2.6272 2.6998 3.0207 3.0523 3.1573 3.2039 3.4665 3.4822 5.4219 5.4310 6.8306 6.9272 7.0367 7.0615 7.4774 7.5307 8.8329 8.8360 8.8569 8.9245 k = 0.1833-0.1296 0.6124 ( 13232 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6907 -47.6907 -19.7349 -19.7349 -19.7309 -19.7308 -19.7295 -19.7294 -19.5632 -19.5631 -19.5606 -19.5605 -19.5523 -19.5523 -19.5494 -19.5494 -19.5453 -19.5452 -19.5440 -19.5439 -9.5381 -9.5380 -8.2550 -8.2549 -8.1449 -8.1423 -8.0534 -8.0505 -4.2158 -4.2155 -0.3399 -0.3249 0.1249 0.1495 0.6825 0.6966 1.1660 1.1756 1.2193 1.2412 2.0261 2.0573 2.2299 2.2650 2.6520 2.7402 2.9792 3.0165 3.1189 3.1589 3.4413 3.4562 5.4493 5.4579 6.8304 6.9143 7.0302 7.0644 7.5376 7.5888 8.8176 8.8239 8.8347 8.9024 k = 0.1667-0.1179 0.6124 ( 13240 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6907 -47.6907 -19.7348 -19.7348 -19.7310 -19.7309 -19.7295 -19.7294 -19.5632 -19.5631 -19.5604 -19.5603 -19.5526 -19.5525 -19.5493 -19.5493 -19.5454 -19.5453 -19.5440 -19.5440 -9.5465 -9.5464 -8.2563 -8.2562 -8.1385 -8.1359 -8.0436 -8.0408 -4.2153 -4.2150 -0.3896 -0.3764 0.1035 0.1258 0.6850 0.6977 1.2057 1.2152 1.2636 1.2829 2.0384 2.0738 2.2325 2.2679 2.6689 2.7737 2.9425 2.9840 3.0865 3.1163 3.4159 3.4300 5.4745 5.4824 6.8271 6.8978 7.0293 7.0715 7.5982 7.6460 8.7996 8.8165 8.8231 8.8820 k = 0.1500-0.1061 0.6124 ( 13218 PWs) bands (ev): -47.6913 -47.6913 -47.6912 -47.6912 -47.6907 -47.6907 -19.7347 -19.7347 -19.7311 -19.7310 -19.7294 -19.7293 -19.5632 -19.5631 -19.5601 -19.5600 -19.5528 -19.5528 -19.5491 -19.5491 -19.5455 -19.5455 -19.5440 -19.5439 -9.5543 -9.5542 -8.2575 -8.2574 -8.1323 -8.1298 -8.0345 -8.0318 -4.2147 -4.2145 -0.4356 -0.4241 0.0842 0.1041 0.6874 0.6987 1.2453 1.2546 1.3089 1.3255 2.0485 2.0877 2.2316 2.2662 2.6777 2.7951 2.9160 2.9552 3.0615 3.0768 3.3907 3.4037 5.4974 5.5046 6.8198 6.8783 7.0351 7.0829 7.6572 7.7007 8.7800 8.8123 8.8199 8.8636 k = 0.1333-0.0943 0.6124 ( 13214 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6907 -47.6907 -19.7346 -19.7345 -19.7311 -19.7310 -19.7294 -19.7293 -19.5631 -19.5631 -19.5599 -19.5598 -19.5530 -19.5530 -19.5490 -19.5490 -19.5457 -19.5456 -19.5440 -19.5439 -9.5614 -9.5613 -8.2586 -8.2586 -8.1265 -8.1241 -8.0262 -8.0237 -4.2141 -4.2138 -0.4777 -0.4677 0.0670 0.0846 0.6896 0.6995 1.2843 1.2935 1.3546 1.3687 2.0562 2.0986 2.2271 2.2597 2.6790 2.7962 2.9082 2.9305 3.0416 3.0448 3.3659 3.3777 5.5181 5.5244 6.8088 6.8570 7.0475 7.0977 7.7132 7.7516 8.7620 8.8086 8.8211 8.8486 k = 0.1167-0.0825 0.6124 ( 13202 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6907 -47.6907 -19.7345 -19.7344 -19.7312 -19.7311 -19.7293 -19.7293 -19.5631 -19.5631 -19.5596 -19.5595 -19.5533 -19.5532 -19.5488 -19.5488 -19.5458 -19.5457 -19.5440 -19.5439 -9.5678 -9.5677 -8.2597 -8.2596 -8.1210 -8.1188 -8.0188 -8.0165 -4.2134 -4.2131 -0.5155 -0.5070 0.0520 0.0673 0.6916 0.7002 1.3221 1.3312 1.4001 1.4119 2.0615 2.1060 2.2189 2.2483 2.6745 2.7789 2.9101 2.9169 3.0119 3.0354 3.3419 3.3524 5.5364 5.5419 6.7955 6.8353 7.0652 7.1148 7.7646 7.7976 8.7460 8.8011 8.8250 8.8401 k = 0.1000-0.0707 0.6124 ( 13200 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6907 -47.6907 -19.7344 -19.7344 -19.7313 -19.7312 -19.7293 -19.7292 -19.5631 -19.5631 -19.5594 -19.5593 -19.5535 -19.5535 -19.5487 -19.5486 -19.5459 -19.5458 -19.5440 -19.5440 -9.5734 -9.5734 -8.2606 -8.2606 -8.1161 -8.1142 -8.0123 -8.0102 -4.2127 -4.2124 -0.5488 -0.5416 0.0391 0.0522 0.6934 0.7007 1.3580 1.3668 1.4448 1.4543 2.0644 2.1096 2.2070 2.2323 2.6668 2.7550 2.8946 2.9282 2.9908 3.0314 3.3192 3.3283 5.5524 5.5570 6.7814 6.8141 7.0863 7.1330 7.8102 7.8377 8.7323 8.7877 8.8306 8.8391 k = 0.0833-0.0589 0.6124 ( 13176 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6907 -47.6907 -19.7343 -19.7342 -19.7313 -19.7313 -19.7293 -19.7292 -19.5631 -19.5631 -19.5591 -19.5590 -19.5537 -19.5536 -19.5486 -19.5485 -19.5460 -19.5460 -19.5440 -19.5439 -9.5782 -9.5782 -8.2614 -8.2614 -8.1118 -8.1101 -8.0067 -8.0049 -4.2120 -4.2118 -0.5773 -0.5714 0.0283 0.0392 0.6951 0.7011 1.3913 1.3997 1.4876 1.4950 2.0655 2.1094 2.1922 2.2126 2.6583 2.7309 2.8842 2.9303 2.9840 3.0305 3.2984 3.3060 5.5660 5.5698 6.7680 6.7943 7.1091 7.1509 7.8492 7.8713 8.7208 8.7713 8.8370 8.8423 k = 0.0667-0.0471 0.6124 ( 13182 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6908 -47.6908 -19.7342 -19.7342 -19.7314 -19.7313 -19.7293 -19.7292 -19.5631 -19.5631 -19.5589 -19.5589 -19.5539 -19.5539 -19.5484 -19.5484 -19.5461 -19.5461 -19.5440 -19.5439 -9.5822 -9.5822 -8.2621 -8.2621 -8.1081 -8.1067 -8.0021 -8.0006 -4.2114 -4.2112 -0.6008 -0.5961 0.0198 0.0284 0.6965 0.7013 1.4210 1.4287 1.5272 1.5326 2.0655 2.1058 2.1756 2.1908 2.6511 2.7090 2.8785 2.9221 2.9903 3.0309 3.2802 3.2862 5.5772 5.5802 6.7562 6.7768 7.1316 7.1670 7.8812 7.8982 8.7116 8.7544 8.8433 8.8468 k = 0.0500-0.0354 0.6124 ( 13166 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6908 -47.6908 -19.7341 -19.7341 -19.7314 -19.7314 -19.7292 -19.7292 -19.5631 -19.5630 -19.5587 -19.5587 -19.5540 -19.5540 -19.5483 -19.5483 -19.5462 -19.5462 -19.5439 -19.5439 -9.5854 -9.5853 -8.2626 -8.2626 -8.1051 -8.1040 -7.9985 -7.9973 -4.2108 -4.2107 -0.6191 -0.6157 0.0133 0.0198 0.6978 0.7014 1.4462 1.4526 1.5618 1.5655 2.0654 2.0996 2.1590 2.1691 2.6464 2.6899 2.8770 2.9117 3.0004 3.0312 3.2651 3.2696 5.5860 5.5882 6.7469 6.7621 7.1524 7.1801 7.9062 7.9184 8.7052 8.7384 8.8489 8.8513 k = 0.0333-0.0236 0.6124 ( 13158 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7341 -19.7314 -19.7314 -19.7292 -19.7292 -19.5631 -19.5631 -19.5586 -19.5585 -19.5541 -19.5541 -19.5482 -19.5482 -19.5463 -19.5463 -19.5439 -19.5439 -9.5876 -9.5876 -8.2630 -8.2630 -8.1029 -8.1022 -7.9958 -7.9950 -4.2104 -4.2103 -0.6321 -0.6299 0.0090 0.0134 0.6989 0.7012 1.4657 1.4704 1.5893 1.5915 2.0663 2.0915 2.1446 2.1503 2.6449 2.6741 2.8786 2.9023 3.0101 3.0305 3.2539 3.2568 5.5924 5.5939 6.7405 6.7506 7.1699 7.1890 7.9242 7.9321 8.7018 8.7244 8.8534 8.8549 k = 0.0167-0.0118 0.6124 ( 13168 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5631 -19.5631 -19.5585 -19.5585 -19.5543 -19.5542 -19.5482 -19.5481 -19.5463 -19.5463 -19.5440 -19.5439 -9.5890 -9.5889 -8.2632 -8.2632 -8.1015 -8.1011 -7.9941 -7.9937 -4.2102 -4.2101 -0.6398 -0.6386 0.0069 0.0090 0.6997 0.7009 1.4785 1.4809 1.6073 1.6083 2.0693 2.0829 2.1350 2.1374 2.6469 2.6616 2.8824 2.8944 3.0180 3.0282 3.2472 3.2486 5.5964 5.5971 6.7376 6.7426 7.1829 7.1927 7.9356 7.9395 8.7018 8.7133 8.8564 8.8571 k = 0.0000 0.0000 0.6124 ( 13170 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5630 -19.5630 -19.5585 -19.5585 -19.5543 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5440 -19.5440 -9.5894 -9.5894 -8.2633 -8.2633 -8.1009 -8.1009 -7.9934 -7.9934 -4.2101 -4.2101 -0.6419 -0.6419 0.0069 0.0069 0.7004 0.7004 1.4837 1.4837 1.6138 1.6138 2.0750 2.0750 2.1322 2.1322 2.6525 2.6525 2.8878 2.8878 3.0241 3.0241 3.2454 3.2454 5.5980 5.5980 6.7382 6.7382 7.1907 7.1907 7.9406 7.9406 8.7057 8.7057 8.8577 8.8577 k = 0.0000 0.0000 0.6124 ( 13170 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5630 -19.5630 -19.5585 -19.5585 -19.5543 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5440 -19.5440 -9.5894 -9.5894 -8.2633 -8.2633 -8.1009 -8.1009 -7.9934 -7.9934 -4.2101 -4.2101 -0.6419 -0.6419 0.0069 0.0069 0.7004 0.7004 1.4837 1.4837 1.6138 1.6138 2.0750 2.0750 2.1322 2.1322 2.6525 2.6525 2.8878 2.8878 3.0241 3.0241 3.2454 3.2454 5.5980 5.5980 6.7382 6.7382 7.1907 7.1907 7.9406 7.9406 8.7057 8.7057 8.8577 8.8577 k = 0.0000 0.0000 0.5920 ( 13164 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7291 -19.5631 -19.5631 -19.5584 -19.5584 -19.5543 -19.5543 -19.5481 -19.5481 -19.5463 -19.5463 -19.5440 -19.5439 -9.5901 -9.5901 -8.2625 -8.2623 -8.1008 -8.1005 -7.9934 -7.9934 -4.2101 -4.2101 -0.6420 -0.6416 0.0037 0.0049 0.6914 0.6998 1.4845 1.4898 1.6106 1.6197 2.0498 2.0950 2.1136 2.1586 2.6525 2.6562 2.8708 2.8841 3.0210 3.0459 3.2439 3.2474 5.5989 5.5993 6.7374 6.7447 7.1856 7.1945 7.9411 7.9453 8.6934 8.6955 8.8449 8.8574 k = 0.0000 0.0000 0.5715 ( 13162 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7316 -19.7315 -19.7291 -19.7291 -19.5632 -19.5631 -19.5584 -19.5584 -19.5543 -19.5543 -19.5481 -19.5481 -19.5463 -19.5463 -19.5439 -19.5439 -9.5922 -9.5922 -8.2599 -8.2594 -8.1001 -8.0995 -7.9933 -7.9933 -4.2104 -4.2103 -0.6417 -0.6410 -0.0044 -0.0022 0.6732 0.6891 1.4924 1.5029 1.6105 1.6278 2.0255 2.0787 2.1339 2.1868 2.6545 2.6644 2.8450 2.8587 3.0367 3.0759 3.2429 3.2500 5.6020 5.6029 6.7423 6.7568 7.1795 7.1972 7.9466 7.9549 8.6618 8.6649 8.8216 8.8434 k = 0.0000 0.0000 0.5511 ( 13184 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7317 -19.7316 -19.7291 -19.7290 -19.5633 -19.5633 -19.5584 -19.5583 -19.5543 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5439 -19.5439 -9.5957 -9.5957 -8.2556 -8.2547 -8.0988 -8.0979 -7.9932 -7.9932 -4.2107 -4.2106 -0.6412 -0.6401 -0.0172 -0.0141 0.6465 0.6687 1.5069 1.5227 1.6139 1.6375 2.0024 2.0566 2.1627 2.2163 2.6549 2.6772 2.8198 2.8217 3.0610 3.1079 3.2426 3.2528 5.6074 5.6086 6.7528 6.7746 7.1722 7.1987 7.9571 7.9694 8.6166 8.6198 8.7902 8.8180 k = 0.0000 0.0000 0.5307 ( 13188 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7318 -19.7317 -19.7290 -19.7289 -19.5634 -19.5634 -19.5582 -19.5582 -19.5544 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5439 -19.5439 -9.6005 -9.6005 -8.2495 -8.2484 -8.0970 -8.0958 -7.9930 -7.9930 -4.2112 -4.2111 -0.6404 -0.6390 -0.0342 -0.0303 0.6122 0.6388 1.5270 1.5489 1.6217 1.6484 1.9809 2.0355 2.1930 2.2468 2.6482 2.6941 2.7795 2.8028 3.0871 3.1393 3.2430 3.2557 5.6150 5.6164 6.7687 6.7978 7.1639 7.1993 7.9725 7.9886 8.5634 8.5663 8.7530 8.7846 k = 0.0000 0.0000 0.5103 ( 13174 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7319 -19.7318 -19.7288 -19.7288 -19.5635 -19.5635 -19.5581 -19.5580 -19.5544 -19.5543 -19.5480 -19.5480 -19.5464 -19.5464 -19.5439 -19.5439 -9.6066 -9.6065 -8.2419 -8.2405 -8.0947 -8.0931 -7.9927 -7.9927 -4.2118 -4.2116 -0.6393 -0.6376 -0.0548 -0.0504 0.5710 0.6005 1.5501 1.5804 1.6359 1.6606 1.9609 2.0160 2.2244 2.2783 2.6292 2.7117 2.7379 2.7996 3.1123 3.1689 3.2440 3.2586 5.6245 5.6259 6.7900 6.8263 7.1549 7.1991 7.9924 8.0121 8.5062 8.5087 