Program PWSCF v.5.1.1 starts on 20Jul2015 at 7:16:46 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: ./SiO2.save/ 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 55 32 9 2475 1084 165 Max 56 33 10 2483 1106 170 Sum 2687 1565 449 119073 52579 7995 bravais-lattice index = 14 lattice parameter (alat) = 12.4257 a.u. unit-cell volume = 1208.6774 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.425704 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.131574 celldm(5)= -0.131574 celldm(6)= -0.736853 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.736853 0.676053 0.000000 ) a(3) = ( -0.131574 -0.338027 0.931894 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.089933 0.536542 ) b(2) = ( 0.000000 1.479173 0.536542 ) b(3) = ( 0.000000 0.000000 1.073083 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: fdd4f0c14d34ff7e95251eb8672b2767 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Si 4.00 28.08550 Si( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 265 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0000000 0.0000000 0.0206362), wk = 0.0037736 k( 3) = ( 0.0000000 0.0000000 0.0412724), wk = 0.0037736 k( 4) = ( 0.0000000 0.0000000 0.0619087), wk = 0.0037736 k( 5) = ( 0.0000000 0.0000000 0.0825449), wk = 0.0037736 k( 6) = ( 0.0000000 0.0000000 0.1031811), wk = 0.0037736 k( 7) = ( 0.0000000 0.0000000 0.1238173), wk = 0.0037736 k( 8) = ( 0.0000000 0.0000000 0.1444535), wk = 0.0037736 k( 9) = ( 0.0000000 0.0000000 0.1650898), wk = 0.0037736 k( 10) = ( 0.0000000 0.0000000 0.1857260), wk = 0.0037736 k( 11) = ( 0.0000000 0.0000000 0.2063622), wk = 0.0037736 k( 12) = ( 0.0000000 0.0000000 0.2269984), wk = 0.0037736 k( 13) = ( 0.0000000 0.0000000 0.2476346), wk = 0.0037736 k( 14) = ( 0.0000000 0.0000000 0.2682709), wk = 0.0037736 k( 15) = ( 0.0000000 0.0000000 0.2889071), wk = 0.0037736 k( 16) = ( 0.0000000 0.0000000 0.3095433), wk = 0.0037736 k( 17) = ( 0.0000000 0.0000000 0.3301795), wk = 0.0037736 k( 18) = ( 0.0000000 0.0000000 0.3508157), wk = 0.0037736 k( 19) = ( 0.0000000 0.0000000 0.3714520), wk = 0.0037736 k( 20) = ( 0.0000000 0.0000000 0.3920882), wk = 0.0037736 k( 21) = ( 0.0000000 0.0000000 0.4127244), wk = 0.0037736 k( 22) = ( 0.0000000 0.0000000 0.4333606), wk = 0.0037736 k( 23) = ( 0.0000000 0.0000000 0.4539968), wk = 0.0037736 k( 24) = ( 0.0000000 0.0000000 0.4746331), wk = 0.0037736 k( 25) = ( 0.0000000 0.0000000 0.4952693), wk = 0.0037736 k( 26) = ( 0.0000000 0.0000000 0.5159055), wk = 0.0037736 k( 27) = ( 0.0000000 0.0000000 0.5365417), wk = 0.0037736 k( 28) = ( 0.0000000 0.0000000 0.5365417), wk = 0.0037736 k( 29) = ( -0.0192308 0.0074854 0.5365417), wk = 0.0037736 k( 30) = ( -0.0384615 0.0149708 0.5365417), wk = 0.0037736 k( 31) = ( -0.0576923 0.0224562 0.5365417), wk = 0.0037736 k( 32) = ( -0.0769231 0.0299416 0.5365417), wk = 0.0037736 k( 33) = ( -0.0961538 0.0374270 0.5365417), wk = 0.0037736 k( 34) = ( -0.1153846 0.0449124 0.5365417), wk = 0.0037736 k( 35) = ( -0.1346154 0.0523977 0.5365417), wk = 0.0037736 k( 36) = ( -0.1538461 0.0598831 0.5365417), wk = 0.0037736 k( 37) = ( -0.1730769 0.0673685 0.5365417), wk = 0.0037736 k( 38) = ( -0.1923077 0.0748539 0.5365417), wk = 0.0037736 k( 39) = ( -0.2115385 0.0823393 0.5365417), wk = 0.0037736 k( 40) = ( -0.2307692 0.0898247 0.5365417), wk = 0.0037736 k( 41) = ( -0.2500000 0.0973101 0.5365417), wk = 0.0037736 k( 42) = ( -0.2692308 0.1047955 0.5365417), wk = 0.0037736 k( 43) = ( -0.2884615 0.1122809 0.5365417), wk = 0.0037736 k( 44) = ( -0.3076923 0.1197663 0.5365417), wk = 0.0037736 k( 45) = ( -0.3269231 0.1272517 0.5365417), wk = 0.0037736 k( 46) = ( -0.3461538 0.1347371 0.5365417), wk = 0.0037736 k( 47) = ( -0.3653846 0.1422225 0.5365417), wk = 0.0037736 k( 48) = ( -0.3846154 0.1497079 0.5365417), wk = 0.0037736 k( 49) = ( -0.4038462 0.1571932 0.5365417), wk = 0.0037736 k( 50) = ( -0.4230769 0.1646786 0.5365417), wk = 0.0037736 k( 51) = ( -0.4423077 0.1721640 0.5365417), wk = 0.0037736 k( 52) = ( -0.4615385 0.1796494 0.5365417), wk = 0.0037736 k( 53) = ( -0.4807692 0.1871348 0.5365417), wk = 0.0037736 k( 54) = ( -0.5000000 0.1946202 0.5365417), wk = 0.0037736 k( 55) = ( -0.5000000 0.1946202 0.5365417), wk = 0.0037736 k( 56) = ( -0.4864865 0.1893602 0.5220406), wk = 0.0037736 k( 57) = ( -0.4729730 0.1841002 0.5075395), wk = 0.0037736 k( 58) = ( -0.4594595 0.1788402 0.4930383), wk = 0.0037736 k( 59) = ( -0.4459459 0.1735802 0.4785372), wk = 0.0037736 k( 60) = ( -0.4324324 0.1683202 0.4640361), wk = 0.0037736 k( 61) = ( -0.4189189 0.1630602 0.4495350), wk = 0.0037736 k( 62) = ( -0.4054054 0.1578002 0.4350338), wk = 0.0037736 k( 63) = ( -0.3918919 0.1525402 0.4205327), wk = 0.0037736 k( 64) = ( -0.3783784 0.1472802 0.4060316), wk = 0.0037736 k( 65) = ( -0.3648649 0.1420202 0.3915304), wk = 0.0037736 k( 66) = ( -0.3513514 0.1367601 0.3770293), wk = 0.0037736 k( 67) = ( -0.3378378 0.1315001 0.3625282), wk = 0.0037736 k( 68) = ( -0.3243243 0.1262401 0.3480271), wk = 0.0037736 k( 69) = ( -0.3108108 0.1209801 0.3335259), wk = 0.0037736 k( 70) = ( -0.2972973 0.1157201 0.3190248), wk = 0.0037736 k( 71) = ( -0.2837838 0.1104601 0.3045237), wk = 0.0037736 k( 72) = ( -0.2702703 0.1052001 0.2900226), wk = 0.0037736 k( 73) = ( -0.2567568 0.0999401 0.2755214), wk = 0.0037736 k( 74) = ( -0.2432432 0.0946801 0.2610203), wk = 0.0037736 k( 75) = ( -0.2297297 0.0894201 0.2465192), wk = 0.0037736 k( 76) = ( -0.2162162 0.0841601 0.2320180), wk = 0.0037736 k( 77) = ( -0.2027027 0.0789001 0.2175169), wk = 0.0037736 k( 78) = ( -0.1891892 0.0736401 0.2030158), wk = 0.0037736 k( 79) = ( -0.1756757 0.0683801 0.1885147), wk = 0.0037736 k( 80) = ( -0.1621622 0.0631201 0.1740135), wk = 0.0037736 k( 81) = ( -0.1486486 0.0578601 0.1595124), wk = 0.0037736 k( 82) = ( -0.1351351 0.0526001 0.1450113), wk = 0.0037736 k( 83) = ( -0.1216216 0.0473401 0.1305101), wk = 0.0037736 k( 84) = ( -0.1081081 0.0420800 0.1160090), wk = 0.0037736 k( 85) = ( -0.0945946 0.0368200 0.1015079), wk = 0.0037736 k( 86) = ( -0.0810811 0.0315600 0.0870068), wk = 0.0037736 k( 87) = ( -0.0675676 0.0263000 0.0725056), wk = 0.0037736 k( 88) = ( -0.0540540 0.0210400 0.0580045), wk = 0.0037736 k( 89) = ( -0.0405405 0.0157800 0.0435034), wk = 0.0037736 k( 90) = ( -0.0270270 0.0105200 0.0290023), wk = 0.0037736 k( 91) = ( -0.0135135 0.0052600 0.0145011), wk = 0.0037736 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 94) = ( 0.0075757 0.0194627 -0.0000000), wk = 0.0037736 k( 95) = ( 0.0151513 0.0389254 -0.0000000), wk = 0.0037736 k( 96) = ( 0.0227270 0.0583882 -0.0000000), wk = 0.0037736 k( 97) = ( 0.0303027 0.0778509 -0.0000000), wk = 0.0037736 k( 98) = ( 0.0378784 0.0973136 -0.0000000), wk = 0.0037736 k( 99) = ( 0.0454541 0.1167763 -0.0000000), wk = 0.0037736 k( 100) = ( 0.0530297 0.1362390 -0.0000000), wk = 0.0037736 k( 101) = ( 0.0606054 0.1557017 -0.0000000), wk = 0.0037736 k( 102) = ( 0.0681811 0.1751644 -0.0000000), wk = 0.0037736 k( 103) = ( 0.0757568 0.1946272 -0.0000000), wk = 0.0037736 k( 104) = ( 0.0833324 0.2140899 -0.0000000), wk = 0.0037736 k( 105) = ( 0.0909081 0.2335526 -0.0000000), wk = 0.0037736 k( 106) = ( 0.0984838 0.2530153 -0.0000000), wk = 0.0037736 k( 107) = ( 0.1060595 0.2724780 -0.0000000), wk = 0.0037736 k( 108) = ( 0.1136351 0.2919407 -0.0000000), wk = 0.0037736 k( 109) = ( 0.1212108 0.3114034 -0.0000000), wk = 0.0037736 k( 110) = ( 0.1287865 0.3308662 -0.0000000), wk = 0.0037736 k( 111) = ( 0.1363622 0.3503289 -0.0000000), wk = 0.0037736 k( 112) = ( 0.1439378 0.3697916 -0.0000000), wk = 0.0037736 k( 113) = ( 0.1515135 0.3892543 -0.0000000), wk = 0.0037736 k( 114) = ( 0.1590892 0.4087170 -0.0000000), wk = 0.0037736 k( 115) = ( 0.1666649 0.4281798 -0.0000000), wk = 0.0037736 k( 116) = ( 0.1742405 0.4476425 -0.0000000), wk = 0.0037736 k( 117) = ( 0.1818162 0.4671052 -0.0000000), wk = 0.0037736 k( 118) = ( 0.1893919 0.4865679 -0.0000000), wk = 0.0037736 k( 119) = ( 0.1969676 0.5060306 -0.0000000), wk = 0.0037736 k( 120) = ( 