8.7117 8.7459 k = 0.0000 0.0000 0.4899 ( 13168 PWs) bands (ev): -47.6914 -47.6914 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7321 -19.7319 -19.7287 -19.7286 -19.5637 -19.5637 -19.5579 -19.5579 -19.5544 -19.5543 -19.5480 -19.5480 -19.5464 -19.5463 -19.5438 -19.5438 -9.6137 -9.6136 -8.2328 -8.2311 -8.0918 -8.0900 -7.9924 -7.9924 -4.2124 -4.2122 -0.6379 -0.6359 -0.0783 -0.0736 0.5239 0.5548 1.5721 1.6149 1.6597 1.6761 1.9425 1.9982 2.2568 2.3106 2.5989 2.6839 2.7432 2.8092 3.1348 3.1962 3.2460 3.2610 5.6358 5.6371 6.8162 6.8598 7.1455 7.1985 8.0165 8.0396 8.4480 8.4499 8.6679 8.7038 k = 0.0000 0.0000 0.4695 ( 13174 PWs) bands (ev): -47.6914 -47.6914 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7322 -19.7321 -19.7286 -19.7285 -19.5639 -19.5639 -19.5578 -19.5577 -19.5545 -19.5544 -19.5479 -19.5479 -19.5464 -19.5464 -19.5438 -19.5438 -9.6218 -9.6217 -8.2224 -8.2205 -8.0884 -8.0864 -7.9921 -7.9920 -4.2131 -4.2129 -0.6363 -0.6341 -0.1041 -0.0993 0.4719 0.5030 1.5897 1.6457 1.6954 1.7007 1.9258 1.9822 2.2898 2.3435 2.5615 2.6371 2.7692 2.8270 3.1536 3.2209 3.2492 3.2629 5.6485 5.6495 6.8468 6.8978 7.1363 7.1982 8.0445 8.0704 8.3905 8.3919 8.6225 8.6597 k = 0.0000 0.0000 0.4491 ( 13166 PWs) bands (ev): -47.6914 -47.6914 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7323 -19.7322 -19.7284 -19.7283 -19.5641 -19.5641 -19.5576 -19.5575 -19.5545 -19.5544 -19.5479 -19.5478 -19.5464 -19.5464 -19.5437 -19.5437 -9.6307 -9.6307 -8.2109 -8.2087 -8.0846 -8.0823 -7.9917 -7.9916 -4.2138 -4.2136 -0.6346 -0.6321 -0.1316 -0.1269 0.4159 0.4463 1.6034 1.6658 1.7406 1.7416 1.9107 1.9682 2.3234 2.3767 2.5207 2.5893 2.7976 2.8493 3.1676 3.2426 3.2541 3.2639 5.6622 5.6626 6.8810 6.9393 7.1285 7.1989 8.0758 8.1039 8.3353 8.3360 8.5769 8.6148 k = 0.0000 0.0000 0.4287 ( 13162 PWs) bands (ev): -47.6914 -47.6914 -47.6910 -47.6910 -47.6908 -47.6908 -19.7341 -19.7340 -19.7325 -19.7323 -19.7283 -19.7282 -19.5643 -19.5643 -19.5574 -19.5573 -19.5545 -19.5544 -19.5478 -19.5478 -19.5464 -19.5464 -19.5437 -19.5437 -9.6404 -9.6404 -8.1984 -8.1961 -8.0804 -8.0778 -7.9913 -7.9912 -4.2145 -4.2142 -0.6326 -0.6300 -0.1603 -0.1558 0.3568 0.3859 1.6150 1.6787 1.7914 1.7958 1.8974 1.9566 2.3572 2.4087 2.4797 2.5417 2.8270 2.8738 3.1763 3.2592 3.2610 3.2658 5.6759 5.6761 6.9175 6.9816 7.1250 7.2023 8.1097 8.1390 8.2831 8.2834 8.5319 8.5702 k = 0.0000 0.0000 0.4082 ( 13156 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6908 -47.6908 -19.7341 -19.7340 -19.7326 -19.7325 -19.7281 -19.7281 -19.5645 -19.5645 -19.5572 -19.5571 -19.5546 -19.5545 -19.5477 -19.5477 -19.5464 -19.5464 -19.5436 -19.5436 -9.6507 -9.6506 -8.1852 -8.1826 -8.0757 -8.0729 -7.9908 -7.9907 -4.2151 -4.2148 -0.6304 -0.6278 -0.1897 -0.1856 0.2954 0.3229 1.6258 1.6889 1.8466 1.8555 1.8861 1.9488 2.3901 2.4198 2.4592 2.4957 2.8566 2.8993 3.1797 3.2601 3.2694 3.2789 5.6886 5.6896 6.9540 7.0183 7.1324 7.2107 8.1453 8.1729 8.2339 8.2368 8.4888 8.5274 k = 0.0000 0.0000 0.3878 ( 13162 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7341 -19.7328 -19.7326 -19.7279 -19.7279 -19.5647 -19.5647 -19.5571 -19.5570 -19.5546 -19.5545 -19.5476 -19.5476 -19.5464 -19.5464 -19.5436 -19.5436 -9.6613 -9.6613 -8.1714 -8.1686 -8.0707 -8.0676 -7.9902 -7.9901 -4.2156 -4.2154 -0.6282 -0.6255 -0.2193 -0.2157 0.2326 0.2583 1.6362 1.6980 1.8752 1.8953 1.9210 1.9538 2.3834 2.4136 2.4601 2.4865 2.8859 2.9246 3.1787 3.2566 3.2783 3.2918 5.6997 5.7015 6.9878 7.0394 7.1610 7.2272 8.1798 8.1799 8.1903 8.2199 8.4490 8.4886 k = 0.0000 0.0000 0.3674 ( 13162 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7340 -19.7329 -19.7328 -19.7278 -19.7278 -19.5649 -19.5649 -19.5569 -19.5568 -19.5547 -19.5546 -19.5476 -19.5476 -19.5464 -19.5464 -19.5435 -19.5435 -9.6723 -9.6723 -8.1573 -8.1543 -8.0654 -8.0621 -7.9897 -7.9896 -4.2160 -4.2158 -0.6259 -0.6232 -0.2488 -0.2457 0.1692 0.1928 1.6469 1.7066 1.8670 1.9110 1.9888 1.9968 2.3411 2.3902 2.4727 2.5205 2.9143 2.9491 3.1741 3.2510 3.2869 3.3021 5.7082 5.7107 7.0160 7.0461 7.2103 7.2550 8.1447 8.1473 8.2169 8.2450 8.4144 8.4569 k = 0.0000 0.0000 0.3470 ( 13168 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7341 -19.7331 -19.7329 -19.7277 -19.7276 -19.5652 -19.5652 -19.5568 -19.5566 -19.5548 -19.5546 -19.5475 -19.5475 -19.5464 -19.5464 -19.5435 -19.5434 -9.6834 -9.6834 -8.1429 -8.1398 -8.0598 -8.0563 -7.9891 -7.9890 -4.2163 -4.2161 -0.6237 -0.6211 -0.2778 -0.2754 0.1057 0.1274 1.6578 1.7149 1.8603 1.9098 2.0590 2.0606 2.2992 2.3485 2.5051 2.5554 2.9414 2.9724 3.1666 3.2434 3.2944 3.3097 5.7128 5.7160 7.0377 7.0478 7.2711 7.2953 8.1099 8.1113 8.2470 8.2642 8.3886 8.4381 k = 0.0000 0.0000 0.3266 ( 13156 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7341 -19.7332 -19.7330 -19.7275 -19.7275 -19.5654 -19.5653 -19.5566 -19.5565 -19.5548 -19.5547 -19.5474 -19.5474 -19.5464 -19.5464 -19.5434 -19.5434 -9.6946 -9.6946 -8.1286 -8.1253 -8.0539 -8.0504 -7.9885 -7.9883 -4.2165 -4.2162 -0.6215 -0.6190 -0.3060 -0.3043 0.0429 0.0625 1.6692 1.7233 1.8551 1.9066 2.1288 2.1297 2.2598 2.3069 2.5397 2.5905 2.9670 2.9939 3.1568 3.2340 3.3006 3.3148 5.7125 5.7161 7.0501 7.0544 7.3381 7.3468 8.0795 8.0802 8.2659 8.2679 8.3779 8.4374 k = 0.0000 0.0000 0.3062 ( 13158 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7341 -19.7333 -19.7332 -19.7274 -19.7273 -19.5656 -19.5656 -19.5564 -19.5563 -19.5549 -19.5547 -19.5473 -19.5473 -19.5464 -19.5464 -19.5433 -19.5433 -9.7057 -9.7056 -8.1144 -8.1110 -8.0479 -8.0443 -7.9878 -7.9876 -4.2164 -4.2162 -0.6195 -0.6173 -0.3332 -0.3323 -0.0187 -0.0010 1.6810 1.7316 1.8515 1.9039 2.1858 2.1936 2.2376 2.2719 2.5749 2.6257 2.9909 3.0135 3.1448 3.2228 3.3054 3.3176 5.7060 5.7099 7.0555 7.0690 7.4068 7.4088 8.0539 8.0542 8.2579 8.2686 8.3872 8.4526 k = 0.0000 0.0000 0.2858 ( 13162 PWs) bands (ev): -47.6915 -47.6915 -47.6909 -47.6909 -47.6908 -47.6908 -19.7342 -19.7341 -19.7335 -19.7333 -19.7272 -19.7272 -19.5658 -19.5658 -19.5563 -19.5562 -19.5549 -19.5548 -19.5472 -19.5472 -19.5464 -19.5464 -19.5432 -19.5432 -9.7165 -9.7165 -8.1005 -8.0971 -8.0417 -8.0381 -7.9871 -7.9869 -4.2162 -4.2160 -0.6177 -0.6159 -0.3591 -0.3590 -0.0786 -0.0628 1.6932 1.7399 1.8493 1.9022 2.1693 2.2083 2.2895 2.2902 2.6100 2.6608 3.0130 3.0306 3.1313 3.2103 3.3087 3.3185 5.6926 5.6965 7.0653 7.0839 7.4723 7.4817 8.0335 8.0335 8.2418 8.2623 8.4089 8.4749 k = 0.0000 0.0000 0.2654 ( 13166 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7342 -19.7341 -19.7336 -19.7334 -19.7271 -19.7271 -19.5659 -19.5659 -19.5562 -19.5561 -19.5550 -19.5548 -19.5472 -19.5471 -19.5464 -19.5464 -19.5432 -19.5432 -9.7271 -9.7271 -8.0871 -8.0838 -8.0355 -8.0318 -7.9864 -7.9862 -4.2158 -4.2156 -0.6165 -0.6150 -0.3842 -0.3834 -0.1361 -0.1221 1.7058 1.7481 1.8484 1.9016 2.1352 2.1764 2.3554 2.3618 2.6451 2.6959 3.0331 3.0448 3.1168 3.1971 3.3109 3.3177 5.6718 5.6755 7.0798 7.1005 7.5412 7.5553 8.0183 8.0183 8.2253 8.2559 8.4336 8.4859 k = 0.0000 0.0000 0.2449 ( 13182 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7336 -19.7335 -19.7271 -19.7270 -19.5661 -19.5661 -19.5561 -19.5560 -19.5550 -19.5549 -19.5471 -19.5471 -19.5464 -19.5464 -19.5431 -19.5431 -9.7372 -9.7372 -8.0744 -8.0712 -8.0292 -8.0256 -7.9856 -7.9854 -4.2152 -4.2151 -0.6158 -0.6147 -0.4076 -0.4060 -0.1909 -0.1786 1.7186 1.7560 1.8490 1.9022 2.1015 2.1418 2.4250 2.4338 2.6800 2.7309 3.0504 3.0554 3.1025 3.1842 3.3120 3.3156 5.6436 5.6470 7.0988 7.1195 7.6113 7.6281 8.0085 8.0086 8.2111 8.2538 8.4304 8.4585 k = 0.0000 0.0000 0.2245 ( 13174 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7337 -19.7336 -19.7270 -19.7269 -19.5663 -19.5663 -19.5559 -19.5558 -19.5550 -19.5549 -19.5470 -19.5470 -19.5464 -19.5464 -19.5431 -19.5431 -9.7469 -9.7468 -8.0625 -8.0594 -8.0229 -8.0195 -7.9848 -7.9846 -4.2145 -4.2143 -0.6159 -0.6154 -0.4291 -0.4266 -0.2424 -0.2318 1.7312 1.7634 1.8508 1.9038 2.0698 2.1087 2.4930 2.5036 2.7146 2.7660 3.0605 3.0612 3.0939 3.1734 3.3122 3.3126 5.6086 5.6115 7.1215 7.1408 7.6805 7.6985 8.0042 8.0046 8.1999 8.2573 8.3814 8.4526 k = 0.0000 0.0000 0.2041 ( 13174 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7341 -19.7339 -19.7337 -19.7269 -19.7269 -19.5664 -19.5664 -19.5558 -19.5557 -19.5551 -19.5550 -19.5469 -19.5469 -19.5464 -19.5464 -19.5430 -19.5430 -9.7559 -9.7559 -8.0515 -8.0487 -8.0166 -8.0134 -7.9839 -7.9837 -4.2136 -4.2135 -0.6171 -0.6170 -0.4483 -0.4450 -0.2902 -0.2811 1.7434 1.7702 1.8540 1.9063 2.0407 2.0781 2.5575 2.5696 2.7489 2.8010 3.0540 3.0610 3.1011 3.1665 3.3093 3.3118 5.5677 5.5700 7.1468 7.1637 7.7468 7.7645 8.0053 8.0063 8.1912 8.2658 8.3387 8.4239 k = 0.0000 0.0000 0.1837 ( 13178 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7339 -19.7338 -19.7268 -19.7267 -19.5665 -19.5665 -19.5558 -19.5557 -19.5551 -19.5550 -19.5469 -19.5468 -19.5464 -19.5464 -19.5430 -19.5430 -9.7643 -9.7643 -8.0416 -8.0392 -8.0103 -8.0076 -7.9830 -7.9828 -4.2126 -4.2125 -0.6199 -0.6195 -0.4650 -0.4611 -0.3339 -0.3264 1.7548 1.7760 1.8584 1.9097 2.0145 2.0502 2.6170 2.6302 2.7822 2.8358 3.0393 3.0543 3.1173 3.1652 3.3059 3.3110 5.5221 5.5239 7.1734 7.1873 7.8080 7.8243 8.0118 8.0134 8.1834 8.2678 8.3148 8.4065 k = 0.0000 0.0000 0.1633 ( 13188 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7340 -19.7339 -19.7267 -19.7267 -19.5667 -19.5667 -19.5557 -19.5556 -19.5552 -19.5551 -19.5468 -19.5468 -19.5464 -19.5464 -19.5430 -19.5430 -9.7720 -9.7720 -8.0329 -8.0310 -8.0042 -8.0019 -7.9820 -7.9818 -4.2116 -4.2115 -0.6241 -0.6234 -0.4791 -0.4747 -0.3732 -0.3670 1.7648 1.7807 1.8642 1.9136 1.9915 2.0253 2.6705 2.6843 2.8139 2.8692 3.0231 3.0422 3.1369 3.1698 3.3028 3.3099 5.4735 5.4748 7.1997 7.2105 7.8624 7.8760 8.0232 8.0257 8.1746 8.2438 8.3289 8.4028 k = 0.0000 0.0000 0.1429 ( 13180 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7341 -19.7340 -19.7266 -19.7266 -19.5668 -19.5668 -19.5556 -19.5555 -19.5552 -19.5551 -19.5467 -19.5467 -19.5465 -19.5464 -19.5429 -19.5429 -9.7789 -9.7789 -8.0255 -8.0240 -7.9982 -7.9966 -7.9810 -7.9808 -4.2105 -4.2105 -0.6296 -0.6288 -0.4904 -0.4858 -0.4077 -0.4028 1.7731 1.7842 1.8713 1.9178 1.9720 2.0035 2.7175 2.7313 2.8426 2.8994 3.0072 3.0268 3.1593 3.1802 3.3003 3.3086 5.4236 5.4246 7.2245 7.2324 7.9090 7.9191 8.0384 8.0418 8.1643 8.2143 