0.2045432 0.5254933 -0.0000000), wk = 0.0037736 k( 121) = ( 0.2121189 0.5449560 -0.0000000), wk = 0.0037736 k( 122) = ( 0.2196946 0.5644188 -0.0000000), wk = 0.0037736 k( 123) = ( 0.2272703 0.5838815 -0.0000000), wk = 0.0037736 k( 124) = ( 0.2348459 0.6033442 -0.0000000), wk = 0.0037736 k( 125) = ( 0.2424216 0.6228069 -0.0000000), wk = 0.0037736 k( 126) = ( 0.2499973 0.6422696 -0.0000000), wk = 0.0037736 k( 127) = ( 0.2575730 0.6617323 -0.0000000), wk = 0.0037736 k( 128) = ( 0.2651486 0.6811950 -0.0000000), wk = 0.0037736 k( 129) = ( 0.2727243 0.7006578 -0.0000000), wk = 0.0037736 k( 130) = ( 0.2803000 0.7201205 -0.0000000), wk = 0.0037736 k( 131) = ( 0.2878757 0.7395832 -0.0000000), wk = 0.0037736 k( 132) = ( 0.2954514 0.7590459 -0.0000000), wk = 0.0037736 k( 133) = ( 0.3030270 0.7785086 -0.0000000), wk = 0.0037736 k( 134) = ( 0.3106027 0.7979713 -0.0000000), wk = 0.0037736 k( 135) = ( 0.3181784 0.8174341 -0.0000000), wk = 0.0037736 k( 136) = ( 0.3257541 0.8368968 -0.0000000), wk = 0.0037736 k( 137) = ( 0.3257541 0.8368968 -0.0000000), wk = 0.0037736 k( 138) = ( 0.3230485 0.8299460 0.0191622), wk = 0.0037736 k( 139) = ( 0.3203431 0.8229953 0.0383244), wk = 0.0037736 k( 140) = ( 0.3176375 0.8160446 0.0574866), wk = 0.0037736 k( 141) = ( 0.3149321 0.8090939 0.0766488), wk = 0.0037736 k( 142) = ( 0.3122265 0.8021432 0.0958110), wk = 0.0037736 k( 143) = ( 0.3095210 0.7951924 0.1149732), wk = 0.0037736 k( 144) = ( 0.3068155 0.7882417 0.1341354), wk = 0.0037736 k( 145) = ( 0.3041100 0.7812910 0.1532976), wk = 0.0037736 k( 146) = ( 0.3014045 0.7743403 0.1724598), wk = 0.0037736 k( 147) = ( 0.2986990 0.7673896 0.1916220), wk = 0.0037736 k( 148) = ( 0.2959935 0.7604388 0.2107842), wk = 0.0037736 k( 149) = ( 0.2932880 0.7534881 0.2299465), wk = 0.0037736 k( 150) = ( 0.2905825 0.7465374 0.2491087), wk = 0.0037736 k( 151) = ( 0.2878770 0.7395867 0.2682709), wk = 0.0037736 k( 152) = ( 0.2851715 0.7326360 0.2874331), wk = 0.0037736 k( 153) = ( 0.2824660 0.7256852 0.3065953), wk = 0.0037736 k( 154) = ( 0.2797605 0.7187345 0.3257575), wk = 0.0037736 k( 155) = ( 0.2770550 0.7117838 0.3449197), wk = 0.0037736 k( 156) = ( 0.2743495 0.7048331 0.3640819), wk = 0.0037736 k( 157) = ( 0.2716440 0.6978823 0.3832441), wk = 0.0037736 k( 158) = ( 0.2689385 0.6909316 0.4024063), wk = 0.0037736 k( 159) = ( 0.2662330 0.6839809 0.4215685), wk = 0.0037736 k( 160) = ( 0.2635275 0.6770302 0.4407307), wk = 0.0037736 k( 161) = ( 0.2608220 0.6700794 0.4598929), wk = 0.0037736 k( 162) = ( 0.2581165 0.6631287 0.4790551), wk = 0.0037736 k( 163) = ( 0.2554110 0.6561780 0.4982173), wk = 0.0037736 k( 164) = ( 0.2527055 0.6492273 0.5173795), wk = 0.0037736 k( 165) = ( 0.2500000 0.6422766 0.5365417), wk = 0.0037736 k( 166) = ( 0.2500000 0.6422766 0.5365417), wk = 0.0037736 k( 167) = ( 0.2368421 0.6473981 0.5224222), wk = 0.0037736 k( 168) = ( 0.2236842 0.6525197 0.5083027), wk = 0.0037736 k( 169) = ( 0.2105263 0.6576413 0.4941832), wk = 0.0037736 k( 170) = ( 0.1973684 0.6627629 0.4800637), wk = 0.0037736 k( 171) = ( 0.1842105 0.6678845 0.4659441), wk = 0.0037736 k( 172) = ( 0.1710526 0.6730061 0.4518246), wk = 0.0037736 k( 173) = ( 0.1578947 0.6781276 0.4377051), wk = 0.0037736 k( 174) = ( 0.1447368 0.6832492 0.4235856), wk = 0.0037736 k( 175) = ( 0.1315790 0.6883708 0.4094661), wk = 0.0037736 k( 176) = ( 0.1184210 0.6934924 0.3953465), wk = 0.0037736 k( 177) = ( 0.1052632 0.6986140 0.3812270), wk = 0.0037736 k( 178) = ( 0.0921053 0.7037356 0.3671075), wk = 0.0037736 k( 179) = ( 0.0789474 0.7088572 0.3529880), wk = 0.0037736 k( 180) = ( 0.0657895 0.7139787 0.3388685), wk = 0.0037736 k( 181) = ( 0.0526316 0.7191003 0.3247489), wk = 0.0037736 k( 182) = ( 0.0394737 0.7242219 0.3106294), wk = 0.0037736 k( 183) = ( 0.0263158 0.7293435 0.2965099), wk = 0.0037736 k( 184) = ( 0.0131579 0.7344651 0.2823904), wk = 0.0037736 k( 185) = ( 0.0000000 0.7395867 0.2682709), wk = 0.0037736 k( 186) = ( 0.0000000 0.7395867 0.2682709), wk = 0.0037736 k( 187) = ( -0.0155121 0.7349528 0.2810457), wk = 0.0037736 k( 188) = ( -0.0310242 0.7303190 0.2938205), wk = 0.0037736 k( 189) = ( -0.0465363 0.7256852 0.3065953), wk = 0.0037736 k( 190) = ( -0.0620484 0.7210514 0.3193701), wk = 0.0037736 k( 191) = ( -0.0775605 0.7164176 0.3321449), wk = 0.0037736 k( 192) = ( -0.0930726 0.7117838 0.3449197), wk = 0.0037736 k( 193) = ( -0.1085847 0.7071500 0.3576945), wk = 0.0037736 k( 194) = ( -0.1240968 0.7025162 0.3704693), wk = 0.0037736 k( 195) = ( -0.1396089 0.6978823 0.3832441), wk = 0.0037736 k( 196) = ( -0.1551210 0.6932485 0.3960189), wk = 0.0037736 k( 197) = ( -0.1706331 0.6886147 0.4087937), wk = 0.0037736 k( 198) = ( -0.1861452 0.6839809 0.4215685), wk = 0.0037736 k( 199) = ( -0.2016573 0.6793471 0.4343433), wk = 0.0037736 k( 200) = ( -0.2171694 0.6747133 0.4471181), wk = 0.0037736 k( 201) = ( -0.2326815 0.6700794 0.4598929), wk = 0.0037736 k( 202) = ( -0.2481936 0.6654456 0.4726677), wk = 0.0037736 k( 203) = ( -0.2637057 0.6608118 0.4854425), wk = 0.0037736 k( 204) = ( -0.2792178 0.6561780 0.4982173), wk = 0.0037736 k( 205) = ( -0.2947299 0.6515442 0.5109921), wk = 0.0037736 k( 206) = ( -0.3102420 0.6469104 0.5237669), wk = 0.0037736 k( 207) = ( -0.3257541 0.6422766 0.5365417), wk = 0.0037736 k( 208) = ( -0.3257541 0.6422766 0.5365417), wk = 0.0037736 k( 209) = ( -0.3333300 0.6228132 0.5365417), wk = 0.0037736 k( 210) = ( -0.3409059 0.6033499 0.5365417), wk = 0.0037736 k( 211) = ( -0.3484818 0.5838866 0.5365417), wk = 0.0037736 k( 212) = ( -0.3560577 0.5644233 0.5365417), wk = 0.0037736 k( 213) = ( -0.3636336 0.5449600 0.5365417), wk = 0.0037736 k( 214) = ( -0.3712095 0.5254966 0.5365417), wk = 0.0037736 k( 215) = ( -0.3787854 0.5060333 0.5365417), wk = 0.0037736 k( 216) = ( -0.3863613 0.4865700 0.5365417), wk = 0.0037736 k( 217) = ( -0.3939373 0.4671067 0.5365417), wk = 0.0037736 k( 218) = ( -0.4015132 0.4476434 0.5365417), wk = 0.0037736 k( 219) = ( -0.4090891 0.4281800 0.5365417), wk = 0.0037736 k( 220) = ( -0.4166650 0.4087167 0.5365417), wk = 0.0037736 k( 221) = ( -0.4242409 0.3892534 0.5365417), wk = 0.0037736 k( 222) = ( -0.4318168 0.3697901 0.5365417), wk = 0.0037736 k( 223) = ( -0.4393927 0.3503268 0.5365417), wk = 0.0037736 k( 224) = ( -0.4469686 0.3308634 0.5365417), wk = 0.0037736 k( 225) = ( -0.4545445 0.3114001 0.5365417), wk = 0.0037736 k( 226) = ( -0.4621205 0.2919368 0.5365417), wk = 0.0037736 k( 227) = ( -0.4696964 0.2724735 0.5365417), wk = 0.0037736 k( 228) = ( -0.4772723 0.2530102 0.5365417), wk = 0.0037736 k( 229) = ( -0.4848482 0.2335468 0.5365417), wk = 0.0037736 k( 230) = ( -0.4924241 0.2140835 0.5365417), wk = 0.0037736 k( 231) = ( -0.5000000 0.1946202 0.5365417), wk = 0.0037736 k( 232) = ( 0.0000000 0.0000000 0.5365417), wk = 0.0037736 k( 233) = ( 0.0075758 0.0194629 0.5365417), wk = 0.0037736 k( 234) = ( 0.0151515 0.0389259 0.5365417), wk = 0.0037736 k( 235) = ( 0.0227273 0.0583888 0.5365417), wk = 0.0037736 k( 236) = ( 0.0303030 0.0778517 0.5365417), wk = 0.0037736 k( 237) = ( 0.0378788 0.0973146 0.5365417), wk = 0.0037736 k( 238) = ( 0.0454546 0.1167776 0.5365417), wk = 0.0037736 k( 239) = ( 0.0530303 0.1362405 0.5365417), wk = 0.0037736 k( 240) = ( 0.0606061 0.1557034 0.5365417), wk = 0.0037736 k( 241) = ( 0.0681818 0.1751663 0.5365417), wk = 0.0037736 k( 242) = ( 0.0757576 0.1946293 0.5365417), wk = 0.0037736 k( 243) = ( 0.0833333 0.2140922 0.5365417), wk = 0.0037736 k( 244) = ( 0.0909091 0.2335551 0.5365417), wk = 0.0037736 k( 245) = ( 0.0984848 0.2530180 0.5365417), wk = 0.0037736 k( 246) = ( 0.1060606 0.2724810 0.5365417), wk = 0.0037736 k( 247) = ( 0.1136364 0.2919439 0.5365417), wk = 0.0037736 k( 248) = ( 0.1212121 0.3114068 0.5365417), wk = 0.0037736 k( 249) = ( 0.1287879 0.3308697 0.5365417), wk = 0.0037736 k( 250) = ( 0.1363636 0.3503327 0.5365417), wk = 0.0037736 k( 251) = ( 0.1439394 0.3697956 0.5365417), wk = 0.0037736 k( 252) = ( 0.1515151 0.3892585 0.5365417), wk = 0.0037736 k( 253) = ( 0.1590909 0.4087214 0.5365417), wk = 0.0037736 k( 254) = ( 0.1666667 0.4281844 0.5365417), wk = 0.0037736 k( 255) = ( 0.1742424 0.4476473 0.5365417), wk = 0.0037736 k( 256) = ( 0.1818182 0.4671102 0.5365417), wk = 0.0037736 k( 257) = ( 0.1893939 0.4865731 0.5365417), wk = 0.0037736 k( 258) = ( 0.1969697 0.5060361 0.5365417), wk = 0.0037736 k( 259) = ( 0.2045454 0.5254990 0.5365417), wk = 0.0037736 k( 260) = ( 0.2121212 0.5449619 0.5365417), wk = 0.0037736 k( 261) = ( 0.2196970 0.5644249 0.5365417), wk = 0.0037736 k( 262) = ( 0.2272727 0.5838878 0.5365417), wk = 0.0037736 k( 263) = ( 0.2348485 0.6033507 0.5365417), wk = 0.0037736 k( 264) = ( 0.2424242 0.6228136 0.5365417), wk = 0.0037736 k( 265) = ( 0.2500000 0.6422766 0.5365417), wk = 0.0037736 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0037736 k( 3) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0037736 k( 4) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0037736 k( 5) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0037736 k( 6) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0037736 k( 7) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0037736 k( 8) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0037736 k( 9) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0037736 k( 10) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0037736 k( 11) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0037736 k( 12) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0037736 k( 13) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0037736 k( 14) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0037736 k( 15) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0037736 k( 16) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0037736 k( 17) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0037736 k( 18) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0037736 k( 19) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0037736 k( 20) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0037736 k( 21) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0037736 k( 22) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0037736 k( 23) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0037736 k( 24) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0037736 k( 25) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0037736 k( 26) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0037736 k( 27) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 28) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 29) = ( -0.0192308 0.0192308 0.5000000), wk = 0.0037736 k( 30) = ( -0.0384615 0.0384615 0.5000000), wk = 0.0037736 k( 31) = ( -0.0576923 0.0576923 0.5000000), wk = 0.0037736 k( 32) = ( -0.0769231 0.0769231 0.5000000), wk = 0.0037736 k( 33) = ( -0.0961538 0.0961538 0.5000000), wk = 0.0037736 k( 34) = ( -0.1153846 0.1153846 0.5000000), wk = 0.0037736 k( 35) = ( -0.1346154 0.1346154 0.5000000), wk = 0.0037736 k( 36) = ( -0.1538461 0.1538461 0.5000000), wk = 0.0037736 k( 37) = ( -0.1730769 0.1730769 0.5000000), wk = 0.0037736 k( 38) = ( -0.1923077 0.1923077 0.5000000), wk = 0.0037736 k( 39) = ( -0.2115385 0.2115385 0.5000000), wk = 0.0037736 k( 40) = ( -0.2307692 0.2307692 0.5000000), wk = 0.0037736 k( 41) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0037736 k( 42) = ( -0.2692308 0.2692308 0.5000000), wk = 0.0037736 k( 43) = ( -0.2884615 0.2884615 0.5000000), wk = 0.0037736 k( 44) = ( -0.3076923 0.3076923 0.5000000), wk = 0.0037736 k( 45) = ( -0.3269231 0.3269231 0.5000000), wk = 0.0037736 k( 46) = ( -0.3461538 0.3461538 0.5000000), wk = 0.0037736 k( 47) = ( -0.3653846 0.3653846 0.5000000), wk = 0.0037736 k( 48) = ( -0.3846154 0.3846154 0.5000000), wk = 0.0037736 k( 49) = ( -0.4038462 0.4038462 0.5000000), wk = 0.0037736 k( 50) = ( -0.4230769 0.4230769 0.5000000), wk = 0.0037736 k( 51) = ( -0.4423077 0.4423077 0.5000000), wk = 0.0037736 k( 52) = ( -0.4615385 0.4615385 0.5000000), wk = 0.0037736 k( 53) = ( -0.4807692 0.4807692 0.5000000), wk = 0.0037736 k( 54) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 55) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 56) = ( -0.4864865 0.4864865 0.4864865), wk = 0.0037736 k( 57) = ( -0.4729730 0.4729730 0.4729730), wk = 0.0037736 k( 58) = ( -0.4594595 0.4594595 0.4594595), wk = 0.0037736 k( 59) = ( -0.4459459 0.4459459 0.4459460), wk = 0.0037736 k( 60) = ( -0.4324324 0.4324324 0.4324324), wk = 0.0037736 k( 61) = ( -0.4189189 0.4189189 0.4189189), wk = 0.0037736 k( 62) = ( -0.4054054 0.4054054 0.4054054), wk = 0.0037736 k( 63) = ( -0.3918919 0.3918919 0.3918919), wk = 0.0037736 k( 64) = ( -0.3783784 0.3783784 0.3783784), wk = 0.0037736 k( 65) = ( -0.3648649 0.3648649 0.3648649), wk = 0.0037736 k( 66) = ( -0.3513514 0.3513513 0.3513513), wk = 0.0037736 k( 67) = ( -0.3378378 0.3378378 0.3378378), wk = 0.0037736 k( 68) = ( -0.3243243 0.3243243 0.3243243), wk = 0.0037736 k( 69) = ( -0.3108108 0.3108108 0.3108108), wk = 0.0037736 k( 70) = ( -0.2972973 0.2972973 0.2972973), wk = 0.0037736 k( 71) = ( -0.2837838 0.2837838 0.2837838), wk = 0.0037736 k( 72) = ( -0.2702703 0.2702703 0.2702703), wk = 0.0037736 k( 73) = ( -0.2567568 0.2567568 0.2567568), wk = 0.0037736 k( 74) = ( -0.2432432 0.2432432 0.2432432), wk = 0.0037736 k( 75) = ( -0.2297297 0.2297297 0.2297297), wk = 0.0037736 k( 76) = ( -0.2162162 0.2162162 0.2162162), wk = 0.0037736 k( 77) = ( -0.2027027 0.2027027 0.2027027), wk = 0.0037736 k( 78) = ( -0.1891892 0.1891892 0.1891892), wk = 0.0037736 k( 79) = ( -0.1756757 0.1756757 0.1756757), wk = 0.0037736 k( 80) = ( -0.1621622 0.1621622 0.1621622), wk = 0.0037736 k( 81) = ( -0.1486486 0.1486486 0.1486486), wk = 0.0037736 k( 82) = ( -0.1351351 0.1351351 0.1351351), wk = 0.0037736 k( 83) = ( -0.1216216 0.1216216 0.1216216), wk = 0.0037736 k( 84) = ( -0.1081081 0.1081081 0.1081081), wk = 0.0037736 k( 85) = ( -0.0945946 0.0945946 0.0945946), wk = 0.0037736 k( 86) = ( -0.0810811 0.0810811 0.0810811), wk = 0.0037736 k( 87) = ( -0.0675676 0.0675676 0.0675676), wk = 0.0037736 k( 88) = ( -0.0540540 0.0540541 0.0540540), wk = 0.0037736 k( 89) = ( -0.0405405 0.0405405 0.0405405), wk = 0.0037736 k( 90) = ( -0.0270270 0.0270270 0.0270270), wk = 0.0037736 k( 91) = ( -0.0135135 0.0135135 0.0135135), wk = 0.0037736 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 94) = ( 0.0075757 0.0075757 -0.0075757), wk = 0.0037736 k( 95) = ( 0.0151513 0.0151513 -0.0151513), wk = 0.0037736 k( 96) = ( 0.0227270 0.0227270 -0.0227270), wk = 0.0037736 k( 97) = ( 0.0303027 0.0303027 -0.0303027), wk = 0.0037736 k( 98) = ( 0.0378784 0.0378784 -0.0378784), wk = 0.0037736 k( 99) = ( 0.0454541 0.0454541 -0.0454541), wk = 0.0037736 k( 100) = ( 0.0530297 0.0530297 -0.0530297), wk = 0.0037736 k( 101) = ( 0.0606054 0.0606054 -0.0606054), wk = 0.0037736 k( 102) = ( 0.0681811 0.0681811 -0.0681811), wk = 0.0037736 k( 103) = ( 0.0757568 0.0757568 -0.0757568), wk = 0.0037736 k( 104) = ( 0.0833324 0.0833324 -0.0833324), wk = 0.0037736 k( 105) = ( 0.0909081 0.0909081 -0.0909081), wk = 0.0037736 k( 106) = ( 0.0984838 0.0984838 -0.0984838), wk = 0.0037736 k( 107) = ( 0.1060595 0.1060595 -0.1060595), wk = 0.0037736 k( 108) = ( 0.1136351 0.1136351 -0.1136351), wk = 0.0037736 k( 109) = ( 0.1212108 0.1212108 -0.1212108), wk = 0.0037736 k( 110) = ( 0.1287865 0.1287865 -0.1287865), wk = 0.0037736 k( 111) = ( 0.1363622 0.1363622 -0.1363622), wk = 0.0037736 k( 112) = ( 0.1439378 0.1439378 -0.1439378), wk = 0.0037736 k( 113) = ( 0.1515135 0.1515135 -0.1515135), wk = 0.0037736 k( 114) = ( 0.1590892 0.1590892 -0.1590892), wk = 0.0037736 k( 115) = ( 0.1666649 0.1666649 -0.1666649), wk = 0.0037736 k( 116) = ( 0.1742405 0.1742405 -0.1742405), wk = 0.0037736 k( 117) = ( 0.1818162 0.1818162 -0.1818162), wk = 0.0037736 k( 118) = ( 0.1893919 0.1893919 -0.1893919), wk = 0.0037736 k( 119) = ( 0.1969676 0.1969676 -0.1969676), wk = 0.0037736 k( 120) = ( 0.2045432 0.2045432 -0.2045432), wk = 0.0037736 k( 121) = ( 0.2121189 0.2121189 -0.2121189), wk = 