8.3598 8.4131 k = 0.0000 0.0000 0.1225 ( 13168 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7341 -19.7341 -19.7265 -19.7265 -19.5669 -19.5669 -19.5555 -19.5554 -19.5552 -19.5552 -19.5467 -19.5466 -19.5464 -19.5464 -19.5428 -19.5428 -9.7850 -9.7850 -8.0193 -8.0184 -7.9927 -7.9915 -7.9799 -7.9798 -4.2095 -4.2095 -0.6362 -0.6354 -0.4991 -0.4946 -0.4372 -0.4336 1.7793 1.7864 1.8794 1.9220 1.9562 1.9849 2.7584 2.7714 2.8666 2.9238 2.9924 3.0099 3.1846 3.1960 3.2986 3.3074 5.3744 5.3750 7.2468 7.2521 7.9480 7.9546 8.0546 8.0594 8.1535 8.1880 8.3969 8.4344 k = 0.0000 0.0000 0.1021 ( 13168 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7341 -19.7264 -19.7264 -19.5670 -19.5670 -19.5554 -19.5554 -19.5552 -19.5552 -19.5466 -19.5466 -19.5464 -19.5464 -19.5428 -19.5428 -9.7902 -9.7902 -8.0144 -8.0138 -7.9877 -7.9870 -7.9788 -7.9787 -4.2085 -4.2085 -0.6434 -0.6428 -0.5055 -0.5013 -0.4618 -0.4592 1.7834 1.7874 1.8883 1.9256 1.9440 1.9694 2.7940 2.8054 2.8851 2.9403 2.9789 2.9928 3.2118 3.2167 3.2976 3.3061 5.3278 5.3282 7.2660 7.2692 7.9809 7.9844 8.0683 8.0749 8.1444 8.1667 8.4362 8.4623 k = 0.0000 0.0000 0.0816 ( 13162 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7342 -19.7264 -19.7264 -19.5670 -19.5670 -19.5554 -19.5554 -19.5553 -19.5552 -19.5465 -19.5465 -19.5464 -19.5464 -19.5428 -19.5428 -9.7945 -9.7945 -8.0106 -8.0104 -7.9834 -7.9830 -7.9777 -7.9777 -4.2077 -4.2076 -0.6507 -0.6503 -0.5099 -0.5063 -0.4815 -0.4797 1.7856 1.7876 1.8974 1.9285 1.9353 1.9568 2.8250 2.8344 2.8981 2.9482 2.9667 2.9765 3.2390 3.2402 3.2974 3.3049 5.2859 5.2861 7.2816 7.2833 8.0095 8.0106 8.0763 8.0847 8.1388 8.1514 8.4743 8.4921 k = 0.0000 0.0000 0.0612 ( 13157 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7343 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5554 -19.5553 -19.5553 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5428 -19.5428 -9.7979 -9.7979 -8.0079 -8.0078 -7.9800 -7.9798 -7.9768 -7.9768 -4.2069 -4.2069 -0.6573 -0.6571 -0.5127 -0.5099 -0.4964 -0.4953 1.7864 1.7872 1.9063 1.9299 1.9301 1.9469 2.8523 2.8591 2.9071 2.9485 2.9554 2.9617 3.2633 3.2638 3.2976 3.3038 5.2507 5.2508 7.2936 7.2943 8.0341 8.0346 8.0786 8.0870 8.1359 8.1418 8.5079 8.5195 k = 0.0000 0.0000 0.0408 ( 13147 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5553 -19.5553 -19.5553 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5428 -19.5428 -9.8004 -9.8004 -8.0061 -8.0060 -7.9774 -7.9774 -7.9760 -7.9760 -4.2064 -4.2064 -0.6626 -0.6626 -0.5143 -0.5124 -0.5068 -0.5062 1.7864 1.7866 1.9145 1.9272 1.9303 1.9392 2.8762 2.8801 2.9138 2.9430 2.9443 2.9486 3.2826 3.2836 3.2983 3.3026 5.2240 5.2240 7.3020 7.3022 8.0547 8.0560 8.0779 8.0844 8.1330 8.1352 8.5343 8.5413 k = 0.0000 0.0000 0.0204 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5670 -19.5670 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8018 -9.8018 -8.0050 -8.0050 -7.9759 -7.9759 -7.9756 -7.9756 -4.2061 -4.2061 -0.6661 -0.6661 -0.5150 -0.5140 -0.5129 -0.5127 1.7861 1.7861 1.9216 1.9266 1.9292 1.9331 2.8962 2.8974 2.9200 2.9332 2.9346 2.9363 3.2955 3.2962 3.2992 3.3014 5.2073 5.2073 7.3069 7.3069 8.0707 8.0720 8.0772 8.0806 8.1289 8.1292 8.5514 8.5529 k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8023 -9.8023 -8.0047 -8.0047 -7.9754 -7.9754 -7.9754 -7.9754 -4.2060 -4.2060 -0.6673 -0.6673 -0.5149 -0.5149 -0.5149 -0.5149 1.7859 1.7859 1.9276 1.9276 1.9276 1.9276 2.9070 2.9070 2.9268 2.9268 2.9268 2.9268 3.3003 3.3003 3.3003 3.3003 5.2016 5.2016 7.3085 7.3085 8.0779 8.0779 8.0779 8.0779 8.1263 8.1263 8.5585 8.5585 k = 0.0000 0.0000 0.0000 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8023 -9.8023 -8.0047 -8.0047 -7.9754 -7.9754 -7.9754 -7.9754 -4.2060 -4.2060 -0.6673 -0.6673 -0.5149 -0.5149 -0.5149 -0.5149 1.7859 1.7859 1.9276 1.9276 1.9276 1.9276 2.9070 2.9070 2.9268 2.9268 2.9268 2.9268 3.3003 3.3003 3.3003 3.3003 5.2016 5.2016 7.3085 7.3085 8.0779 8.0779 8.0779 8.0779 8.1263 8.1263 8.5585 8.5585 k = 0.0068 0.0096 0.0166 ( 13115 PWs) bands (ev): -47.6916 -47.6916 -47.6907 -47.6907 -47.6907 -47.6907 -19.7342 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5670 -19.5670 -19.5552 -19.5552 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8018 -9.8018 -8.0050 -8.0050 -7.9759 -7.9759 -7.9756 -7.9755 -4.2061 -4.2061 -0.6661 -0.6661 -0.5151 -0.5141 -0.5127 -0.5127 1.7861 1.7861 1.9215 1.9280 1.9280 1.9330 2.8971 2.8971 2.9191 2.9346 2.9349 2.9349 3.2957 3.2957 3.2994 3.3017 5.2072 5.2072 7.3069 7.3069 8.0724 8.0724 8.0758 8.0799 8.1291 8.1291 8.5526 8.5531 k = 0.0135 0.0191 0.0331 ( 13145 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7342 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5553 -19.5553 -19.5552 -19.5552 -19.5464 -19.5464 -19.5464 -19.5464 -19.5427 -19.5427 -9.8004 -9.8004 -8.0061 -8.0061 -7.9775 -7.9775 -7.9760 -7.9759 -4.2064 -4.2064 -0.6627 -0.6627 -0.5149 -0.5129 -0.5060 -0.5060 1.7866 1.7866 1.9148 1.9292 1.9292 1.9376 2.8797 2.8797 2.9116 2.9421 2.9465 2.9465 3.2827 3.2827 3.2990 3.3033 5.2237 5.2237 7.3021 7.3021 8.0586 8.0586 8.0737 8.0817 8.1343 8.1344 8.5379 8.5379 k = 0.0203 0.0287 0.0497 ( 13151 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7343 -19.7342 -19.7263 -19.7263 -19.5671 -19.5671 -19.5554 -19.5553 -19.5553 -19.5553 -19.5464 -19.5464 -19.5464 -19.5464 -19.5428 -19.5428 -9.7980 -9.7980 -8.0079 -8.0079 -7.9799 -7.9799 -7.9767 -7.9766 -4.2069 -4.2069 -0.6576 -0.6576 -0.5143 -0.5113 -0.4945 -0.4945 1.7874 1.7874 1.9077 1.9312 1.9312 1.9414 2.8594 2.8594 2.9043 2.9490 2.9560 2.9560 3.2627 3.2627 3.2993 3.3053 5.2502 5.2502 7.2938 7.2938 8.0400 8.0400 8.0716 8.0833 8.1382 8.1382 8.5154 8.5154 k = 0.0270 0.0382 0.0662 ( 13172 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7343 -19.7343 -19.7342 -19.7264 -19.7264 -19.5670 -19.5670 -19.5554 -19.5553 -19.5553 -19.5553 -19.5465 -19.5465 -19.5464 -19.5464 -19.5428 -19.5428 -9.7947 -9.7947 -8.0106 -8.0106 -7.9830 -7.9830 -7.9776 -7.9776 -4.2076 -4.2076 -0.6512 -0.6512 -0.5131 -0.5092 -0.4777 -0.4777 1.7885 1.7885 1.9004 1.9343 1.9343 1.9445 2.8364 2.8364 2.8973 2.9550 2.9615 2.9615 3.2387 3.2387 3.3006 3.3075 5.2851 5.2851 7.2816 7.2816 8.0182 8.0182 8.0698 8.0850 8.1386 8.1386 8.4895 8.4895 k = 0.0338 0.0478 0.0828 ( 13175 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7343 -19.7342 -19.7342 -19.7342 -19.7265 -19.7265 -19.5670 -19.5670 -19.5553 -19.5553 -19.5553 -19.5553 -19.5465 -19.5465 -19.5465 -19.5465 -19.5428 -19.5428 -9.7904 -9.7904 -8.0145 -8.0145 -7.9865 -7.9865 -7.9788 -7.9788 -4.2084 -4.2084 -0.6443 -0.6443 -0.5115 -0.5066 -0.4551 -0.4551 1.7899 1.7899 1.8930 1.9384 1.9384 1.9469 2.8100 2.8100 2.8904 2.9596 2.9609 2.9609 3.2145 3.2145 3.3029 3.3099 5.3269 5.3269 7.2650 7.2650 7.9938 7.9938 8.0685 8.0868 8.1349 8.1349 8.4639 8.4639 k = 0.0405 0.0573 0.0993 ( 13181 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7342 -19.7342 -19.7342 -19.7341 -19.7265 -19.7265 -19.5669 -19.5669 -19.5554 -19.5554 -19.5554 -19.5553 -19.5466 -19.5466 -19.5465 -19.5465 -19.5429 -19.5429 -9.7853 -9.7853 -8.0197 -8.0197 -7.9902 -7.9902 -7.9803 -7.9803 -4.2094 -4.2094 -0.6372 -0.6372 -0.5093 -0.5036 -0.4266 -0.4266 1.7915 1.7915 1.8857 1.9438 1.9438 1.9487 2.7793 2.7793 2.8834 2.9522 2.9522 2.9623 3.1944 3.1944 3.3063 3.3125 5.3735 5.3735 7.2434 7.2434 7.9675 7.9675 8.0679 8.0889 8.1276 8.1276 8.4415 8.4415 k = 0.0473 0.0669 0.1159 ( 13175 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7342 -19.7342 -19.7342 -19.7341 -19.7266 -19.7266 -19.5668 -19.5668 -19.5554 -19.5554 -19.5554 -19.5553 -19.5466 -19.5466 -19.5465 -19.5465 -19.5429 -19.5429 -9.7793 -9.7793 -8.0264 -8.0264 -7.9938 -7.9938 -7.9821 -7.9820 -4.2103 -4.2103 -0.6302 -0.6302 -0.5066 -0.5000 -0.3921 -0.3921 1.7934 1.7934 1.8788 1.9500 1.9505 1.9505 2.7428 2.7428 2.8763 2.9346 2.9346 2.9630 3.1816 3.1816 3.3110 3.3153 5.4230 5.4230 7.2162 7.2163 7.9406 7.9406 8.0682 8.0914 8.1181 8.1181 8.4235 8.4235 k = 0.0541 0.0764 0.1324 ( 13181 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7342 -19.7341 -19.7341 -19.7340 -19.7267 -19.7267 -19.5667 -19.5667 -19.5554 -19.5554 -19.5554 -19.5553 -19.5467 -19.5467 -19.5465 -19.5465 -19.5430 -19.5430 -9.7725 -9.7725 -8.0345 -8.0345 -7.9973 -7.9973 -7.9841 -7.9840 -4.2112 -4.2112 -0.6233 -0.6233 -0.5033 -0.4960 -0.3520 -0.3520 1.7956 1.7956 1.8725 1.9510 1.9586 1.9586 2.6994 2.6994 2.8687 2.9101 2.9101 2.9613 3.1765 3.1765 3.3168 3.3181 5.4733 5.4733 7.1832 7.1832 7.9149 7.9149 8.0696 8.0947 8.1081 8.1081 8.4098 8.4098 k = 0.0608 0.0860 0.1490 ( 13187 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7342 -19.7341 -19.7341 -19.7340 -19.7268 -19.7268 -19.5665 -19.5665 -19.5555 -19.5554 -19.5554 -19.5553 -19.5467 -19.5467 -19.5466 -19.5465 -19.5430 -19.5430 -9.7650 -9.7650 -8.0438 -8.0438 -8.0008 -8.0008 -7.9864 -7.9863 -4.2121 -4.2121 -0.6166 -0.6166 -0.4995 -0.4915 -0.3065 -0.3065 1.7981 1.7981 1.8668 1.9520 1.9683 1.9683 2.6483 2.6483 2.8607 2.8822 2.8822 2.9572 3.1772 3.1772 3.3209 3.3234 5.5224 5.5224 7.1444 7.1444 7.8927 7.8927 8.0720 8.0986 8.0991 8.0991 8.3992 8.3992 k = 0.0676 0.0956 0.1655 ( 13181 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7341 -19.7340 -19.7340 -19.7339 -19.7269 -19.7269 -19.5664 -19.5664 -19.5555 -19.5555 -19.5555 -19.5553 -19.5468 -19.5468 -19.5466 -19.5466 -19.5431 -19.5431 -9.7568 -9.7568 -8.0541 -8.0541 -8.0042 -8.0042 -7.9889 -7.9888 -4.2129 -4.2129 -0.6099 -0.6099 -0.4951 -0.4864 -0.2563 -0.2563 1.8011 1.8011 1.8621 1.9529 1.9795 1.9795 2.5897 2.5897 2.8519 2.8536 2.8536 2.9508 3.1816 3.1816 3.3235 3.3305 5.5682 5.5682 7.1007 7.1007 7.8759 7.8759 8.0756 8.0921 8.0921 8.1030 8.3909 8.3909 k = 0.0743 0.1051 0.1821 ( 13181 PWs) bands (ev): -47.6916 -47.6916 -47.6908 -47.6908 -47.6908 -47.6908 -19.7340 -19.7340 -19.7340 -19.7338 -19.7270 -19.7270 -19.5662 -19.5662 -19.5555 -19.5555 -19.5555 -19.5554 -19.5468 -19.5468 -19.5466 -19.5466 -19.5431 -19.5431 -9.7480 -9.7480 -8.0654 -8.0654 -8.0076 -8.0076 -7.9917 -7.9916 -4.2134 -4.2134 -0.6030 -0.6030 -0.4900 -0.4808 -0.2019 -0.2019 1.8045 1.8045 1.8584 1.9541 1.9923 1.9923 2.5248 2.5248 2.8258 2.8258 2.8424 2.9421 3.1877 3.1877 3.3257 3.3377 5.6090 5.6090 7.0536 7.0536 7.8654 7.8654 8.0799 8.0876 8.0876 8.1075 8.3840 8.3840 k = 0.0811 0.1147 0.1986 ( 13169 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7340 -19.7339 -19.7339 -19.7338 -19.7271 -19.7271 -19.5661 -19.5661 -19.5556 -19.5555 -19.5555 -19.5554 -19.5468 -19.5468 -19.5467 -19.5466 -19.5432 -19.5432 -9.7387 -9.7387 -8.0772 -8.0772 -8.0111 -8.0111 -7.9947 -7.9946 -4.2138 -4.2138 -0.5960 -0.5960 -0.4844 -0.4747 -0.1440 -0.1440 1.8086 1.8086 1.8559 1.9557 2.0066 2.0066 2.4553 2.4553 2.7993 2.7993 2.8320 2.9315 3.1942 3.1942 3.3273 3.3445 5.6428 5.6428 7.0051 7.0051 7.8610 7.8610 8.0843 8.0863 8.0863 8.1110 8.3786 8.3786 k = 0.0878 0.1242 0.2152 ( 13172 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7339 -19.7338 -19.7338 -19.7337 -19.7272 -19.7272 -19.5659 -19.5659 -19.5556 -19.5555 -19.5555 -19.5554 -19.5469 -19.5469 -19.5467 -19.5466 -19.5432 -19.5432 -9.7289 -9.7289 -8.0894 -8.0894 -8.0148 -8.0148 -7.9980 -7.9979 -4.2139 -4.2139 -0.5887 -0.5887 -0.4780 -0.4679 -0.0832 -0.0832 1.8132 1.8132 1.8547 1.9578 2.0225 2.0225 2.3827 2.3827 2.7739 2.7739 2.8209 2.9192 3.2001 3.2001 3.3279 3.3504 5.6683 5.6683 6.9571 6.9571 7.8612 7.8612 8.0879 8.0890 8.0890 8.1117 8.3753 8.3753 k = 0.0946 0.1338 0.2317 ( 13172 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7338 -19.7338 -19.7338 -19.7336 -19.7273 -19.7273 -19.5657 -19.5657 -19.5556 -19.5556 -19.5556 -19.5554 -19.5470 -19.5470 -19.5467 -19.5467 -19.5433 -19.5433 -9.7187 -9.7187 -8.1019 -8.1019 -8.0186 -8.0186 -8.0015 -8.0014 -4.2138 -4.2138 -0.5809 -0.5809 -0.4710 -0.4605 -0.0205 -0.0205 1.8186 1.8186 1.8548 1.9605 2.0398 2.0398 2.3087 2.3087 2.7496 2.7496 2.8090 2.9054 3.2047 3.2047 3.3273 3.3549 5.6844 5.6844 6.9116 6.9116 7.8629 7.8629 8.0886 8.0975 8.0975 8.1069 8.3750 8.3750 k = 0.1014 0.1433 0.2483 ( 13178 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7338 -19.7337 -19.7337 -19.7335 -19.7274 -19.7274 -19.5655 -19.5655 -19.5557 -19.5557 -19.5557 -19.5555 -19.5470 -19.5470 -19.5467 -19.5467 -19.5434 -19.5434 -9.7082 -9.7082 -8.1144 -8.1144 -8.0226 -8.0226 -8.0053 -8.0052 -4.2133 -4.2133 -0.5727 -0.5727 -0.4632 -0.4525 0.0432 0.0432 1.8247 1.8247 1.8564 1.9640 2.0585 2.0585 2.2349 2.2349 2.7260 2.7260 2.7965 2.8903 3.2076 3.2076 3.3252 3.3575 5.6906 5.6906 6.8701 6.8701 7.8618 7.8618 8.0840 8.0935 8.1143 8.1143 8.3791 8.3791 k = 0.1081 0.1529 0.2648 ( 13166 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7337 -19.7336 -19.7336 -19.7335 -19.7275 -19.7275 -19.5653 -19.5653 -19.5557 -19.5557 -19.5557 -19.5555 -19.5470 -19.5470 -19.5467 -19.5467 -19.5435 -19.5435 -9.6975 -9.6975 -8.1267 -8.1267 -8.0267 -8.0267 -8.0092 -8.0091 -4.2125 -4.2125 -0.5639 -0.5639 -0.4547 -0.4439 0.1070 0.1070 1.8313 1.8313 1.8595 1.9682 2.0781 2.0782 2.1631 2.1631 2.7032 2.7032 2.7835 2.8744 3.2083 3.2083 3.3213 3.3578 5.6870 5.6870 6.8333 6.8333 7.8534 7.8534 8.0693 8.0712 8.1420 8.1420 8.3889 8.3889 k = 0.1149 0.1624 0.2814 ( 13175 PWs) bands (ev): -47.6915 -47.6915 -47.6908 -47.6908 -47.6908 -47.6908 -19.7336 -19.7336 -19.7336 -19.7334 -19.7277 -19.7277 -19.5651 -19.5651 -19.5558 -19.5558 -19.5558 -19.5556 -19.5471 -19.5471 -19.5467 -19.5467 -19.5436 -19.5436 -9.6868 -9.6868 -8.1387 -8.1387 -8.0311 -8.0311 -8.0134 -8.0133 -4.2114 -4.2114 -0.5546 -0.5546 -0.4454 -0.4345 0.1696 0.1696 1.8381 1.8381 1.8641 1.9734 2.0855 2.0855 2.1084 2.1084 2.6809 2.6810 2.7700 2.8577 3.2064 3.2064 3.3154 3.3556 5.6744 5.6744 6.8014 6.8014 7.8352 7.8352 8.0345 8.0478 8.1819 8.1819 8.4053 8.4053 k = 0.1216 0.1720 0.2979 ( 13169 PWs) bands (ev): -47.6914 -47.6914 -47.6908 -47.6908 -47.6908 -47.6908 -19.7335 -19.7335 -19.7335 -19.7333 -19.7278 -19.7278 -19.5648 -19.5648 -19.5559 -19.5558 -19.5558 -19.5557 -19.5471 -19.5471 -19.5467 -19.5467 -19.5437 -19.5437 -9.6761 -9.6761 -8.1502 -8.1502 -8.0356 -8.0356 -8.0178 -8.0177 -4.2100 -4.2100 -0.5446 -0.5446 -0.4354 -0.4245 0.2295 0.2295 1.8443 1.8443 1.8703 1.9794 2.0282 2.0282 2.1254 2.1254 2.6594 2.6594 2.7562 2.8405 3.2018 3.2018 3.3071 3.3505 5.6543 5.6543 6.7743 6.7743 7.8068 7.8068 7.9905 8.0133 8.2334 8.2334 8.4287 8.4287 k = 0.1284 0.1816 0.3145 ( 13157 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6909 -47.6909 -19.7334 -19.7334 -19.7334 -19.7332 -19.7280 -19.7280 -19.5646 -19.5646 -19.5559 -19.5559 -19.5559 -19.5557 -19.5472 -19.5472 -19.5467 -19.5467 -19.5437 -19.5437 -9.6655 -9.6655 -8.1609 -8.1609 -8.0403 -8.0403 -8.0224 -8.0223 -4.2083 -4.2083 -0.5340 -0.5340 -0.4245 -0.4137 0.2851 0.2851 1.8474 1.8474 1.8779 1.9752 1.9752 1.9863 2.1491 2.1491 2.6384 2.6384 2.7423 2.8229 3.1943 3.1943 3.2964 3.3422 5.6283 5.6283 6.7514 6.7514 7.7694 7.7694 7.9396 7.9688 8.2947 8.2947 8.4593 8.4593 k = 0.1351 0.1911 0.3310 ( 13166 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6909 -47.6909 -19.7334 -19.7333 -19.7333 -19.7331 -19.7282 -19.7282 -19.5643 -19.5643 -19.5560 -19.5560 -19.5560 -19.5558 -19.5473 -19.5473 -19.5467 -19.5467 -19.5439 -19.5439 -9.6552 -9.6552 -8.1708 -8.1708 -8.0451 -8.0451 -8.0272 -8.0271 -4.2063 -4.2063 -0.5227 -0.5227 -0.4128 -0.4022 0.3345 0.3345 1.8414 1.8414 1.8870 1.9393 1.9393 1.9941 2.1743 2.1743 2.6181 2.6181 2.7284 2.8052 3.1838 3.1838 3.2830 3.3307 5.5983 5.5983 6.7319 6.7319 7.7245 7.7245 7.8835 7.9163 8.3636 8.3636 8.4969 8.4969 k = 0.1419 0.2007 0.3476 ( 13160 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6909 -47.6909 -19.7333 -19.7332 -19.7332 -19.7330 -19.7283 -19.7283 -19.5640 -19.5640 -19.5561 -19.5561 -19.5561 -19.5559 -19.5473 -19.5473 -19.5467 -19.5467 -19.5440 -19.5440 -9.6452 -9.6452 -8.1797 -8.1797 -8.0501 -8.0501 -8.0321 -8.0320 -4.2040 -4.2040 -0.5106 -0.5106 -0.4002 -0.3899 0.3758 0.3758 1.8219 1.8219 1.8975 1.9271 1.9271 2.0027 2.2007 2.2007 2.5986 2.5986 2.7146 2.7874 3.1702 3.1702 3.2670 3.3159 5.5661 5.5661 6.7154 6.7154 7.6739 7.6739 7.8237 7.8580 8.4375 8.4375 8.5414 8.5414 k = 0.1486 0.2102 0.3641 ( 13175 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6909 -47.6909 -19.7332 -19.7331 -19.7331 -19.7329 -19.7285 -19.7285 -19.5637 -19.5637 -19.5563 -19.5563 -19.5562 -19.5560 -19.5473 -19.5473 -19.5467 -19.5467 -19.5441 -19.5441 -9.6357 -9.6357 -8.1874 -8.1874 -8.0553 -8.0553 -8.0372 -8.0371 -4.2015 -4.2015 -0.4978 -0.4978 -0.3868 -0.3768 0.4069 0.4069 1.7983 1.7983 1.9094 1.9311 1.9311 2.0121 2.2281 2.2281 2.5797 2.5797 2.7009 2.7697 3.1535 3.1535 3.2482 3.2977 5.5332 5.5332 6.7013 6.7013 7.6190 7.6190 7.7614 7.7957 8.5137 8.5137 8.5936 8.5936 k = 0.1554 0.2198 0.3807 ( 13160 PWs) bands (ev): -47.6914 -47.6914 -47.6909 -47.6909 -47.6909 -47.6909 -19.7330 -19.7330 -19.7330 -19.7328 -19.7287 -19.7287 -19.5634 -19.5634 -19.5564 -19.5564 -19.5562 -19.5561 -19.5474 -19.5474 -19.5467 -19.5466 -19.5442 -19.5442 -9.6267 -9.6267 -8.1938 -8.1938 -8.0606 -8.0606 -8.0425 -8.0424 -4.1988 -4.1988 -0.4842 -0.4842 -0.3726 -0.3629 0.4260 0.4260 1.7809 1.7809 1.9226 1.9422 1.9422 2.0223 2.2565 2.2565 2.5617 2.5617 2.6874 2.7521 3.1338 3.1338 3.2266 3.2761 5.5009 5.5009 6.6893 6.6893 7.5611 7.5611 7.6978 7.7307 8.5879 8.5879 8.6549 8.6549 k = 0.1622 0.2293 0.3972 ( 13145 PWs) bands (ev): -47.6913 -47.6913 -47.6909 -47.6909 -47.6909 -47.6909 -19.7329 -19.7329 -19.7329 -19.7327 -19.7288 -19.7288 -19.5631 -19.5631 -19.5565 -19.5565 -19.5563 -19.5562 -19.5473 -19.5473 -19.5467 -19.5466 -19.5443 -19.5443 -9.6183 -9.6183 -8.1988 -8.1988 -8.0660 -8.0660 -8.0478 -8.0478 -4.1960 -4.1960 -0.4699 -0.4699 -0.3575 -0.3483 0.4322 0.4322 1.7741 1.7741 1.9370 1.9570 1.9570 2.0331 2.2857 2.2857 2.5446 2.5446 2.6742 2.7347 3.1113 3.1113 3.2025 3.2513 5.4704 5.4704 6.6795 6.6795 7.5014 7.5014 7.6336 7.6645 8.6570 8.6570 8.7261 8.7261 k = 0.1689 0.2389 0.4138 ( 13157 PWs) bands (ev): -47.6913 -47.6913 -47.6909 -47.6909 -47.6909 -47.6909 -19.7328 -19.7328 -19.7328 -19.7326 -19.7290 -19.7290 -19.5628 -19.5628 -19.5566 -19.5566 -19.5565 -19.5563 -19.5474 -19.5474 -19.5466 -19.5466 -19.5444 -19.5444 -9.6106 -9.6106 -8.2024 -8.2024 -8.0715 -8.0715 -8.0534 -8.0533 -4.1930 -4.1930 -0.4549 -0.4549 -0.3415 -0.3328 0.4253 0.4253 1.7790 1.7790 1.9526 1.9741 1.9741 2.0446 2.3154 2.3154 2.5285 2.5285 2.6613 2.7175 3.0861 3.0861 3.1758 3.2235 5.4424 5.4424 6.6717 6.6717 7.4409 7.4409 7.5696 7.5980 8.7218 8.7218 8.7914 8.8018 k = 0.1757 0.2484 0.4303 ( 13169 PWs) bands (ev): -47.6913 -47.6913 -47.6909 -47.6909 -47.6909 -47.6909 -19.7327 -19.7327 -19.7327 -19.7325 -19.7293 -19.7293 -19.5625 -19.5625 -19.5568 -19.5568 -19.5566 -19.5564 -19.5474 -19.5474 -19.5466 -19.5466 -19.5446 -19.5446 -9.6036 -9.6036 -8.2044 -8.2044 -8.0771 -8.0771 -8.0590 -8.0589 -4.1900 -4.1900 -0.4391 -0.4391 -0.3247 -0.3166 0.4061 0.4061 1.7949 1.7949 1.9693 1.9930 1.9930 2.0565 2.3455 2.3455 2.5135 2.5135 2.6485 2.7004 3.0585 3.0585 3.1469 3.1928 5.4176 5.4176 6.6663 6.6663 7.3806 7.3806 7.5066 7.5321 8.7845 8.7845 8.8544 8.8681 k = 0.1824 0.2580 0.4469 ( 13184 PWs) bands (ev): -47.6913 -47.6913 -47.6909 -47.6909 -47.6909 -47.6909 -19.7326 -19.7326 -19.7326 -19.7324 -19.7295 -19.7295 -19.5621 -19.5621 -19.5569 -19.5569 -19.5567 -19.5566 -19.5474 -19.5474 -19.5466 -19.5465 -19.5447 -19.5447 -9.5974 -9.5974 -8.2048 -8.2048 -8.0827 -8.0827 -8.0647 -8.0646 -4.1871 -4.1871 -0.4226 -0.4226 -0.3070 -0.2996 0.3761 0.3761 1.8199 1.8199 1.9868 2.0136 2.0136 2.0689 2.3754 2.3754 2.5001 2.5001 2.6357 2.6833 3.0288 3.0288 3.1161 3.1596 5.3962 5.3962 6.6634 6.6634 7.3212 7.3212 7.4450 7.4675 8.8459 8.8459 8.9185 8.9351 k = 0.1892 0.2676 0.4634 ( 13163 PWs) bands (ev): -47.6912 -47.6912 -47.6909 -47.6909 -47.6909 -47.6909 -19.7325 -19.7325 -19.7325 -19.7323 -19.7296 -19.7296 -19.5618 -19.5618 -19.5571 -19.5571 -19.5568 -19.5567 -19.5474 -19.5474 -19.5465 -19.5465 -19.5448 -19.5448 -9.5920 -9.5920 -8.2037 -8.2037 -8.0884 -8.0884 -8.0704 -8.0704 -4.1841 -4.1841 -0.4055 -0.4055 -0.2885 -0.2818 0.3375 0.3375 1.8518 1.8518 2.0052 2.0359 2.0359 2.0816 2.4035 2.4035 2.4897 2.4897 2.6227 2.6662 2.9975 2.9975 3.0837 3.1243 5.3784 5.3784 6.6635 6.6635 7.2636 7.2636 7.3854 7.4048 8.9057 8.9057 8.9826 9.0016 k = 0.1959 0.2771 0.4800 ( 13157 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6910 -47.6910 -19.7324 -19.7324 -19.7324 -19.7322 -19.7298 -19.7298 -19.5615 -19.5615 -19.5572 -19.5572 -19.5570 -19.5569 -19.5474 -19.5474 -19.5465 -19.5464 -19.5449 -19.5449 -9.5874 -9.5874 -8.2011 -8.2011 -8.0941 -8.0941 -8.0763 -8.0762 -4.1813 -4.1813 -0.3878 -0.3878 -0.2693 -0.2632 0.2922 0.2922 1.8880 1.8880 2.0243 2.0598 2.0598 2.0945 2.4254 2.4254 2.4865 2.4865 2.6093 2.6486 2.9652 2.9652 3.0502 3.0874 5.3642 5.3642 6.6668 6.6668 7.2084 7.2084 7.3283 7.3446 8.9629 8.9629 9.0454 9.0661 k = 0.2027 0.2867 0.4965 ( 13163 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6910 -47.6910 -19.7323 -19.7323 -19.7323 -19.7321 -19.7300 -19.7300 -19.5611 -19.5611 -19.5574 -19.5574 -19.5571 -19.5570 -19.5473 -19.5473 -19.5464 -19.5464 -19.5451 -19.5451 -9.5836 -9.5836 -8.1971 -8.1971 -8.0998 -8.0998 -8.0822 -8.0821 -4.1787 -4.1787 -0.3695 -0.3695 -0.2492 -0.2439 0.2423 0.2423 1.9260 1.9260 2.0438 2.0850 2.0850 2.1074 2.4328 2.4328 2.4986 2.4986 2.5951 2.6304 2.9326 2.9326 3.0163 3.0495 5.3534 5.3534 6.6737 6.6737 7.1564 7.1564 7.2740 7.2874 9.0163 9.0163 9.1054 9.1270 k = 0.2095 0.2962 0.5131 ( 13163 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6910 -47.6910 -19.7322 -19.7322 -19.7321 -19.7320 -19.7302 -19.7302 -19.5607 -19.5607 -19.5575 -19.5575 -19.5573 -19.5572 -19.5473 -19.5473 -19.5464 -19.5463 -19.5452 -19.5452 -9.5806 -9.5806 -8.1917 -8.1917 -8.1055 -8.1055 -8.0881 -8.0880 -4.1763 -4.1763 -0.3509 -0.3509 -0.2285 -0.2239 0.1896 0.1896 1.9638 1.9639 2.0637 2.1111 2.1111 2.1201 2.4288 2.4288 2.5230 2.5230 2.5797 2.6111 2.9005 2.9005 2.9826 3.0113 5.3456 5.3456 6.6844 6.6844 7.1084 7.1084 7.2230 7.2336 9.0646 9.0646 9.1611 9.1827 k = 0.2162 0.3058 0.5296 ( 13163 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6910 -47.6910 -19.7321 -19.7321 -19.7320 -19.7319 -19.7304 -19.7304 -19.5604 -19.5604 -19.5577 -19.5577 -19.5574 -19.5574 -19.5473 -19.5473 -19.5463 -19.5463 -19.5453 -19.5453 -9.5782 -9.5782 -8.1851 -8.1851 -8.1110 -8.1110 -8.0940 -8.0939 -4.1741 -4.1741 -0.3321 -0.3321 -0.2070 -0.2032 0.1358 0.1358 2.0001 2.0001 2.0837 2.1324 2.1367 2.1367 2.4220 2.4220 2.5511 2.5511 2.5627 2.5903 2.8703 2.8703 2.9499 2.9736 5.3404 5.3404 6.6987 6.6987 7.0653 7.0653 7.1755 7.1835 9.1066 9.1066 9.2112 9.2316 k = 0.2230 0.3153 0.5462 ( 13157 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7320 -19.7320 -19.7319 -19.7318 -19.7306 -19.7306 -19.5600 -19.5600 -19.5579 -19.5579 -19.5576 -19.5575 -19.5473 -19.5473 -19.5462 -19.5462 -19.5455 -19.5455 -9.5764 -9.5764 -8.1776 -8.1776 -8.1163 -8.1163 -8.0999 -8.0998 -4.1723 -4.1723 -0.3134 -0.3134 -0.1849 -0.1818 0.0822 0.0822 2.0339 2.0339 2.1033 2.1439 2.1591 2.1591 2.4169 2.4169 2.5438 2.5676 2.5789 2.5789 2.8437 2.8437 2.9190 2.9375 5.3373 5.3373 6.7161 6.7161 7.0284 7.0284 7.1317 7.1375 9.1411 9.1411 9.2542 9.2722 k = 0.2297 0.3249 0.5627 ( 13154 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7318 -19.7318 -19.7317 -19.7317 -19.7309 -19.7309 -19.5596 -19.5596 -19.5581 -19.5581 -19.5578 -19.5577 -19.5472 -19.5472 -19.5462 -19.5461 -19.5456 -19.5456 -9.5752 -9.5752 -8.1695 -8.1695 -8.1211 -8.1211 -8.1057 -8.1057 -4.1708 -4.1708 -0.2954 -0.2954 -0.1621 -0.1599 0.0305 0.0305 2.0653 2.0653 2.1221 2.1538 2.1748 2.1748 2.4165 2.4165 2.5231 2.5426 2.6038 2.6038 2.8230 2.8230 2.8906 2.9038 5.3357 5.3357 6.7349 6.7349 6.9999 6.9999 7.0920 7.0957 9.1676 9.1676 9.2891 9.3036 k = 0.2365 0.3344 0.5793 ( 13142 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7317 -19.7317 -19.7316 -19.7316 -19.7311 -19.7311 -19.5593 -19.5593 -19.5582 -19.5582 -19.5579 -19.5579 -19.5472 -19.5472 -19.5461 -19.5460 -19.5457 -19.5457 -9.5745 -9.5745 -8.1616 -8.1616 -8.1248 -8.1248 -8.1116 -8.1115 -4.1698 -4.1698 -0.2790 -0.2790 -0.1388 -0.1373 -0.0176 -0.0176 2.0943 2.0943 2.1392 2.1613 2.1799 2.1799 2.4234 2.4234 2.5010 2.5154 2.6229 2.6229 2.8114 2.8114 2.8654 2.8735 5.3350 5.3350 6.7524 6.7524 6.9830 6.9830 7.0564 7.0585 9.1859 9.1859 9.3153 9.3254 k = 0.2432 0.3440 0.5958 ( 13148 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7316 -19.7316 -19.7315 -19.7315 -19.7313 -19.7313 -19.5590 -19.5590 -19.5583 -19.5583 -19.5581 -19.5581 -19.5472 -19.5472 -19.5460 -19.5460 -19.5458 -19.5458 -9.5741 -9.5741 -8.1554 -8.1554 -8.1262 -8.1262 -8.1173 -8.1173 -4.1691 -4.1691 -0.2663 -0.2663 -0.1150 -0.1143 -0.0594 -0.0594 2.1207 2.1207 2.1533 2.1648 2.1731 2.1731 2.4382 2.4382 2.4789 2.4869 2.6339 2.6339 2.8120 2.8120 2.8435 2.8471 5.3349 5.3349 6.7643 6.7643 6.9816 6.9816 7.0251 7.0259 9.1962 9.1962 9.3324 9.3376 k = 0.2500 0.3536 0.6124 ( 13172 PWs) bands (ev): -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -19.7316 -19.7316 -19.7314 -19.7314 -19.7314 -19.7314 -19.5589 -19.5589 -19.5583 -19.5583 -19.5583 -19.5583 -19.5472 -19.5472 -19.5459 -19.5459 -19.5459 -19.5459 -9.5740 -9.5740 -8.1531 -8.1531 -8.1230 -8.1230 -8.1230 -8.1230 -4.1689 -4.1689 -0.2610 -0.2610 -0.0907 -0.0907 -0.0907 -0.0907 2.1377 2.1377 2.1624 2.1624 2.1624 2.1624 2.4588 2.4588 2.4588 2.4588 2.6369 2.6369 2.8250 2.8250 2.8250 2.8250 5.3350 5.3350 6.7682 6.7682 6.9981 6.9981 6.9981 6.9981 9.1994 9.1994 9.3407 9.3407 k = 0.2500 0.3536 0.6124 ( 13172 PWs) bands (ev): -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -19.7316 -19.7316 -19.7314 -19.7314 -19.7314 -19.7314 -19.5589 -19.5589 -19.5583 -19.5583 -19.5583 -19.5583 -19.5472 -19.5472 -19.5459 -19.5459 -19.5459 -19.5459 -9.5740 -9.5740 -8.1531 -8.1531 -8.1230 -8.1230 -8.1230 -8.1230 -4.1689 -4.1689 -0.2610 -0.2610 -0.0907 -0.0907 -0.0907 -0.0907 2.1377 2.1377 2.1624 2.1624 2.1624 2.1624 2.4588 2.4588 2.4588 2.4588 2.6369 2.6369 2.8250 2.8250 2.8250 2.8250 5.3350 5.3350 6.7682 6.7682 6.9981 6.9981 6.9981 6.9981 9.1994 9.1994 9.3407 9.3407 k = 0.2568 0.3344 0.6124 ( 13154 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6910 -47.6910 -19.7317 -19.7317 -19.7314 -19.7314 -19.7313 -19.7313 -19.5589 -19.5589 -19.5585 -19.5585 -19.5580 -19.5580 -19.5472 -19.5472 -19.5460 -19.5460 -19.5458 -19.5458 -9.5741 -9.5741 -8.1547 -8.1547 -8.1286 -8.1286 -8.1156 -8.1156 -4.1691 -4.1691 -0.2675 -0.2675 -0.1064 -0.1064 -0.0666 -0.0660 2.1175 2.1175 2.1517 2.1634 2.1777 2.1777 2.4343 2.4433 2.4823 2.4823 2.6353 2.6353 2.8073 2.8097 2.8475 2.8475 5.3349 5.3349 6.7654 6.7654 6.9752 6.9756 7.0304 7.0304 9.1966 9.1966 9.3355 9.3369 k = 0.2635 0.3153 0.6124 ( 13148 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6910 -47.6910 -19.7319 -19.7319 -19.7313 -19.7313 -19.7312 -19.7312 -19.5591 -19.5591 -19.5586 -19.5586 -19.5577 -19.5577 -19.5472 -19.5472 -19.5460 -19.5460 -19.5457 -19.5457 -9.5742 -9.5742 -8.1584 -8.1584 -8.1341 -8.1341 -8.1059 -8.1059 -4.1698 -4.1698 -0.2861 -0.2861 -0.1060 -0.1060 -0.0422 -0.0409 2.0815 2.0815 2.1313 2.1529 2.2000 2.2000 2.4169 2.4342 2.5059 2.5059 2.6330 2.6330 2.7939 2.7975 2.8758 2.8758 5.3344 5.3344 6.7595 6.7595 6.9570 6.9575 7.0737 7.0737 9.1891 9.1891 9.3230 9.3293 k = 0.2703 0.2962 0.6124 ( 13157 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6910 -47.6910 -19.7321 -19.7321 -19.7312 -19.7312 -19.7312 -19.7311 -19.5593 -19.5593 -19.5589 -19.5588 -19.5573 -19.5573 -19.5473 -19.5473 -19.5460 -19.5460 -19.5457 -19.5456 -9.5743 -9.5743 -8.1628 -8.1628 -8.1395 -8.1395 -8.0956 -8.0956 -4.1709 -4.1709 -0.3114 -0.3114 -0.0945 -0.0945 -0.0174 -0.0154 2.0387 2.0387 2.1011 2.1292 2.2216 2.2216 2.4085 2.4321 2.5277 2.5277 2.6329 2.6329 2.7846 2.7879 2.9076 2.9076 5.3337 5.3337 6.7536 6.7536 6.9437 6.9438 7.1236 7.1236 9.1779 9.1779 9.3042 9.3180 k = 0.2770 0.2771 0.6124 ( 13157 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6909 -47.6909 -19.7323 -19.7323 -19.7311 -19.7311 -19.7311 -19.7310 -19.5594 -19.5594 -19.5591 -19.5590 -19.5569 -19.5569 -19.5474 -19.5474 -19.5460 -19.5460 -19.5456 -19.5455 -9.5743 -9.5743 -8.1674 -8.1674 -8.1448 -8.1448 -8.0852 -8.0852 -4.1724 -4.1724 -0.3381 -0.3381 -0.0770 -0.0770 0.0078 0.0103 1.9912 1.9912 2.0624 2.0934 2.2414 2.2414 2.4083 2.4357 2.5462 2.5462 2.6367 2.6367 2.7797 2.7811 2.9415 2.9415 5.3326 5.3326 6.7494 6.7494 6.9344 6.9351 7.1765 7.1765 9.1638 9.1638 9.2803 9.2974 k = 0.2838 0.2580 0.6124 ( 13175 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6909 -47.6909 -19.7325 -19.7325 -19.7311 -19.7311 -19.7310 -19.7309 -19.5597 -19.5597 -19.5593 -19.5592 -19.5566 -19.5566 -19.5475 -19.5475 -19.5460 -19.5460 -19.5455 -19.5455 -9.5741 -9.5741 -8.1722 -8.1722 -8.1499 -8.1499 -8.0751 -8.0751 -4.1743 -4.1743 -0.3632 -0.3632 -0.0561 -0.0561 0.0333 0.0362 1.9402 1.9402 2.0172 2.0484 2.2586 2.2586 2.4130 2.4429 2.5615 2.5615 2.6449 2.6449 2.7771 2.7791 2.9765 2.9765 5.3312 5.3312 6.7477 6.7477 6.9291 6.9311 7.2295 7.2295 9.1470 9.1470 9.2522 9.2721 k = 0.2905 0.2389 0.6124 ( 13181 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6909 -47.6909 -19.7327 -19.7327 -19.7310 -19.7310 -19.7309 -19.7308 -19.5599 -19.5599 -19.5595 -19.5594 -19.5562 -19.5562 -19.5476 -19.5476 -19.5460 -19.5460 -19.5454 -19.5454 -9.5736 -9.5736 -8.1769 -8.1769 -8.1549 -8.1548 -8.0656 -8.0656 -4.1766 -4.1766 -0.3852 -0.3852 -0.0333 -0.0333 0.0590 0.0624 1.8866 1.8866 1.9674 1.9973 2.2726 2.2726 2.4195 2.4518 2.5749 2.5749 2.6564 2.6564 2.7764 2.7833 3.0121 3.0121 5.3298 5.3298 6.7491 6.7491 6.9278 6.9314 7.2799 7.2799 9.1274 9.1274 9.2212 9.2432 k = 0.2973 0.2198 0.6124 ( 13169 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6909 -47.6909 -19.7329 -19.7329 -19.7309 -19.7309 -19.7308 -19.7307 -19.5600 -19.5600 -19.5597 -19.5596 -19.5559 -19.5559 -19.5477 -19.5477 -19.5459 -19.5459 -19.5453 -19.5453 -9.5728 -9.5728 -8.1815 -8.1815 -8.1597 -8.1596 -8.0569 -8.0569 -4.1791 -4.1791 -0.4032 -0.4032 -0.0092 -0.0092 0.0850 0.0886 1.8310 1.8310 1.9142 1.9421 2.2825 2.2825 2.4255 2.4604 2.5882 2.5882 2.6697 2.6697 2.7795 2.7925 3.0481 3.0481 5.3284 5.3284 6.7536 6.7536 6.9302 6.9359 7.3252 7.3252 9.1051 9.1051 9.1883 9.2117 k = 0.3041 0.2007 0.6124 ( 13163 PWs) bands (ev): -47.6911 -47.6911 -47.6911 -47.6911 -47.6909 -47.6909 -19.7330 -19.7330 -19.7308 -19.7308 -19.7308 -19.7306 -19.5602 -19.5602 -19.5599 -19.5598 -19.5555 -19.5555 -19.5479 -19.5479 -19.5458 -19.5458 -19.5452 -19.5452 -9.5715 -9.5715 -8.1860 -8.1860 -8.1643 -8.1643 -8.0492 -8.0492 -4.1819 -4.1819 -0.4167 -0.4167 0.0157 0.0157 0.1112 0.1150 1.7742 1.7742 1.8590 1.8844 2.2879 2.2879 2.4293 2.4671 2.6026 2.6026 2.6839 2.6839 2.7871 2.8071 3.0842 3.0842 5.3272 5.3272 6.7611 6.7611 6.9359 6.9441 7.3634 7.3634 9.0807 9.0807 9.1546 9.1789 k = 0.3108 0.1816 