0.0037736 k( 122) = ( 0.2196946 0.2196946 -0.2196946), wk = 0.0037736 k( 123) = ( 0.2272703 0.2272703 -0.2272703), wk = 0.0037736 k( 124) = ( 0.2348459 0.2348460 -0.2348460), wk = 0.0037736 k( 125) = ( 0.2424216 0.2424216 -0.2424216), wk = 0.0037736 k( 126) = ( 0.2499973 0.2499973 -0.2499973), wk = 0.0037736 k( 127) = ( 0.2575730 0.2575730 -0.2575730), wk = 0.0037736 k( 128) = ( 0.2651486 0.2651486 -0.2651486), wk = 0.0037736 k( 129) = ( 0.2727243 0.2727243 -0.2727243), wk = 0.0037736 k( 130) = ( 0.2803000 0.2803000 -0.2803000), wk = 0.0037736 k( 131) = ( 0.2878757 0.2878757 -0.2878757), wk = 0.0037736 k( 132) = ( 0.2954514 0.2954514 -0.2954514), wk = 0.0037736 k( 133) = ( 0.3030270 0.3030270 -0.3030270), wk = 0.0037736 k( 134) = ( 0.3106027 0.3106027 -0.3106027), wk = 0.0037736 k( 135) = ( 0.3181784 0.3181784 -0.3181784), wk = 0.0037736 k( 136) = ( 0.3257541 0.3257541 -0.3257541), wk = 0.0037736 k( 137) = ( 0.3257541 0.3257541 -0.3257541), wk = 0.0037736 k( 138) = ( 0.3230485 0.3230485 -0.3051914), wk = 0.0037736 k( 139) = ( 0.3203431 0.3203431 -0.2846288), wk = 0.0037736 k( 140) = ( 0.3176375 0.3176376 -0.2640661), wk = 0.0037736 k( 141) = ( 0.3149321 0.3149321 -0.2435035), wk = 0.0037736 k( 142) = ( 0.3122265 0.3122265 -0.2229408), wk = 0.0037736 k( 143) = ( 0.3095210 0.3095210 -0.2023782), wk = 0.0037736 k( 144) = ( 0.3068155 0.3068155 -0.1818155), wk = 0.0037736 k( 145) = ( 0.3041100 0.3041100 -0.1612529), wk = 0.0037736 k( 146) = ( 0.3014045 0.3014045 -0.1406902), wk = 0.0037736 k( 147) = ( 0.2986990 0.2986990 -0.1201276), wk = 0.0037736 k( 148) = ( 0.2959935 0.2959935 -0.0995650), wk = 0.0037736 k( 149) = ( 0.2932880 0.2932880 -0.0790023), wk = 0.0037736 k( 150) = ( 0.2905825 0.2905825 -0.0584397), wk = 0.0037736 k( 151) = ( 0.2878770 0.2878770 -0.0378770), wk = 0.0037736 k( 152) = ( 0.2851715 0.2851715 -0.0173144), wk = 0.0037736 k( 153) = ( 0.2824660 0.2824660 0.0032483), wk = 0.0037736 k( 154) = ( 0.2797605 0.2797605 0.0238109), wk = 0.0037736 k( 155) = ( 0.2770550 0.2770550 0.0443735), wk = 0.0037736 k( 156) = ( 0.2743495 0.2743495 0.0649362), wk = 0.0037736 k( 157) = ( 0.2716440 0.2716440 0.0854988), wk = 0.0037736 k( 158) = ( 0.2689385 0.2689385 0.1060615), wk = 0.0037736 k( 159) = ( 0.2662330 0.2662330 0.1266241), wk = 0.0037736 k( 160) = ( 0.2635275 0.2635275 0.1471868), wk = 0.0037736 k( 161) = ( 0.2608220 0.2608220 0.1677494), wk = 0.0037736 k( 162) = ( 0.2581165 0.2581165 0.1883121), wk = 0.0037736 k( 163) = ( 0.2554110 0.2554110 0.2088747), wk = 0.0037736 k( 164) = ( 0.2527055 0.2527055 0.2294374), wk = 0.0037736 k( 165) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037736 k( 166) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037736 k( 167) = ( 0.2368421 0.2631579 0.2368421), wk = 0.0037736 k( 168) = ( 0.2236842 0.2763158 0.2236842), wk = 0.0037736 k( 169) = ( 0.2105263 0.2894737 0.2105263), wk = 0.0037736 k( 170) = ( 0.1973684 0.3026316 0.1973684), wk = 0.0037736 k( 171) = ( 0.1842105 0.3157895 0.1842105), wk = 0.0037736 k( 172) = ( 0.1710526 0.3289474 0.1710526), wk = 0.0037736 k( 173) = ( 0.1578947 0.3421053 0.1578947), wk = 0.0037736 k( 174) = ( 0.1447368 0.3552632 0.1447368), wk = 0.0037736 k( 175) = ( 0.1315790 0.3684211 0.1315789), wk = 0.0037736 k( 176) = ( 0.1184210 0.3815789 0.1184210), wk = 0.0037736 k( 177) = ( 0.1052632 0.3947368 0.1052632), wk = 0.0037736 k( 178) = ( 0.0921053 0.4078947 0.0921053), wk = 0.0037736 k( 179) = ( 0.0789474 0.4210526 0.0789474), wk = 0.0037736 k( 180) = ( 0.0657895 0.4342105 0.0657895), wk = 0.0037736 k( 181) = ( 0.0526316 0.4473684 0.0526316), wk = 0.0037736 k( 182) = ( 0.0394737 0.4605263 0.0394737), wk = 0.0037736 k( 183) = ( 0.0263158 0.4736842 0.0263158), wk = 0.0037736 k( 184) = ( 0.0131579 0.4868421 0.0131579), wk = 0.0037736 k( 185) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0037736 k( 186) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0037736 k( 187) = ( -0.0155121 0.5082974 0.0155121), wk = 0.0037736 k( 188) = ( -0.0310242 0.5165948 0.0310242), wk = 0.0037736 k( 189) = ( -0.0465363 0.5248923 0.0465363), wk = 0.0037736 k( 190) = ( -0.0620484 0.5331897 0.0620484), wk = 0.0037736 k( 191) = ( -0.0775605 0.5414871 0.0775605), wk = 0.0037736 k( 192) = ( -0.0930726 0.5497846 0.0930726), wk = 0.0037736 k( 193) = ( -0.1085847 0.5580820 0.1085847), wk = 0.0037736 k( 194) = ( -0.1240968 0.5663794 0.1240968), wk = 0.0037736 k( 195) = ( -0.1396089 0.5746768 0.1396089), wk = 0.0037736 k( 196) = ( -0.1551210 0.5829743 0.1551210), wk = 0.0037736 k( 197) = ( -0.1706331 0.5912717 0.1706331), wk = 0.0037736 k( 198) = ( -0.1861452 0.5995691 0.1861452), wk = 0.0037736 k( 199) = ( -0.2016573 0.6078665 0.2016573), wk = 0.0037736 k( 200) = ( -0.2171694 0.6161640 0.2171694), wk = 0.0037736 k( 201) = ( -0.2326815 0.6244614 0.2326815), wk = 0.0037736 k( 202) = ( -0.2481936 0.6327588 0.2481936), wk = 0.0037736 k( 203) = ( -0.2637057 0.6410562 0.2637057), wk = 0.0037736 k( 204) = ( -0.2792178 0.6493537 0.2792178), wk = 0.0037736 k( 205) = ( -0.2947299 0.6576511 0.2947299), wk = 0.0037736 k( 206) = ( -0.3102420 0.6659485 0.3102420), wk = 0.0037736 k( 207) = ( -0.3257541 0.6742459 0.3257541), wk = 0.0037736 k( 208) = ( -0.3257541 0.6742459 0.3257541), wk = 0.0037736 k( 209) = ( -0.3333300 0.6666700 0.3333300), wk = 0.0037736 k( 210) = ( -0.3409059 0.6590941 0.3409059), wk = 0.0037736 k( 211) = ( -0.3484818 0.6515182 0.3484818), wk = 0.0037736 k( 212) = ( -0.3560577 0.6439423 0.3560577), wk = 0.0037736 k( 213) = ( -0.3636336 0.6363664 0.3636336), wk = 0.0037736 k( 214) = ( -0.3712095 0.6287905 0.3712095), wk = 0.0037736 k( 215) = ( -0.3787854 0.6212146 0.3787854), wk = 0.0037736 k( 216) = ( -0.3863613 0.6136387 0.3863613), wk = 0.0037736 k( 217) = ( -0.3939373 0.6060627 0.3939373), wk = 0.0037736 k( 218) = ( -0.4015132 0.5984868 0.4015132), wk = 0.0037736 k( 219) = ( -0.4090891 0.5909109 0.4090891), wk = 0.0037736 k( 220) = ( -0.4166650 0.5833350 0.4166650), wk = 0.0037736 k( 221) = ( -0.4242409 0.5757591 0.4242409), wk = 0.0037736 k( 222) = ( -0.4318168 0.5681832 0.4318168), wk = 0.0037736 k( 223) = ( -0.4393927 0.5606073 0.4393927), wk = 0.0037736 k( 224) = ( -0.4469686 0.5530314 0.4469686), wk = 0.0037736 k( 225) = ( -0.4545445 0.5454555 0.4545445), wk = 0.0037736 k( 226) = ( -0.4621205 0.5378795 0.4621205), wk = 0.0037736 k( 227) = ( -0.4696964 0.5303036 0.4696964), wk = 0.0037736 k( 228) = ( -0.4772723 0.5227277 0.4772723), wk = 0.0037736 k( 229) = ( -0.4848482 0.5151518 0.4848482), wk = 0.0037736 k( 230) = ( -0.4924241 0.5075759 0.4924241), wk = 0.0037736 k( 231) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037736 k( 232) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 233) = ( 0.0075758 0.0075758 0.4924242), wk = 0.0037736 k( 234) = ( 0.0151515 0.0151515 0.4848485), wk = 0.0037736 k( 235) = ( 0.0227273 0.0227273 0.4772727), wk = 0.0037736 k( 236) = ( 0.0303030 0.0303030 0.4696970), wk = 0.0037736 k( 237) = ( 0.0378788 0.0378788 0.4621212), wk = 0.0037736 k( 238) = ( 0.0454546 0.0454546 0.4545455), wk = 0.0037736 k( 239) = ( 0.0530303 0.0530303 0.4469697), wk = 0.0037736 k( 240) = ( 0.0606061 0.0606061 0.4393939), wk = 0.0037736 k( 241) = ( 0.0681818 0.0681818 0.4318182), wk = 0.0037736 k( 242) = ( 0.0757576 0.0757576 0.4242424), wk = 0.0037736 k( 243) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0037736 k( 244) = ( 0.0909091 0.0909091 0.4090909), wk = 0.0037736 k( 245) = ( 0.0984848 0.0984848 0.4015152), wk = 0.0037736 k( 246) = ( 0.1060606 0.1060606 0.3939394), wk = 0.0037736 k( 247) = ( 0.1136364 0.1136364 0.3863636), wk = 0.0037736 k( 248) = ( 0.1212121 0.1212121 0.3787879), wk = 0.0037736 k( 249) = ( 0.1287879 0.1287879 0.3712121), wk = 0.0037736 k( 250) = ( 0.1363636 0.1363636 0.3636364), wk = 0.0037736 k( 251) = ( 0.1439394 0.1439394 0.3560606), wk = 0.0037736 k( 252) = ( 0.1515151 0.1515151 0.3484849), wk = 0.0037736 k( 253) = ( 0.1590909 0.1590909 0.3409091), wk = 0.0037736 k( 254) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0037736 k( 255) = ( 0.1742424 0.1742424 0.3257576), wk = 0.0037736 k( 256) = ( 0.1818182 0.1818182 0.3181818), wk = 0.0037736 k( 257) = ( 0.1893939 0.1893939 0.3106061), wk = 0.0037736 k( 258) = ( 0.1969697 0.1969697 0.3030303), wk = 0.0037736 k( 259) = ( 0.2045454 0.2045454 0.2954545), wk = 0.0037736 k( 260) = ( 0.2121212 0.2121212 0.2878788), wk = 0.0037736 k( 261) = ( 0.2196970 0.2196970 0.2803030), wk = 0.0037736 k( 262) = ( 0.2272727 0.2272727 0.2727273), wk = 0.0037736 k( 263) = ( 0.2348485 0.2348485 0.2651515), wk = 0.0037736 k( 264) = ( 0.2424242 0.2424242 0.2575758), wk = 0.0037736 k( 265) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037736 Dense grid: 119073 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 52579 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.34 Mb ( 290, 76) NL pseudopotentials 0.37 Mb ( 145, 168) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2479) G-vector shells 0.01 Mb ( 1137) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.35 Mb ( 290, 304) Each subspace H/S matrix 1.41 Mb ( 304, 304) Each matrix 0.39 Mb ( 168, 2, 76) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./SiO2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 47.0 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 58.2 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 69.3 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 80.3 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 91.2 secs Computing kpt #: 6 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 102.4 secs Computing kpt #: 7 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 113.3 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 124.1 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 135.1 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 146.0 secs Computing kpt #: 11 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 157.0 secs Computing kpt #: 12 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 168.1 secs Computing kpt #: 13 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 179.4 secs Computing kpt #: 14 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 190.6 secs Computing kpt #: 15 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 201.6 secs Computing kpt #: 16 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 212.6 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 223.7 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 234.9 secs Computing kpt #: 19 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 246.0 secs Computing kpt #: 20 total cpu time spent up to now is 256.7 secs Computing kpt #: 21 total cpu time spent up to now is 267.9 secs Computing kpt #: 22 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 279.0 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 290.3 secs Computing kpt #: 24 total cpu time spent up to now is 300.1 secs Computing kpt #: 25 total cpu time spent up to now is 311.3 secs Computing kpt #: 26 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 322.8 secs Computing kpt #: 27 total cpu time spent up to now is 332.8 secs Computing kpt #: 28 total cpu time spent up to now is 343.4 secs Computing kpt #: 29 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 354.4 secs Computing kpt #: 30 total cpu time spent up to now is 365.6 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 376.9 secs Computing kpt #: 32 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 388.1 secs Computing kpt #: 33 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 399.4 secs Computing kpt #: 34 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 410.6 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 421.9 secs Computing kpt #: 36 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 433.4 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 444.8 secs Computing kpt #: 38 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 456.3 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 467.9 secs Computing kpt #: 40 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 479.0 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 490.3 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 501.8 secs Computing kpt #: 43 total cpu time spent up to now is 512.2 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 523.4 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 534.5 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 546.0 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 557.4 secs Computing kpt #: 48 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 568.5 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 579.9 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 591.6 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 603.4 secs Computing kpt #: 52 total cpu time spent up to now is 613.8 secs Computing kpt #: 53 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 625.9 secs Computing kpt #: 54 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 637.7 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 648.8 secs Computing kpt #: 56 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 661.0 secs Computing kpt #: 57 total cpu time spent up to now is 671.1 secs Computing kpt #: 58 total cpu time spent up to now is 681.2 secs Computing kpt #: 59 total cpu time spent up to now is 688.6 secs Computing kpt #: 60 total cpu time spent up to now is 696.4 secs Computing kpt #: 61 total cpu time spent up to now is 703.8 secs Computing kpt #: 62 total cpu time spent up to now is 711.1 secs Computing kpt #: 63 total cpu time spent up to now is 719.3 secs Computing kpt #: 64 total cpu time spent up to now is 727.8 secs Computing kpt #: 65 total cpu time spent up to now is 737.2 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 748.4 secs Computing kpt #: 67 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 759.6 secs Computing kpt #: 68 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 770.9 secs Computing kpt #: 69 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 782.1 secs Computing kpt #: 70 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 793.2 secs Computing kpt #: 71 total cpu time spent up to now is 802.0 secs Computing kpt #: 72 total cpu time spent up to now is 811.2 secs Computing kpt #: 73 total cpu time spent up to now is 818.8 secs Computing kpt #: 74 total cpu time spent up to now is 826.3 secs Computing kpt #: 75 total cpu time spent up to now is 833.5 secs Computing kpt #: 76 total cpu time spent up to now is 840.5 secs Computing kpt #: 77 total cpu time spent up to now is 847.3 secs Computing kpt #: 78 total cpu time spent up to now is 854.2 secs Computing kpt #: 79 total cpu time spent up to now is 861.1 secs Computing kpt #: 80 total cpu time spent up to now is 868.2 secs Computing kpt #: 81 total cpu time spent up to now is 877.6 secs Computing kpt #: 82 total cpu time spent up to now is 887.0 secs Computing kpt #: 83 total cpu time spent up to now is 895.2 secs Computing kpt #: 84 total cpu time spent up to now is 905.5 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 916.5 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 927.6 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 938.7 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 949.6 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 960.7 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 971.8 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 982.7 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 993.6 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1004.2 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1015.0 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1025.8 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1036.8 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1047.6 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1058.5 secs Computing kpt #: 99 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1069.3 