0.6124 ( 13172 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6908 -47.6908 -19.7332 -19.7332 -19.7307 -19.7307 -19.7307 -19.7306 -19.5604 -19.5604 -19.5601 -19.5600 -19.5552 -19.5552 -19.5480 -19.5480 -19.5457 -19.5457 -19.5452 -19.5451 -9.5697 -9.5697 -8.1904 -8.1904 -8.1688 -8.1687 -8.0427 -8.0427 -4.1849 -4.1849 -0.4253 -0.4253 0.0413 0.0413 0.1375 0.1415 1.7166 1.7166 1.8023 1.8252 2.2886 2.2886 2.4299 2.4706 2.6177 2.6177 2.6992 2.6992 2.7999 2.8269 3.1202 3.1202 5.3264 5.3264 6.7714 6.7714 6.9448 6.9557 7.3929 7.3929 9.0551 9.0551 9.1211 9.1458 k = 0.3176 0.1624 0.6124 ( 13172 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6908 -47.6908 -19.7334 -19.7334 -19.7307 -19.7307 -19.7306 -19.7305 -19.5606 -19.5606 -19.5603 -19.5602 -19.5548 -19.5548 -19.5482 -19.5482 -19.5456 -19.5456 -19.5451 -19.5450 -9.5674 -9.5674 -8.1946 -8.1946 -8.1730 -8.1730 -8.0374 -8.0374 -4.1880 -4.1880 -0.4290 -0.4290 0.0673 0.0673 0.1640 0.1680 1.6585 1.6585 1.7450 1.7652 2.2848 2.2848 2.4270 2.4700 2.6318 2.6318 2.7168 2.7168 2.8182 2.8519 3.1560 3.1560 5.3259 5.3259 6.7841 6.7841 6.9563 6.9704 7.4124 7.4124 9.0295 9.0295 9.0887 9.1135 k = 0.3243 0.1433 0.6124 ( 13181 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6908 -47.6908 -19.7336 -19.7336 -19.7306 -19.7306 -19.7306 -19.7304 -19.5607 -19.5607 -19.5605 -19.5604 -19.5545 -19.5545 -19.5483 -19.5483 -19.5455 -19.5455 -19.5450 -19.5449 -9.5645 -9.5645 -8.1986 -8.1986 -8.1771 -8.1771 -8.0335 -8.0335 -4.1912 -4.1912 -0.4276 -0.4276 0.0937 0.0937 0.1907 0.1946 1.6005 1.6005 1.6874 1.7050 2.2768 2.2768 2.4206 2.4651 2.6425 2.6425 2.7385 2.7385 2.8419 2.8815 3.1914 3.1914 5.3258 5.3258 6.7988 6.7988 6.9700 6.9874 7.4217 7.4217 9.0049 9.0049 9.0585 9.0829 k = 0.3311 0.1242 0.6124 ( 13201 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6908 -47.6908 -19.7338 -19.7338 -19.7306 -19.7306 -19.7305 -19.7304 -19.5609 -19.5609 -19.5607 -19.5606 -19.5542 -19.5542 -19.5485 -19.5485 -19.5455 -19.5455 -19.5449 -19.5448 -9.5611 -9.5611 -8.2025 -8.2025 -8.1810 -8.1809 -8.0311 -8.0311 -4.1943 -4.1943 -0.4211 -0.4211 0.1203 0.1203 0.2174 0.2211 1.5427 1.5427 1.6300 1.6449 2.2652 2.2652 2.4109 2.4561 2.6480 2.6480 2.7654 2.7654 2.8706 2.9152 3.2263 3.2263 5.3260 5.3260 6.8150 6.8150 6.9854 7.0064 7.4207 7.4207 8.9825 8.9825 9.0312 9.0551 k = 0.3378 0.1051 0.6124 ( 13189 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6908 -47.6908 -19.7339 -19.7339 -19.7305 -19.7305 -19.7305 -19.7303 -19.5611 -19.5611 -19.5608 -19.5607 -19.5538 -19.5538 -19.5487 -19.5487 -19.5453 -19.5453 -19.5448 -19.5447 -9.5570 -9.5570 -8.2062 -8.2062 -8.1847 -8.1846 -8.0303 -8.0303 -4.1973 -4.1973 -0.4094 -0.4094 0.1472 0.1472 0.2441 0.2476 1.4856 1.4856 1.5731 1.5855 2.2504 2.2504 2.3982 2.4433 2.6482 2.6482 2.7973 2.7973 2.9036 2.9523 3.2607 3.2607 5.3263 5.3264 6.8321 6.8321 7.0020 7.0268 7.4104 7.4104 8.9632 8.9632 9.0076 9.0308 k = 0.3446 0.0860 0.6124 ( 13186 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6907 -47.6907 -19.7341 -19.7341 -19.7304 -19.7304 -19.7304 -19.7302 -19.5612 -19.5612 -19.5610 -19.5609 -19.5535 -19.5535 -19.5488 -19.5488 -19.5452 -19.5452 -19.5448 -19.5447 -9.5522 -9.5522 -8.2097 -8.2097 -8.1882 -8.1881 -8.0309 -8.0309 -4.2002 -4.2002 -0.3927 -0.3927 0.1743 0.1743 0.2710 0.2739 1.4293 1.4293 1.5170 1.5269 2.2328 2.2328 2.3830 2.4272 2.6433 2.6433 2.8330 2.8330 2.9403 2.9922 3.2944 3.2944 5.3266 5.3266 6.8496 6.8496 7.0192 7.0478 7.3917 7.3917 8.9478 8.9478 8.9886 9.0109 k = 0.3514 0.0669 0.6124 ( 13177 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6907 -47.6907 -19.7342 -19.7342 -19.7303 -19.7303 -19.7303 -19.7301 -19.5614 -19.5614 -19.5612 -19.5611 -19.5532 -19.5532 -19.5489 -19.5489 -19.5451 -19.5451 -19.5447 -19.5446 -9.5469 -9.5469 -8.2130 -8.2130 -8.1915 -8.1914 -8.0332 -8.0332 -4.2029 -4.2029 -0.3709 -0.3709 0.2015 0.2015 0.2978 0.3002 1.3741 1.3741 1.4620 1.4695 2.2128 2.2128 2.3654 2.4084 2.6339 2.6339 2.8717 2.8717 2.9800 3.0345 3.3274 3.3274 5.3264 5.3264 6.8667 6.8667 7.0364 7.0688 7.3662 7.3662 8.9372 8.9372 8.9747 8.9962 k = 0.3581 0.0478 0.6124 ( 13168 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6907 -47.6907 -19.7344 -19.7344 -19.7303 -19.7302 -19.7302 -19.7301 -19.5615 -19.5615 -19.5613 -19.5612 -19.5529 -19.5529 -19.5491 -19.5491 -19.5450 -19.5450 -19.5446 -19.5445 -9.5409 -9.5409 -8.2161 -8.2161 -8.1946 -8.1945 -8.0370 -8.0370 -4.2054 -4.2054 -0.3443 -0.3443 0.2289 0.2289 0.3246 0.3263 1.3201 1.3201 1.4083 1.4134 2.1908 2.1908 2.3460 2.3872 2.6203 2.6203 2.9126 2.9126 3.0222 3.0787 3.3596 3.3596 5.3253 5.3253 6.8828 6.8828 7.0530 7.0891 7.3357 7.3357 8.9320 8.9320 8.9666 8.9873 k = 0.3649 0.0287 0.6124 ( 13198 PWs) bands (ev): -47.6912 -47.6912 -47.6912 -47.6912 -47.6907 -47.6907 -19.7346 -19.7346 -19.7303 -19.7302 -19.7302 -19.7301 -19.5617 -19.5617 -19.5615 -19.5614 -19.5526 -19.5526 -19.5493 -19.5493 -19.5449 -19.5449 -19.5445 -19.5444 -9.5343 -9.5343 -8.2190 -8.2190 -8.1975 -8.1974 -8.0423 -8.0423 -4.2075 -4.2075 -0.3129 -0.3129 0.2563 0.2563 0.3513 0.3521 1.2677 1.2677 1.3562 1.3588 2.1670 2.1670 2.3248 2.3642 2.6029 2.6029 2.9550 2.9550 3.0664 3.1242 3.3910 3.3910 5.3228 5.3228 6.8972 6.8972 7.0686 7.1082 7.3018 7.3018 8.9327 8.9327 8.9649 8.9848 k = 0.3716 0.0096 0.6124 ( 13228 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6907 -47.6907 -19.7347 -19.7347 -19.7303 -19.7302 -19.7302 -19.7300 -19.5619 -19.5619 -19.5617 -19.5616 -19.5524 -19.5524 -19.5494 -19.5494 -19.5449 -19.5449 -19.5445 -19.5444 -9.5272 -9.5272 -8.2218 -8.2218 -8.2002 -8.2001 -8.0490 -8.0490 -4.2094 -4.2094 -0.2771 -0.2771 0.2837 0.2837 0.3777 0.3779 1.2169 1.2169 1.3058 1.3060 2.1417 2.1417 2.3023 2.3395 2.5817 2.5817 2.9985 2.9985 3.1120 3.1708 3.4215 3.4215 5.3184 5.3184 6.9091 6.9091 7.0826 7.1255 7.2665 7.2665 8.9398 8.9398 8.9698 8.9892 k = 0.3784-0.0096 0.6124 ( 13222 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6907 -47.6907 -19.7348 -19.7348 -19.7302 -19.7302 -19.7302 -19.7300 -19.5620 -19.5620 -19.5618 -19.5617 -19.5521 -19.5521 -19.5496 -19.5496 -19.5448 -19.5448 -19.5444 -19.5443 -9.5194 -9.5194 -8.2244 -8.2244 -8.2027 -8.2026 -8.0571 -8.0571 -4.2110 -4.2110 -0.2369 -0.2369 0.3111 0.3111 0.4030 0.4043 1.1680 1.1680 1.2551 1.2573 2.1151 2.1151 2.2786 2.3135 2.5570 2.5570 3.0426 3.0426 3.1588 3.2180 3.4510 3.4510 5.3115 5.3115 6.9181 6.9181 7.0947 7.1403 7.2317 7.2317 8.9535 8.9535 8.9818 9.0008 k = 0.3851-0.0287 0.6124 ( 13216 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7349 -19.7349 -19.7302 -19.7301 -19.7301 -19.7300 -19.5621 -19.5621 -19.5620 -19.5619 -19.5518 -19.5518 -19.5497 -19.5497 -19.5446 -19.5446 -19.5444 -19.5442 -9.5113 -9.5113 -8.2268 -8.2268 -8.2050 -8.2050 -8.0664 -8.0664 -4.2122 -4.2122 -0.1927 -0.1927 0.3385 0.3385 0.4278 0.4304 1.1211 1.1211 1.2063 1.2108 2.0875 2.0875 2.2540 2.2866 2.5289 2.5289 3.0869 3.0869 3.2062 3.2655 3.4796 3.4796 5.3015 5.3015 6.9236 6.9236 7.1045 7.1524 7.1992 7.1992 8.9738 8.9738 9.0007 9.0198 k = 0.3919-0.0478 0.6124 ( 13222 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7351 -19.7351 -19.7302 -19.7301 -19.7301 -19.7300 -19.5622 -19.5622 -19.5621 -19.5620 -19.5516 -19.5516 -19.5499 -19.5499 -19.5445 -19.5445 -19.5443 -19.5442 -9.5026 -9.5026 -8.2290 -8.2290 -8.2072 -8.2071 -8.0767 -8.0767 -4.2131 -4.2131 -0.1448 -0.1448 0.3658 0.3658 0.4521 0.4562 1.0764 1.0764 1.1598 1.1667 2.0590 2.0590 2.2287 2.2589 2.4976 2.4976 3.1310 3.1310 3.2540 3.3128 3.5071 3.5071 5.2880 5.2880 6.9253 6.9253 7.1119 7.1616 7.1704 7.1704 9.0009 9.0009 9.0267 9.0462 k = 0.3986-0.0669 0.6124 ( 13210 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7352 -19.7352 -19.7301 -19.7301 -19.7301 -19.7299 -19.5623 -19.5623 -19.5622 -19.5621 -19.5513 -19.5513 -19.5500 -19.5500 -19.5444 -19.5444 -19.5442 -19.5441 -9.4936 -9.4936 -8.2311 -8.2311 -8.2091 -8.2091 -8.0880 -8.0880 -4.2137 -4.2137 -0.0936 -0.0936 0.3929 0.3929 0.4758 0.4815 1.0341 1.0341 1.1156 1.1249 2.0298 2.0298 2.2030 2.2308 2.4633 2.4633 3.1745 3.1745 3.3017 3.3597 3.5336 3.5336 5.2708 5.2708 6.9234 6.9234 7.1168 7.1462 7.1462 7.1676 9.0342 9.0342 9.0594 9.0797 k = 0.4054-0.0860 0.6124 ( 13207 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7353 -19.7353 -19.7301 -19.7300 -19.7300 -19.7299 -19.5624 -19.5624 -19.5624 -19.5623 -19.5511 -19.5511 -19.5501 -19.5501 -19.5444 -19.5444 -19.5442 -19.5441 -9.4844 -9.4844 -8.2330 -8.2330 -8.2109 -8.2109 -8.1000 -8.1000 -4.2140 -4.2140 -0.0394 -0.0394 0.4197 0.4197 0.4987 0.5063 0.9942 0.9942 1.0740 1.0858 2.0002 2.0002 2.1771 2.2025 2.4263 2.4263 3.2170 3.2170 3.3490 3.4057 3.5591 3.5591 5.2498 5.2498 6.9187 6.9187 7.1192 7.1268 7.1268 7.1706 9.0732 9.0732 9.0982 9.1198 k = 0.4122-0.1051 0.6124 ( 13207 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7354 -19.7354 -19.7300 -19.7300 -19.7300 -19.7298 -19.5625 -19.5625 -19.5625 -19.5624 -19.5509 -19.5509 -19.5502 -19.5502 -19.5443 -19.5443 -19.5441 -19.5440 -9.4749 -9.4749 -8.2348 -8.2348 -8.2126 -8.2125 -8.1125 -8.1125 -4.2141 -4.2141 0.0171 0.0171 0.4463 0.4463 0.5207 0.5303 0.9570 0.9570 1.0350 1.0494 1.9704 1.9704 2.1512 2.1742 2.3867 2.3867 3.2581 3.2581 3.3955 3.4505 3.5834 3.5834 5.2250 5.2250 6.9122 6.9122 7.1118 7.1118 7.1195 7.1707 9.1167 9.1167 9.1422 9.1656 k = 0.4189-0.1242 0.6124 ( 13213 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7355 -19.7355 -19.7300 -19.7299 -19.7299 -19.7298 -19.5626 -19.5626 -19.5626 -19.5625 -19.5507 -19.5507 -19.5503 -19.5503 -19.5442 -19.5442 -19.5441 -19.5440 -9.4654 -9.4654 -8.2365 -8.2365 -8.2141 -8.2140 -8.1254 -8.1254 -4.2139 -4.2139 0.0755 0.0755 0.4725 0.4725 0.5416 0.5534 0.9227 0.9227 0.9990 1.0158 1.9404 1.9404 2.1256 2.1463 2.3449 2.3449 3.2976 3.2976 3.4409 3.4938 3.6067 3.6067 5.1970 5.1970 6.9054 6.9054 7.1004 7.1004 7.1178 7.1681 9.1627 9.1627 9.1900 9.2156 k = 0.4257-0.1433 0.6124 ( 13210 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7356 -19.7356 -19.7300 -19.7299 -19.7299 -19.7298 -19.5627 -19.5627 -19.5627 -19.5626 -19.5505 -19.5505 -19.5504 -19.5504 -19.5441 -19.5441 -19.5440 -19.5439 -9.4559 -9.4559 -8.2381 -8.2381 -8.2154 -8.2154 -8.1383 -8.1383 -4.2136 -4.2136 0.1349 0.1349 0.4982 0.4982 0.5612 0.5752 0.8915 0.8915 0.9659 0.9853 1.9106 1.9106 