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1080.2 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1091.0 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1102.0 secs Computing kpt #: 103 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1112.9 secs Computing kpt #: 104 total cpu time spent up to now is 1123.4 secs Computing kpt #: 105 total cpu time spent up to now is 1133.8 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1144.6 secs Computing kpt #: 107 total cpu time spent up to now is 1154.8 secs Computing kpt #: 108 total cpu time spent up to now is 1164.2 secs Computing kpt #: 109 total cpu time spent up to now is 1173.1 secs Computing kpt #: 110 total cpu time spent up to now is 1182.6 secs Computing kpt #: 111 total cpu time spent up to now is 1192.9 secs Computing kpt #: 112 total cpu time spent up to now is 1201.5 secs Computing kpt #: 113 total cpu time spent up to now is 1210.6 secs Computing kpt #: 114 total cpu time spent up to now is 1221.1 secs Computing kpt #: 115 total cpu time spent up to now is 1231.0 secs Computing kpt #: 116 total cpu time spent up to now is 1241.3 secs Computing kpt #: 117 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1252.2 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1263.4 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1274.7 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1285.9 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1297.2 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1308.4 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1319.6 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1330.8 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1341.9 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1352.8 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1363.9 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1374.7 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1385.5 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1396.3 secs Computing kpt #: 131 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1407.1 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1418.0 secs Computing kpt #: 133 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1428.9 secs Computing kpt #: 134 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1439.7 secs Computing kpt #: 135 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1450.6 secs Computing kpt #: 136 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1461.4 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1472.4 secs Computing kpt #: 138 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1483.3 secs Computing kpt #: 139 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1494.3 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1505.4 secs Computing kpt #: 141 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1516.4 secs Computing kpt #: 142 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1527.4 secs Computing kpt #: 143 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1538.5 secs Computing kpt #: 144 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1549.7 secs Computing kpt #: 145 total cpu time spent up to now is 1560.8 secs Computing kpt #: 146 total cpu time spent up to now is 1571.6 secs Computing kpt #: 147 total cpu time spent up to now is 1581.5 secs Computing kpt #: 148 total cpu time spent up to now is 1591.1 secs Computing kpt #: 149 total cpu time spent up to now is 1599.9 secs Computing kpt #: 150 total cpu time spent up to now is 1609.5 secs Computing kpt #: 151 total cpu time spent up to now is 1619.1 secs Computing kpt #: 152 total cpu time spent up to now is 1629.2 secs Computing kpt #: 153 total cpu time spent up to now is 1639.5 secs Computing kpt #: 154 total cpu time spent up to now is 1650.4 secs Computing kpt #: 155 total cpu time spent up to now is 1660.1 secs Computing kpt #: 156 total cpu time spent up to now is 1670.3 secs Computing kpt #: 157 total cpu time spent up to now is 1680.2 secs Computing kpt #: 158 total cpu time spent up to now is 1689.7 secs Computing kpt #: 159 total cpu time spent up to now is 1698.5 secs Computing kpt #: 160 total cpu time spent up to now is 1706.9 secs Computing kpt #: 161 total cpu time spent up to now is 1715.3 secs Computing kpt #: 162 total cpu time spent up to now is 1723.6 secs Computing kpt #: 163 total cpu time spent up to now is 1731.4 secs Computing kpt #: 164 total cpu time spent up to now is 1740.2 secs Computing kpt #: 165 total cpu time spent up to now is 1748.1 secs Computing kpt #: 166 total cpu time spent up to now is 1756.4 secs Computing kpt #: 167 total cpu time spent up to now is 1763.6 secs Computing kpt #: 168 total cpu time spent up to now is 1771.8 secs Computing kpt #: 169 total cpu time spent up to now is 1780.2 secs Computing kpt #: 170 total cpu time spent up to now is 1788.1 secs Computing kpt #: 171 total cpu time spent up to now is 1795.8 secs Computing kpt #: 172 total cpu time spent up to now is 1804.4 secs Computing kpt #: 173 total cpu time spent up to now is 1813.0 secs Computing kpt #: 174 total cpu time spent up to now is 1822.6 secs Computing kpt #: 175 total cpu time spent up to now is 1832.6 secs Computing kpt #: 176 total cpu time spent up to now is 1843.3 secs Computing kpt #: 177 total cpu time spent up to now is 1854.6 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1866.1 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1877.6 secs Computing kpt #: 180 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1889.2 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1900.7 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1912.3 secs Computing kpt #: 183 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1923.8 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1935.2 secs Computing kpt #: 185 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1946.3 secs Computing kpt #: 186 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1957.1 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1968.6 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1980.0 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1991.5 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2002.9 secs Computing kpt #: 191 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2014.2 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2025.6 secs Computing kpt #: 193 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2037.0 secs Computing kpt #: 194 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2048.2 secs Computing kpt #: 195 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2059.5 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2070.7 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2082.0 secs Computing kpt #: 198 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2093.1 secs Computing kpt #: 199 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2104.5 secs Computing kpt #: 200 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2115.6 secs Computing kpt #: 201 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2126.7 secs Computing kpt #: 202 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2137.7 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2148.6 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2159.5 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2170.5 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2181.3 secs Computing kpt #: 207 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2192.2 secs Computing kpt #: 208 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2202.9 secs Computing kpt #: 209 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2213.6 secs Computing kpt #: 210 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2224.4 secs Computing kpt #: 211 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2235.3 secs Computing kpt #: 212 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2246.3 secs Computing kpt #: 213 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2257.5 secs Computing kpt #: 214 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2267.9 secs Computing kpt #: 215 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2278.9 secs Computing kpt #: 216 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2289.9 secs Computing kpt #: 217 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2301.3 secs Computing kpt #: 218 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2312.5 secs Computing kpt #: 219 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2323.5 secs Computing kpt #: 220 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2334.7 secs Computing kpt #: 221 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2345.8 secs Computing kpt #: 222 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2357.0 secs Computing kpt #: 223 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2368.1 secs Computing kpt #: 224 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2379.5 secs Computing kpt #: 225 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2390.6 secs Computing kpt #: 226 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2402.5 secs Computing kpt #: 227 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2414.5 secs Computing kpt #: 228 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2426.5 secs Computing kpt #: 229 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2438.4 secs Computing kpt #: 230 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2450.3 secs Computing kpt #: 231 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2462.0 secs Computing kpt #: 232 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2472.8 secs Computing kpt #: 233 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2483.8 secs Computing kpt #: 234 total cpu time spent up to now is 2493.7 secs Computing kpt #: 235 total cpu time spent up to now is 2503.7 secs Computing kpt #: 236 total cpu time spent up to now is 2513.1 secs Computing kpt #: 237 total cpu time spent up to now is 2522.3 secs Computing kpt #: 238 total cpu time spent up to now is 2531.9 secs Computing kpt #: 239 total cpu time spent up to now is 2541.4 secs Computing kpt #: 240 total cpu time spent up to now is 2551.1 secs Computing kpt #: 241 total cpu time spent up to now is 2561.0 secs Computing kpt #: 242 total cpu time spent up to now is 2571.0 secs Computing kpt #: 243 total cpu time spent up to now is 2580.7 secs Computing kpt #: 244 total cpu time spent up to now is 2591.2 secs Computing kpt #: 245 total cpu time spent up to now is 2601.4 secs Computing kpt #: 246 total cpu time spent up to now is 2611.7 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2623.7 secs Computing kpt #: 248 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2635.9 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2647.7 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2659.1 secs Computing kpt #: 251 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2670.4 secs Computing kpt #: 252 total cpu time spent up to now is 2681.8 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2693.2 secs Computing kpt #: 254 total cpu time spent up to now is 2704.5 secs Computing kpt #: 255 total cpu time spent up to now is 2715.4 secs Computing kpt #: 256 total cpu time spent up to now is 2726.1 secs Computing kpt #: 257 total cpu time spent up to now is 2735.9 secs Computing kpt #: 258 total cpu time spent up to now is 2745.8 secs Computing kpt #: 259 total cpu time spent up to now is 2755.3 secs Computing kpt #: 260 total cpu time spent up to now is 2764.4 secs Computing kpt #: 261 total cpu time spent up to now is 2774.0 secs Computing kpt #: 262 total cpu time spent up to now is 2782.6 secs Computing kpt #: 263 total cpu time spent up to now is 2791.0 secs Computing kpt #: 264 total cpu time spent up to now is 2799.3 secs Computing kpt #: 265 total cpu time spent up to now is 2807.6 secs ethr = 1.56E-11, avg # of iterations =106.0 total cpu time spent up to now is 2807.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6633 PWs) bands (ev): -18.4737 -18.4737 -17.5077 -17.5077 -17.0244 -17.0244 -17.0218 -17.0218 -16.4397 -16.4397 -16.3868 -16.3868 -16.3210 -16.3210 -16.3209 -16.3209 -7.2474 -7.2474 -7.2456 -7.2456 -5.9694 -5.9694 -4.6922 -4.6922 -4.3674 -4.3674 -4.3622 -4.3622 -4.0811 -4.0811 -3.9418 -3.9418 -2.5190 -2.5190 -1.6872 -1.6872 -1.6753 -1.6753 -1.6159 -1.6159 -1.0168 -1.0168 -1.0166 -1.0166 -0.7983 -0.7983 -0.7284 -0.7284 -0.7132 -0.7132 -0.6805 -0.6805 -0.2562 -0.2562 -0.1387 -0.1387 -0.1364 -0.1364 0.2803 0.2803 0.6265 0.6265 0.6442 0.6442 6.6119 6.6119 9.6493 9.6493 9.8503 9.8503 9.9540 9.9540 9.9624 9.9624 10.9104 10.9114 k = 0.0000 0.0000 0.0206 ( 6605 PWs) bands (ev): -18.4732 -18.4732 -17.5097 -17.5097 -17.0238 -17.0238 -17.0209 -17.0208 -16.4396 -16.4395 -16.3869 -16.3868 -16.3210 -16.3210 -16.3209 -16.3209 -7.2483 -7.2482 -7.2459 -7.2459 -5.9674 -5.9672 -4.6917 -4.6915 -4.3678 -4.3676 -4.3626 -4.3624 -4.0817 -4.0812 -3.9425 -3.9424 -2.5188 -2.5186 -1.6873 -1.6867 -1.6751 -1.6751 -1.6150 -1.6147 -1.0185 -1.0180 -1.0175 -1.0168 -0.7999 -0.7969 -0.7322 -0.7291 -0.7158 -0.7155 -0.6763 -0.6757 -0.2560 -0.2557 -0.1399 -0.1391 -0.1372 -0.1368 0.2814 0.2819 0.6264 0.6271 0.6441 0.6442 6.6147 6.6147 9.6482 9.6486 9.8493 9.8499 9.9536 9.9545 9.9625 9.9630 10.9040 10.9054 k = 0.0000 0.0000 0.0413 ( 6609 PWs) bands (ev): -18.4716 -18.4716 -17.5157 -17.5156 -17.0232 -17.0231 -17.0173 -17.0171 -16.4392 -16.4390 -16.3871 -16.3870 -16.3210 -16.3210 -16.3209 -16.3209 -7.2523 -7.2520 -7.2457 -7.2457 -5.9614 -5.9610 -4.6900 -4.6896 -4.3689 -4.3687 -4.3635 -4.3630 -4.0828 -4.0818 -3.9445 -3.9444 -2.5180 -2.5177 -1.6872 -1.6859 -1.6745 -1.6743 -1.6122 -1.6118 -1.0232 -1.0223 -1.0195 -1.0180 -0.8017 -0.7956 -0.7405 -0.7343 -0.7209 -0.7196 -0.6658 -0.6651 -0.2549 -0.2544 -0.1433 -0.1416 -0.1388 -0.1376 0.2850 0.2860 0.6267 0.6280 0.6436 0.6438 6.6229 6.6229 9.6451 9.6459 9.8472 9.8484 9.9520 9.9534 9.9648 9.9660 10.8858 10.8890 k = 0.0000 0.0000 0.0619 ( 6607 PWs) bands (ev): -18.4691 -18.4691 -17.5254 -17.5253 -17.0228 -17.0227 -17.0109 -17.0105 -16.4384 -16.4381 -16.3875 -16.3873 -16.3210 -16.3210 -16.3209 -16.3208 -7.2590 -7.2586 -7.2450 -7.2449 -5.9515 -5.9510 -4.6872 -4.6866 -4.3712 -4.3708 -4.3644 -4.3636 -4.0844 -4.0831 -3.9478 -3.9476 -2.5167 -2.5163 -1.6871 -1.6852 -1.6729 -1.6726 -1.6078 -1.6071 -1.0307 -1.0293 -1.0226 -1.0203 -0.8043 -0.7945 -0.7520 -0.7429 -0.7262 -0.7236 -0.6523 -0.6518 -0.2532 -0.2524 -0.1488 -0.1465 -0.1405 -0.1386 0.2909 0.2924 0.6275 0.6294 0.6430 0.6433 6.6365 6.6365 9.6395 9.6406 9.8444 9.8462 9.9481 9.9496 9.9707 9.9726 10.8634 10.8674 k = 0.0000 0.0000 0.0825 ( 6603 PWs) bands (ev): -18.4655 -18.4655 -17.5384 -17.5382 -17.0224 -17.0223 -17.0022 -17.0018 -16.4373 -16.4370 -16.3880 -16.3878 -16.3210 -16.3210 -16.3209 -16.3208 -7.2682 -7.2677 -7.2439 -7.2438 -5.9380 -5.9372 -4.6833 -4.6825 -4.3747 -4.3743 -4.3652 -4.3642 -4.0866 -4.0848 -3.9524 -3.9521 -2.5149 -2.5143 -1.6871 -1.6847 -1.6700 -1.6696 -1.6018 -1.6010 -1.0404 -1.0387 -1.0265 -1.0236 -0.8083 -0.7940 -0.7656 -0.7530 -0.7319 -0.7278 -0.6369 -0.6367 -0.2509 -0.2498 -0.1562 -0.1533 -0.1426 -0.1399 0.2989 0.3010 0.6287 0.6312 0.6421 0.6425 6.6555 6.6555 9.6302 9.6317 9.8415 9.8440 9.9425 9.9443 9.9797 9.9822 10.8401 10.8444 k = 0.0000 0.0000 0.1032 ( 6603 PWs) bands (ev): -18.4609 -18.4609 -17.5543 -17.5541 -17.0219 -17.0219 -16.9918 -16.9912 -16.4358 -16.4355 -16.3886 -16.3884 -16.3211 -16.3210 -16.3209 -16.3208 -7.2796 -7.2790 -7.2425 -7.2424 -5.9210 -5.9201 -4.6782 -4.6773 -4.3795 -4.3790 -4.3658 -4.3646 -4.0893 -4.0871 -3.9583 -3.9578 -2.5125 -2.5118 -1.6872 -1.6844 -1.6658 -1.6652 -1.5946 -1.5936 -1.0520 -1.0498 -1.0314 -1.0277 -0.8147 -0.7951 -0.7804 -0.7633 -0.7381 -0.7318 -0.6204 -0.6203 -0.2480 -0.2466 -0.1649 -0.1616 -0.1450 -0.1416 0.3086 0.3112 0.6302 0.6334 0.6410 