2.1006 2.1191 2.3013 2.3013 3.3349 3.3349 3.4847 3.5351 3.6289 3.6289 5.1664 5.1664 6.8990 6.8990 7.0916 7.0916 7.1145 7.1632 9.2068 9.2068 9.2392 9.2672 k = 0.4324-0.1624 0.6124 ( 13207 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6906 -47.6906 -19.7357 -19.7357 -19.7299 -19.7299 -19.7299 -19.7298 -19.5628 -19.5628 -19.5628 -19.5627 -19.5505 -19.5505 -19.5503 -19.5503 -19.5441 -19.5441 -19.5440 -19.5439 -9.4466 -9.4466 -8.2396 -8.2396 -8.2166 -8.2166 -8.1511 -8.1511 -4.2131 -4.2131 0.1944 0.1944 0.5235 0.5235 0.5792 0.5956 0.8637 0.8637 0.9362 0.9580 1.8810 1.8810 2.0764 2.0927 2.2564 2.2564 3.3698 3.3698 3.5266 3.5741 3.6498 3.6498 5.1341 5.1341 6.8937 6.8937 7.0850 7.0850 7.1099 7.1565 9.2403 9.2403 9.2855 9.2963 k = 0.4392-0.1816 0.6124 ( 13204 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7357 -19.7357 -19.7299 -19.7299 -19.7299 -19.7298 -19.5629 -19.5629 -19.5629 -19.5628 -19.5506 -19.5506 -19.5502 -19.5502 -19.5440 -19.5440 -19.5439 -19.5438 -9.4376 -9.4376 -8.2410 -8.2410 -8.2176 -8.2176 -8.1635 -8.1635 -4.2124 -4.2124 0.2531 0.2531 0.5481 0.5481 0.5955 0.6142 0.8397 0.8397 0.9100 0.9339 1.8519 1.8519 2.0533 2.0676 2.2107 2.2107 3.4020 3.4020 3.5663 3.6105 3.6696 3.6696 5.1009 5.1009 6.8897 6.8897 7.0800 7.0800 7.1045 7.1483 9.2580 9.2580 9.3205 9.3205 k = 0.4459-0.2007 0.6124 ( 13201 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7358 -19.7358 -19.7299 -19.7298 -19.7298 -19.7298 -19.5629 -19.5629 -19.5629 -19.5629 -19.5506 -19.5506 -19.5501 -19.5501 -19.5439 -19.5439 -19.5439 -19.5438 -9.4290 -9.4290 -8.2424 -8.2424 -8.2186 -8.2185 -8.1753 -8.1753 -4.2118 -4.2118 0.3094 0.3094 0.5718 0.5718 0.6099 0.6305 0.8200 0.8200 0.8875 0.9133 1.8233 1.8233 2.0315 2.0439 2.1652 2.1652 3.4311 3.4311 3.6033 3.6438 3.6880 3.6880 5.0680 5.0680 6.8868 6.8868 7.0766 7.0766 7.0987 7.1391 9.2693 9.2693 9.3404 9.3404 k = 0.4527-0.2198 0.6124 ( 13198 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7358 -19.7358 -19.7299 -19.7298 -19.7298 -19.7298 -19.5630 -19.5629 -19.5629 -19.5629 -19.5507 -19.5507 -19.5499 -19.5499 -19.5439 -19.5439 -19.5439 -19.5438 -9.4210 -9.4210 -8.2439 -8.2439 -8.2194 -8.2194 -8.1861 -8.1861 -4.2110 -4.2110 0.3618 0.3618 0.5944 0.5944 0.6222 0.6441 0.8054 0.8054 0.8692 0.8960 1.7954 1.7954 2.0115 2.0220 2.1207 2.1207 3.4570 3.4570 3.6373 3.6737 3.7050 3.7050 5.0362 5.0362 6.8846 6.8846 7.0745 7.0745 7.0928 7.1294 9.2798 9.2798 9.3495 9.3495 k = 0.4595-0.2389 0.6124 ( 13210 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7359 -19.7359 -19.7299 -19.7298 -19.7298 -19.7298 -19.5631 -19.5630 -19.5630 -19.5630 -19.5508 -19.5508 -19.5499 -19.5499 -19.5438 -19.5438 -19.5438 -19.5438 -9.4137 -9.4137 -8.2453 -8.2453 -8.2201 -8.2200 -8.1958 -8.1958 -4.2103 -4.2103 0.4085 0.4085 0.6151 0.6151 0.6323 0.6546 0.7971 0.7971 0.8552 0.8819 1.7684 1.7684 1.9934 2.0022 2.0784 2.0784 3.4795 3.4795 3.6680 3.7000 3.7204 3.7204 5.0067 5.0067 6.8829 6.8829 7.0736 7.0736 7.0873 7.1196 9.2905 9.2905 9.3506 9.3506 k = 0.4662-0.2580 0.6124 ( 13210 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7360 -19.7360 -19.7299 -19.7298 -19.7298 -19.7298 -19.5631 -19.5631 -19.5631 -19.5631 -19.5508 -19.5508 -19.5498 -19.5498 -19.5438 -19.5438 -19.5438 -19.5438 -9.4072 -9.4072 -8.2469 -8.2469 -8.2206 -8.2206 -8.2040 -8.2040 -4.2097 -4.2097 0.4480 0.4480 0.6325 0.6325 0.6405 0.6618 0.7962 0.7962 0.8456 0.8708 1.7426 1.7426 1.9776 1.9847 2.0397 2.0397 3.4986 3.4986 3.6951 3.7223 3.7339 3.7339 4.9802 4.9802 6.8815 6.8815 7.0736 7.0736 7.0824 7.1101 9.3012 9.3012 9.3476 9.3476 k = 0.4730-0.2771 0.6124 ( 13219 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7360 -19.7360 -19.7298 -19.7298 -19.7298 -19.7298 -19.5632 -19.5632 -19.5631 -19.5631 -19.5509 -19.5509 -19.5497 -19.5497 -19.5438 -19.5438 -19.5438 -19.5438 -9.4018 -9.4018 -8.2485 -8.2485 -8.2211 -8.2211 -8.2107 -8.2107 -4.2091 -4.2091 0.4791 0.4791 0.6456 0.6456 0.6468 0.6658 0.8029 0.8029 0.8400 0.8622 1.7186 1.7186 1.9643 1.9699 2.0059 2.0059 3.5141 3.5141 3.7183 3.7404 3.7454 3.7454 4.9575 4.9575 6.8803 6.8803 7.0744 7.0744 7.0786 7.1012 9.3114 9.3114 9.3432 9.3432 k = 0.4797-0.2962 0.6124 ( 13225 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7298 -19.7298 -19.7298 -19.7298 -19.5632 -19.5632 -19.5632 -19.5632 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3974 -9.3974 -8.2501 -8.2501 -8.2214 -8.2214 -8.2158 -8.2158 -4.2086 -4.2086 0.5020 0.5020 0.6518 0.6540 0.6540 0.6670 0.8151 0.8151 0.8378 0.8556 1.6975 1.6975 1.9538 1.9579 1.9782 1.9782 3.5262 3.5262 3.7372 3.7540 3.7546 3.7546 4.9392 4.9392 6.8792 6.8792 7.0754 7.0754 7.0760 7.0932 9.3204 9.3204 9.3388 9.3388 k = 0.4865-0.3153 0.6124 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5633 -19.5632 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3942 -9.3942 -8.2515 -8.2515 -8.2217 -8.2217 -8.2192 -8.2192 -4.2083 -4.2083 0.5172 0.5172 0.6557 0.6588 0.6588 0.6664 0.8286 0.8286 0.8381 0.8504 1.6805 1.6805 1.9464 1.9491 1.9578 1.9578 3.5347 3.5347 3.7517 3.7614 3.7614 3.7630 4.9258 4.9258 6.8784 6.8784 7.0749 7.0765 7.0765 7.0865 9.3272 9.3272 9.3353 9.3353 k = 0.4932-0.3344 0.6124 ( 13246 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7362 -19.7362 -19.7298 -19.7298 -19.7298 -19.7298 -19.5633 -19.5633 -19.5633 -19.5633 -19.5509 -19.5509 -19.5496 -19.5496 -19.5438 -19.5438 -19.5438 -19.5438 -9.3922 -9.3922 -8.2525 -8.2525 -8.2218 -8.2218 -8.2212 -8.2212 -4.2080 -4.2080 0.5258 0.5258 0.6590 0.6612 0.6612 0.6645 0.8389 0.8389 0.8399 0.8463 1.6694 1.6694 1.9421 1.9434 1.9453 1.9453 3.5399 3.5399 3.7616 3.7655 3.7655 3.7673 4.9176 4.9176 6.8778 6.8778 7.0754 7.0772 7.0772 7.0812 9.3310 9.3310 9.3338 9.3339 k = 0.5000-0.3536 0.6124 ( 13078 PWs) bands (ev): -47.6913 -47.6913 -47.6913 -47.6913 -47.6905 -47.6905 -19.7361 -19.7361 -19.7295 -19.7295 -19.7295 -19.7295 -19.5631 -19.5631 -19.5631 -19.5631 -19.5507 -19.5507 -19.5493 -19.5493 -19.5436 -19.5436 -19.5436 -19.5436 -9.3915 -9.3915 -8.2528 -8.2528 -8.2219 -8.2219 -8.2219 -8.2219 -4.2080 -4.2080 0.5286 0.5286 0.6620 0.6620 0.6620 0.6620 0.8428 0.8428 0.8428 0.8428 1.6656 1.6656 1.9411 1.9411 1.9411 1.9411 3.5416 3.5416 3.7669 3.7669 3.7669 3.7669 4.9148 4.9148 6.8776 6.8776 7.0775 7.0775 7.0775 7.0775 9.3313 9.3313 9.3342 9.3342 k = 0.2500 0.3536 0.6124 ( 13172 PWs) bands (ev): -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -47.6910 -19.7316 -19.7316 -19.7314 -19.7314 -19.7314 -19.7314 -19.5589 -19.5589 -19.5583 -19.5583 -19.5583 -19.5583 -19.5472 -19.5472 -19.5459 -19.5459 -19.5459 -19.5459 -9.5740 -9.5740 -8.1531 -8.1531 -8.1230 -8.1230 -8.1230 -8.1230 -4.1689 -4.1689 -0.2610 -0.2610 -0.0907 -0.0907 -0.0907 -0.0907 2.1377 2.1377 2.1624 2.1624 2.1624 2.1624 2.4588 2.4588 2.4588 2.4588 2.6369 2.6369 2.8250 2.8250 2.8250 2.8250 5.3350 5.3350 6.7682 6.7682 6.9981 6.9981 6.9981 6.9981 9.1994 9.1994 9.3407 9.3407 k = 0.2381 0.3367 0.6124 ( 13148 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7317 -19.7317 -19.7315 -19.7315 -19.7313 -19.7313 -19.5590 -19.5590 -19.5584 -19.5584 -19.5580 -19.5580 -19.5472 -19.5472 -19.5460 -19.5460 -19.5458 -19.5458 -9.5741 -9.5741 -8.1551 -8.1551 -8.1275 -8.1275 -8.1162 -8.1162 -4.1691 -4.1691 -0.2672 -0.2672 -0.1108 -0.1108 -0.0622 -0.0622 2.1179 2.1179 2.1607 2.1607 2.1737 2.1737 2.4384 2.4384 2.4826 2.4826 2.6349 2.6349 2.8098 2.8098 2.8469 2.8469 5.3349 5.3349 6.7647 6.7647 6.9782 6.9782 7.0286 7.0286 9.1963 9.1963 9.3348 9.3348 k = 0.2262 0.3199 0.6124 ( 13142 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7318 -19.7318 -19.7315 -19.7315 -19.7311 -19.7311 -19.5592 -19.5592 -19.5584 -19.5584 -19.5577 -19.5577 -19.5472 -19.5472 -19.5460 -19.5460 -19.5457 -19.5457 -9.5744 -9.5744 -8.1606 -8.1606 -8.1295 -8.1295 -8.1081 -8.1081 -4.1698 -4.1698 -0.2843 -0.2843 -0.1222 -0.1222 -0.0274 -0.0274 2.0842 2.0842 2.1578 2.1578 2.1799 2.1799 2.4266 2.4266 2.5030 2.5030 2.6323 2.6323 2.8014 2.8014 2.8742 2.8742 5.3348 5.3348 6.7549 6.7549 6.9701 6.9701 7.0676 7.0676 9.1871 9.1871 9.3219 9.3219 k = 0.2143 0.3030 0.6124 ( 13158 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7320 -19.7320 -19.7315 -19.7315 -19.7309 -19.7309 -19.5595 -19.5595 -19.5585 -19.5585 -19.5574 -19.5574 -19.5473 -19.5473 -19.5461 -19.5461 -19.5456 -19.5456 -9.5748 -9.5748 -8.1679 -8.1679 -8.1299 -8.1299 -8.0992 -8.0992 -4.1709 -4.1709 -0.3086 -0.3086 -0.1264 -0.1264 0.0117 0.0117 2.0461 2.0461 2.1509 2.1509 2.1740 2.1740 2.4246 2.4246 2.5126 2.5126 2.6381 2.6381 2.7988 2.7988 2.9047 2.9047 5.3350 5.3350 6.7407 6.7407 6.9733 6.9733 7.1131 7.1131 9.1720 9.1721 9.3025 9.3025 k = 0.2024 0.2862 0.6124 ( 13146 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6910 -47.6910 -19.7322 -19.7322 -19.7315 -19.7315 -19.7307 -19.7307 -19.5598 -19.5598 -19.5585 -19.5585 -19.5571 -19.5571 -19.5473 -19.5473 -19.5461 -19.5461 -19.5455 -19.5455 -9.5754 -9.5754 -8.1761 -8.1761 -8.1294 -8.1294 -8.0901 -8.0901 -4.1725 -4.1725 -0.3368 -0.3368 -0.1258 -0.1258 0.0538 0.0538 2.0059 2.0059 2.1338 2.1338 2.1641 2.1641 2.4270 2.4270 2.5116 2.5116 2.6567 2.6567 2.8003 2.8003 2.9369 2.9369 5.3359 5.3359 6.7246 6.7246 6.9856 6.9856 7.1635 7.1635 9.1516 9.1516 9.2776 9.2776 k = 0.1905 0.2694 0.6124 ( 13158 PWs) bands (ev): -47.6911 -47.6911 -47.6910 -47.6910 -47.6909 -47.6909 -19.7324 -19.7324 -19.7315 -19.7315 -19.7306 -19.7306 -19.5601 -19.5601 -19.5585 -19.5585 -19.5569 -19.5569 -19.5474 -19.5474 -19.5462 -19.5462 -19.5454 -19.5454 -9.5761 -9.5761 -8.1845 -8.1845 -8.1282 -8.1282 -8.0809 -8.0809 -4.1744 -4.1744 -0.3664 -0.3664 -0.1218 -0.1218 0.0979 0.0979 1.9648 1.9648 2.1041 2.1041 2.1568 2.1568 2.4226 2.4226 2.5125 2.5125 2.6835 2.6835 2.8050 2.8050 2.9696 2.9696 5.3382 5.3382 6.7089 6.7089 7.0048 7.0048 7.2178 7.2178 9.1262 9.1262 9.2484 9.2484 k = 0.1786 0.2525 0.6124 ( 13162 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6909 -47.6909 -19.7325 -19.7325 -19.7315 -19.7315 -19.7305 -19.7305 -19.5605 -19.5605 -19.5585 -19.5585 -19.5566 -19.5566 -19.5475 -19.5475 -19.5462 -19.5462 -19.5452 -19.5452 -9.5770 -9.5770 -8.1928 -8.1928 -8.1266 -8.1266 -8.0718 -8.0718 -4.1767 -4.1767 -0.3962 -0.3962 -0.1156 -0.1156 0.1435 0.1435 1.9235 1.9235 2.0669 2.0669 2.1507 2.1507 2.4055 2.4055 2.5231 2.5231 2.7135 2.7135 2.8123 2.8123 3.0018 3.0018 5.3424 5.3424 6.6951 6.6951 7.0287 7.0287 7.2749 7.2749 9.0965 9.0965 9.2163 9.2163 k = 0.1667 0.2357 0.6124 ( 13188 PWs) bands (ev): -47.6912 -47.6912 -47.6911 -47.6911 -47.6909 -47.6909 -19.7328 -19.7328 -19.7315 -19.7315 -19.7303 -19.7303 -19.5608 -19.5608 -19.5585 -19.5585 -19.5563 -19.5563 -19.5475 -19.5475 -19.5463 -19.5463 -19.5452 -19.5452 -9.5779 -9.5779 -8.2010 -8.2010 -8.1248 -8.1248 -8.0630 -8.0630 -4.1792 -4.1792 -0.4253 -0.4253 -0.1076 -0.1076 0.1903 0.1903 1.8826 1.8826 2.0258 2.0258 2.1447 2.1447 2.3803 2.3803 2.5401 2.5401 2.7434 2.7434 2.8220 2.8220 3.0329 3.0329 5.3491 5.3491 6.6841 6.6841 7.0552 7.0552 7.3340 7.3340 9.0634 9.0634 9.1825 9.1825 k = 0.1548 0.2189 0.6124 ( 13174 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6909 -47.6909 -19.7329 -19.7329 -19.7315 -19.7315 -19.7302 -19.7302 -19.5610 -19.5610 -19.5585 -19.5585 -19.5561 -19.5561 -19.5476 -19.5476 -19.5463 -19.5463 -19.5450 -19.5450 -9.5790 -9.5790 -8.2089 -8.2089 -8.1227 -8.1227 -8.0544 -8.0544 -4.1820 -4.1820 -0.4532 -0.4532 -0.0983 -0.0983 0.2377 0.2377 1.8426 1.8426 1.9827 1.9827 2.1386 2.1386 2.3517 2.3517 2.5589 2.5589 2.7711 2.7711 2.8344 2.8344 3.0624 3.0624 5.3588 5.3588 6.6764 6.6764 7.0827 7.0827 7.3945 7.3945 9.0276 9.0277 9.1480 9.1480 k = 0.1429 0.2020 0.6124 ( 13178 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6909 -47.6909 -19.7330 -19.7330 -19.7315 -19.7315 -19.7300 -19.7300 -19.5613 -19.5613 -19.5585 -19.5585 -19.5558 -19.5558 -19.5477 -19.5477 -19.5463 -19.5463 -19.5449 -19.5449 -9.5801 -9.5801 -8.2164 -8.2164 -8.1204 -8.1204 -8.0462 -8.0462 -4.1849 -4.1849 -0.4798 -0.4798 -0.0881 -0.0881 0.2856 0.2856 1.8036 1.8036 1.9387 1.9387 2.1323 2.1323 2.3224 2.3224 2.5771 2.5771 2.7948 2.7948 2.8502 2.8502 3.0901 3.0901 5.3716 5.3716 6.6722 6.6722 7.1095 7.1095 7.4555 7.4555 8.9903 8.9903 9.1136 9.1136 k = 0.1310 0.1852 0.6124 ( 13178 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6909 -47.6909 -19.7332 -19.7332 -19.7315 -19.7315 -19.7299 -19.7299 -19.5616 -19.5616 -19.5585 -19.5585 -19.5556 -19.5556 -19.5477 -19.5477 -19.5463 -19.5463 -19.5448 -19.5448 -9.5812 -9.5812 -8.2235 -8.2235 -8.1181 -8.1181 -8.0384 -8.0384 -4.1880 -4.1880 -0.5047 -0.5047 -0.0773 -0.0773 0.3336 0.3336 1.7660 1.7660 1.8946 1.8946 2.1260 2.1260 2.2937 2.2937 2.5936 2.5936 2.8137 2.8137 2.8696 2.8696 3.1156 3.1156 5.3877 5.3877 6.6713 6.6713 7.1344 7.1344 7.5164 7.5164 8.9524 8.9524 9.0798 9.0798 k = 0.1190 0.1684 0.6124 ( 13178 PWs) bands (ev): -47.6912 -47.6912 -47.6910 -47.6910 -47.6909 -47.6909 -19.7333 -19.7333 -19.7315 -19.7315 -19.7298 -19.7298 -19.5618 -19.5618 -19.5585 -19.5585 -19.5554 -19.5554 -19.5478 -19.5478 -19.5463 -19.5463 -19.5446 -19.5446 -9.5824 -9.5824 -8.2301 -8.2301 -8.1157 -8.1157 -8.0310 -8.0310 -4.1911 -4.1911 -0.5278 -0.5278 -0.0661 -0.0661 0.3812 0.3812 1.7298 1.7298 1.8512 1.8512 2.1196 2.1196 2.2663 2.2663 2.6079 2.6079 2.8283 2.8283 2.8914 2.8914 3.1389 3.1389 5.4069 5.4069 6.6735 6.6735 7.1560 7.1560 7.5765 7.5765 8.9150 8.9150 9.0471 9.0471 k = 0.1071 0.1515 0.6124 ( 13174 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7335 -19.7335 -19.7315 -19.7315 -19.7297 -19.7297 -19.5621 -19.5621 -19.5585 -19.5585 -19.5551 -19.5551 -19.5479 -19.5479 -19.5463 -19.5463 -19.5445 -19.5445 -9.5835 -9.5835 -8.2362 -8.2362 -8.1133 -8.1133 -8.0242 -8.0242 -4.1941 -4.1941 -0.5490 -0.5490 -0.0549 -0.0549 0.4282 0.4282 1.6949 1.6949 1.8093 1.8093 2.1133 2.1133 2.2408 2.2408 2.6198 2.6198 2.8403 2.8403 2.9136 2.9136 3.1599 3.1599 5.4289 5.4289 6.6783 6.6783 7.1737 7.1737 7.6349 7.6349 8.8788 8.8788 9.0157 9.0157 k = 0.0952 0.1347 0.6124 ( 13172 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7336 -19.7336 -19.7315 -19.7315 -19.7296 -19.7296 -19.5623 -19.5623 -19.5585 -19.5585 -19.5550 -19.5550 -19.5479 -19.5479 -19.5463 -19.5463 -19.5444 -19.5444 -9.5846 -9.5846 -8.2417 -8.2417 -8.1111 -8.1111 -8.0180 -8.0180 -4.1970 -4.1970 -0.5681 -0.5681 -0.0438 -0.0438 0.4741 0.4741 1.6615 1.6615 1.7698 1.7698 2.1072 2.1072 2.2176 2.2176 2.6294 2.6294 2.8503 2.8504 2.9349 2.9349 3.1784 3.1784 5.4531 5.4531 6.6852 6.6852 7.1869 7.1869 7.6908 7.6908 8.8448 8.8448 8.9860 8.9860 k = 0.0833 0.1179 0.6124 ( 13172 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7337 -19.7337 -19.7315 -19.7315 -19.7295 -19.7295 -19.5624 -19.5624 -19.5585 -19.5585 -19.5548 -19.5548 -19.5480 -19.5480 -19.5463 -19.5463 -19.5443 -19.5443 -9.5856 -9.5856 -8.2467 -8.2467 -8.1089 -8.1089 -8.0124 -8.0124 -4.1998 -4.1998 -0.5852 -0.5852 -0.0333 -0.0333 0.5182 0.5182 1.6291 1.6291 1.7335 1.7335 2.1012 2.1012 2.1970 2.1970 2.6369 2.6369 2.8591 2.8591 2.9547 2.9547 3.1946 3.1946 5.4785 5.4785 6.6936 6.6936 7.1956 7.1956 7.7433 7.7433 8.8135 8.8135 8.9585 8.9585 k = 0.0714 0.1010 0.6124 ( 13180 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6908 -47.6908 -19.7338 -19.7338 -19.7315 -19.7315 -19.7294 -19.7294 -19.5626 -19.5626 -19.5585 -19.5585 -19.5547 -19.5547 -19.5480 -19.5480 -19.5463 -19.5463 -19.5442 -19.5442 -9.5866 -9.5866 -8.2510 -8.2510 -8.1069 -8.1069 -8.0075 -8.0075 -4.2023 -4.2023 -0.6001 -0.6001 -0.0235 -0.0235 0.5599 0.5599 1.5980 1.5980 1.7014 1.7014 2.0955 2.0955 2.1792 2.1792 2.6424 2.6424 2.8666 2.8666 2.9724 2.9724 3.2084 3.2084 5.5042 5.5042 6.7027 6.7027 7.2000 7.2000 7.7916 7.7916 8.7856 8.7856 8.9336 8.9336 k = 0.0595 0.0842 0.6124 ( 13190 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6908 -47.6908 -19.7339 -19.7339 -19.7315 -19.7315 -19.7294 -19.7294 -19.5628 -19.5628 -19.5585 -19.5585 -19.5546 -19.5546 -19.5481 -19.5481 -19.5464 -19.5464 -19.5442 -19.5442 -9.5874 -9.5874 -8.2547 -8.2547 -8.1052 -8.1052 -8.0033 -8.0033 -4.2046 -4.2046 -0.6128 -0.6128 -0.0148 -0.0148 0.5982 0.5982 1.5684 1.5684 1.6742 1.6742 2.0901 2.0901 2.1643 2.1643 2.6464 2.6464 2.8730 2.8730 2.9878 2.9878 3.2199 3.2199 5.5290 5.5290 6.7119 6.7119 7.2010 7.2010 7.8346 7.8346 8.7615 8.7615 8.9115 8.9115 k = 0.0476 0.0673 0.6124 ( 13188 PWs) bands (ev): -47.6913 -47.6913 -47.6911 -47.6911 -47.6908 -47.6908 -19.7339 -19.7339 -19.7315 -19.7315 -19.7293 -19.7293 -19.5629 -19.5629 -19.5585 -19.5585 -19.5545 -19.5545 -19.5481 -19.5481 -19.5464 -19.5464 -19.5441 -19.5441 -9.5881 -9.5881 -8.2578 -8.2578 -8.1037 -8.1037 -7.9998 -7.9998 -4.2065 -4.2065 -0.6232 -0.6232 -0.0073 -0.0073 0.6322 0.6322 1.5412 1.5412 1.6521 1.6521 2.0853 2.0853 2.1523 2.1523 2.6491 2.6491 2.8783 2.8783 3.0007 3.0007 3.2292 3.2292 5.5516 5.5516 6.7205 6.7205 7.1995 7.1995 7.8713 7.8713 8.7415 8.7415 8.8928 8.8928 k = 0.0357 0.0505 0.6124 ( 13172 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5629 -19.5629 -19.5585 -19.5585 -19.5544 -19.5544 -19.5481 -19.5481 -19.5463 -19.5463 -19.5440 -19.5440 -9.5887 -9.5887 -8.2602 -8.2602 -8.1025 -8.1025 -7.9970 -7.9970 -4.2080 -4.2080 -0.6314 -0.6314 -0.0012 -0.0012 0.6606 0.6606 1.5177 1.5177 1.6352 1.6352 2.0811 2.0811 2.1433 2.1433 2.6508 2.6508 2.8824 2.8824 3.0108 3.0108 3.2363 3.2363 5.5709 5.5709 6.7279 6.7279 7.1967 7.1967 7.9010 7.9010 8.7259 8.7259 8.8777 8.8777 k = 0.0238 0.0337 0.6124 ( 13172 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5630 -19.5630 -19.5585 -19.5585 -19.5543 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5440 -19.5440 -9.5891 -9.5891 -8.2619 -8.2619 -8.1016 -8.1016 -7.9950 -7.9950 -4.2091 -4.2091 -0.6373 -0.6373 0.0033 0.0033 0.6822 0.6822 1.4994 1.4994 1.6232 1.6232 2.0778 2.0778 2.1370 2.1370 2.6518 2.6518 2.8854 2.8854 3.0182 3.0182 3.2414 3.2414 5.5856 5.5856 6.7335 6.7335 7.1937 7.1937 7.9228 7.9228 8.7147 8.7147 8.8667 8.8667 k = 0.0119 0.0168 0.6124 ( 13164 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5630 -19.5630 -19.5585 -19.5585 -19.5543 -19.5543 -19.5481 -19.5481 -19.5463 -19.5463 -19.5439 -19.5439 -9.5893 -9.5893 -8.2630 -8.2630 -8.1011 -8.1011 -7.9938 -7.9938 -4.2098 -4.2098 -0.6408 -0.6408 0.0060 0.0060 0.6958 0.6958 1.4877 1.4877 1.6162 1.6162 2.0757 2.0757 2.1334 2.1334 2.6523 2.6523 2.8872 2.8872 3.0226 3.0226 3.2444 3.2444 5.5948 5.5948 6.7370 6.7370 7.1915 7.1915 7.9361 7.9361 8.7079 8.7079 8.8599 8.8599 k = 0.0000 0.0000 0.6124 ( 13170 PWs) bands (ev): -47.6913 -47.6913 -47.6910 -47.6910 -47.6908 -47.6908 -19.7340 -19.7340 -19.7315 -19.7315 -19.7292 -19.7292 -19.5630 -19.5630 -19.5585 -19.5585 -19.5543 -19.5543 -19.5481 -19.5481 -19.5464 -19.5464 -19.5440 -19.5440 -9.5894 -9.5894 -8.2633 -8.2633 -8.1009 -8.1009 -7.9934 -7.9934 -4.2101 -4.2101 -0.6419 -0.6419 0.0069 0.0069 0.7004 0.7004 1.4837 1.4837 1.6138 1.6138 2.0750 2.0750 2.1322 2.1322 2.6525 2.6525 2.8878 2.8878 3.0241 3.0241 3.2454 3.2454 5.5980 5.5980 6.7382 6.7382 7.1907 7.1907 7.9406 7.9406 8.7057 8.7057 8.8577 8.8577 Writing output data file Na3SbSe4.save init_run : 4.76s CPU 14.00s WALL ( 1 calls) electrons : 987.56s CPU 1003.47s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.42s CPU 1.74s WALL ( 1 calls) Called by electrons: c_bands : 987.52s CPU 1003.12s WALL ( 1 calls) v_of_rho : 0.24s CPU 1.02s WALL ( 1 calls) v_h : 0.03s CPU 0.03s WALL ( 1 calls) v_xc : 0.20s CPU 0.63s WALL ( 1 calls) newd : 0.36s CPU 0.49s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.18s WALL ( 203 calls) cegterg : 934.18s CPU 946.25s WALL ( 481 calls) Called by sum_band: Called by *egterg: h_psi : 448.85s CPU 457.59s WALL ( 8110 calls) s_psi : 22.40s CPU 22.83s WALL ( 8110 calls) g_psi : 1.58s CPU 1.56s WALL ( 7426 calls) cdiaghg : 293.02s CPU 292.50s WALL ( 7629 calls) cegterg:over : 92.51s CPU 90.91s WALL ( 7426 calls) cegterg:upda : 39.14s CPU 41.95s WALL ( 7426 calls) cegterg:last : 26.00s CPU 26.48s WALL ( 1095 calls) Called by h_psi: h_psi:vloc : 391.68s CPU 398.52s WALL ( 8110 calls) h_psi:vnl : 56.15s CPU 57.50s WALL ( 8110 calls) add_vuspsi : 18.30s CPU 21.08s WALL ( 8110 calls) General routines calbec : 37.81s CPU 36.33s WALL ( 8110 calls) fft : 0.24s CPU 1.40s WALL ( 19 calls) ffts : 0.04s CPU 0.08s WALL ( 4 calls) fftw : 367.79s CPU 373.23s WALL ( 944412 calls) interpolate : 0.06s CPU 0.10s WALL ( 4 calls) davcio : 0.02s CPU 2.10s WALL ( 406 calls) Parallel routines fft_scatter : 180.39s CPU 181.89s WALL ( 944435 calls) PWSCF : 18m15.47s CPU 21m10.11s WALL This run was terminated on: 0:56:45 3Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=