0.6414 6.6797 6.6798 9.6160 9.6179 9.8394 9.8428 9.9360 9.9382 9.9915 9.9944 10.8170 10.8215 k = 0.0000 0.0000 0.1238 ( 6611 PWs) bands (ev): -18.4553 -18.4553 -17.5727 -17.5725 -17.0214 -17.0213 -16.9800 -16.9794 -16.4341 -16.4337 -16.3893 -16.3890 -16.3211 -16.3210 -16.3209 -16.3207 -7.2928 -7.2922 -7.2408 -7.2407 -5.9009 -5.8999 -4.6721 -4.6710 -4.3854 -4.3849 -4.3664 -4.3651 -4.0925 -4.0899 -3.9654 -3.9648 -2.5096 -2.5088 -1.6871 -1.6840 -1.6603 -1.6597 -1.5864 -1.5851 -1.0649 -1.0624 -1.0370 -1.0328 -0.8246 -0.8034 -0.7914 -0.7728 -0.7442 -0.7354 -0.6032 -0.6029 -0.2448 -0.2432 -0.1746 -0.1709 -0.1477 -0.1437 0.3197 0.3228 0.6320 0.6359 0.6397 0.6401 6.7092 6.7092 9.5958 9.5979 9.8388 9.8432 9.9292 9.9320 10.0057 10.0090 10.7948 10.7994 k = 0.0000 0.0000 0.1445 ( 6615 PWs) bands (ev): -18.4487 -18.4487 -17.5931 -17.5929 -17.0208 -17.0207 -16.9673 -16.9667 -16.4321 -16.4316 -16.3902 -16.3898 -16.3211 -16.3210 -16.3209 -16.3207 -7.3076 -7.3069 -7.2389 -7.2388 -5.8782 -5.8770 -4.6650 -4.6636 -4.3923 -4.3917 -4.3670 -4.3655 -4.0960 -4.0931 -3.9736 -3.9730 -2.5062 -2.5052 -1.6867 -1.6834 -1.6539 -1.6531 -1.5772 -1.5757 -1.0786 -1.0759 -1.0434 -1.0385 -0.8383 -0.8210 -0.7974 -0.7811 -0.7495 -0.7383 -0.5854 -0.5849 -0.2414 -0.2395 -0.1850 -0.1810 -0.1506 -0.1460 0.3319 0.3355 0.6336 0.6380 0.6387 0.6393 6.7436 6.7436 9.5687 9.5709 9.8400 9.8457 9.9227 9.9264 10.0224 10.0260 10.7739 10.7786 k = 0.0000 0.0000 0.1651 ( 6611 PWs) bands (ev): -18.4411 -18.4411 -17.6152 -17.6150 -17.0201 -17.0200 -16.9541 -16.9534 -16.4298 -16.4292 -16.3911 -16.3907 -16.3211 -16.3210 -16.3209 -16.3207 -7.3236 -7.3229 -7.2367 -7.2366 -5.8531 -5.8518 -4.6570 -4.6554 -4.4001 -4.3994 -4.3675 -4.3660 -4.1000 -4.0967 -3.9831 -3.9824 -2.5023 -2.5012 -1.6859 -1.6823 -1.6466 -1.6456 -1.5671 -1.5655 -1.0929 -1.0899 -1.0505 -1.0450 -0.8555 -0.8417 -0.8048 -0.7893 -0.7532 -0.7402 -0.5672 -0.5666 -0.2379 -0.2357 -0.1957 -0.1914 -0.1537 -0.1485 0.3448 0.3490 0.6339 0.6365 0.6392 0.6421 6.7829 6.7830 9.5343 9.5366 9.8429 9.8499 9.9175 9.9222 10.0413 10.0451 10.7545 10.7593 k = 0.0000 0.0000 0.1857 ( 6607 PWs) bands (ev): -18.4326 -18.4326 -17.6386 -17.6384 -17.0194 -17.0193 -16.9407 -16.9399 -16.4272 -16.4266 -16.3921 -16.3917 -16.3211 -16.3210 -16.3209 -16.3206 -7.3406 -7.3398 -7.2343 -7.2342 -5.8260 -5.8247 -4.6481 -4.6462 -4.4088 -4.4079 -4.3681 -4.3665 -4.1042 -4.1007 -3.9937 -3.9929 -2.4979 -2.4968 -1.6845 -1.6808 -1.6386 -1.6374 -1.5563 -1.5544 -1.1072 -1.1040 -1.0584 -1.0522 -0.8755 -0.8640 -0.8145 -0.7990 -0.7547 -0.7411 -0.5488 -0.5481 -0.2345 -0.2320 -0.2064 -0.2019 -0.1570 -0.1512 0.3582 0.3629 0.6324 0.6345 0.6415 0.6455 6.8270 6.8270 9.4929 9.4951 9.8462 9.8545 9.9148 9.9206 10.0623 10.0664 10.7368 10.7416 k = 0.0000 0.0000 0.2064 ( 6615 PWs) bands (ev): -18.4232 -18.4232 -17.6631 -17.6629 -17.0186 -17.0185 -16.9273 -16.9265 -16.4244 -16.4237 -16.3931 -16.3927 -16.3211 -16.3211 -16.3209 -16.3206 -7.3581 -7.3573 -7.2318 -7.2317 -5.7975 -5.7961 -4.6384 -4.6362 -4.4181 -4.4171 -4.3685 -4.3669 -4.1087 -4.1050 -4.0053 -4.0045 -2.4931 -2.4919 -1.6827 -1.6789 -1.6301 -1.6286 -1.5446 -1.5425 -1.1214 -1.1180 -1.0669 -1.0601 -0.8974 -0.8874 -0.8260 -0.8106 -0.7547 -0.7412 -0.5304 -0.5297 -0.2315 -0.2286 -0.2167 -0.2120 -0.1602 -0.1539 0.3719 0.3770 0.6301 0.6321 0.6445 0.6490 6.8755 6.8756 9.4446 9.4467 9.8485 9.8574 9.9167 9.9230 10.0852 10.0896 10.7207 10.7256 k = 0.0000 0.0000 0.2270 ( 6611 PWs) bands (ev): -18.4128 -18.4128 -17.6884 -17.6882 -17.0178 -17.0177 -16.9141 -16.9133 -16.4214 -16.4207 -16.3942 -16.3938 -16.3212 -16.3211 -16.3208 -16.3206 -7.3758 -7.3750 -7.2292 -7.2290 -5.7678 -5.7663 -4.6281 -4.6257 -4.4279 -4.4267 -4.3689 -4.3674 -4.1134 -4.1095 -4.0180 -4.0170 -2.4880 -2.4867 -1.6805 -1.6765 -1.6212 -1.6193 -1.5321 -1.5298 -1.1352 -1.1316 -1.0762 -1.0687 -0.9207 -0.9117 -0.8390 -0.8239 -0.7536 -0.7408 -0.5124 -0.5115 -0.2303 -0.2282 -0.2233 -0.2206 -0.1634 -0.1567 0.3856 0.3912 0.6274 0.6295 0.6479 0.6528 6.9284 6.9284 9.3902 9.3921 9.8483 9.8568 9.9246 9.9304 10.1101 10.1147 10.7066 10.7115 k = 0.0000 0.0000 0.2476 ( 6603 PWs) bands (ev): -18.4016 -18.4016 -17.7142 -17.7140 -17.0169 -17.0168 -16.9014 -16.9006 -16.4182 -16.4175 -16.3954 -16.3949 -16.3212 -16.3211 -16.3208 -16.3205 -7.3936 -7.3928 -7.2264 -7.2263 -5.7373 -5.7358 -4.6175 -4.6147 -4.4381 -4.4366 -4.3692 -4.3678 -4.1182 -4.1142 -4.0316 -4.0305 -2.4824 -2.4811 -1.6780 -1.6739 -1.6118 -1.6096 -1.5188 -1.5163 -1.1483 -1.1445 -1.0864 -1.0781 -0.9447 -0.9364 -0.8531 -0.8385 -0.7520 -0.7400 -0.4947 -0.4939 -0.2378 -0.2343 -0.2226 -0.2208 -0.1665 -0.1594 0.3993 0.4053 0.6245 0.6267 0.6515 0.6566 6.9853 6.9854 9.3302 9.3319 9.8455 9.8529 9.9379 9.9426 10.1365 10.1413 10.6942 10.6991 k = 0.0000 0.0000 0.2683 ( 6591 PWs) bands (ev): -18.3896 -18.3896 -17.7404 -17.7402 -17.0160 -17.0160 -16.8893 -16.8885 -16.4149 -16.4142 -16.3965 -16.3961 -16.3212 -16.3211 -16.3208 -16.3205 -7.4112 -7.4104 -7.2236 -7.2235 -5.7065 -5.7049 -4.6068 -4.6035 -4.4482 -4.4463 -4.3693 -4.3681 -4.1232 -4.1191 -4.0460 -4.0448 -2.4766 -2.4752 -1.6753 -1.6711 -1.6022 -1.5996 -1.5045 -1.5019 -1.1605 -1.1567 -1.0977 -1.0886 -0.9689 -0.9611 -0.8683 -0.8541 -0.7501 -0.7390 -0.4777 -0.4769 -0.2466 -0.2427 -0.2206 -0.2180 -0.1695 -0.1620 0.4128 0.4191 0.6212 0.6236 0.6552 0.6605 7.0461 7.0462 9.2652 9.2667 9.8407 9.8471 9.9550 9.9587 10.1644 10.1694 10.6837 10.6885 k = 0.0000 0.0000 0.2889 ( 6587 PWs) bands (ev): -18.3768 -18.3768 -17.7667 -17.7665 -17.0152 -17.0151 -16.8778 -16.8770 -16.4115 -16.4108 -16.3977 -16.3972 -16.3212 -16.3211 -16.3208 -16.3205 -7.4283 -7.4275 -7.2208 -7.2207 -5.6756 -5.6741 -4.5963 -4.5927 -4.4578 -4.4555 -4.3692 -4.3682 -4.1282 -4.1241 -4.0611 -4.0599 -2.4706 -2.4692 -1.6726 -1.6684 -1.5922 -1.5893 -1.4894 -1.4867 -1.1719 -1.1681 -1.1102 -1.1003 -0.9927 -0.9854 -0.8840 -0.8705 -0.7481 -0.7378 -0.4616 -0.4608 -0.2548 -0.2509 -0.2184 -0.2155 -0.1722 -0.1645 0.4261 0.4326 0.6177 0.6202 0.6590 0.6643 7.1105 7.1106 9.1957 9.1970 9.8348 9.8402 9.9747 9.9775 10.1933 10.1985 10.6749 10.6796 k = 0.0000 0.0000 0.3095 ( 6575 PWs) bands (ev): -18.3633 -18.3632 -17.7930 -17.7928 -17.0143 -17.0142 -16.8671 -16.8664 -16.4081 -16.4074 -16.3988 -16.3984 -16.3212 -16.3212 -16.3207 -16.3205 -7.4447 -7.4440 -7.2181 -7.2179 -5.6451 -5.6436 -4.5869 -4.5828 -4.4663 -4.4635 -4.3688 -4.3680 -4.1334 -4.1294 -4.0767 -4.0754 -2.4645 -2.4631 -1.6701 -1.6659 -1.5818 -1.5785 -1.4734 -1.4706 -1.1824 -1.1788 -1.1241 -1.1136 -1.0155 -1.0087 -0.9002 -0.8872 -0.7461 -0.7367 -0.4465 -0.4457 -0.2621 -0.2582 -0.2164 -0.2133 -0.1748 -0.1670 0.4389 0.4457 0.6138 0.6166 0.6627 0.6680 7.1782 7.1783 9.1224 9.1235 9.8281 9.8328 9.9962 9.9983 10.2231 10.2284 10.6678 10.6723 k = 0.0000 0.0000 0.3302 ( 6579 PWs) bands (ev): -18.3491 -18.3491 -17.8191 -17.8189 -17.0135 -17.0134 -16.8573 -16.8566 -16.4047 -16.4040 -16.3999 -16.3994 -16.3212 -16.3212 -16.3207 -16.3204 -7.4602 -7.4596 -7.2154 -7.2152 -5.6153 -5.6139 -4.5794 -4.5748 -4.4728 -4.4694 -4.3682 -4.3673 -4.1389 -4.1351 -4.0925 -4.0912 -2.4583 -2.4569 -1.6679 -1.6639 -1.5709 -1.5672 -1.4565 -1.4537 -1.1923 -1.1889 -1.1394 -1.1285 -1.0369 -1.0308 -0.9162 -0.9039 -0.7442 -0.7357 -0.4327 -0.4320 -0.2682 -0.2644 -0.2147 -0.2115 -0.1772 -0.1693 0.4514 0.4583 0.6097 0.6127 0.6665 0.6716 7.2489 7.2490 9.0457 9.0466 9.8212 9.8253 10.0186 10.0202 10.2533 10.2586 10.6622 10.6664 k = 0.0000 0.0000 0.3508 ( 6575 PWs) bands (ev): -18.3344 -18.3344 -17.8448 -17.8446 -17.0127 -17.0126 -16.8483 -16.8476 -16.4018 -16.4012 -16.4006 -16.4000 -16.3213 -16.3212 -16.3207 -16.3204 -7.4748 -7.4741 -7.2128 -7.2127 -5.5867 -5.5853 -4.5747 -4.5700 -4.4759 -4.4720 -4.3671 -4.3659 -4.1451 -4.1419 -4.1077 -4.1067 -2.4521 -2.4508 -1.6663 -1.6624 -1.5592 -1.5553 -1.4388 -1.4360 -1.2022 -1.1992 -1.1554 -1.1446 -1.0568 -1.0516 -0.9318 -0.9203 -0.7424 -0.7348 -0.4204 -0.4198 -0.2731 -0.2694 -0.2134 -0.2101 -0.1793 -0.1715 0.4634 0.4705 0.6053 0.6085 0.6701 0.6751 7.3223 7.3224 8.9663 8.9671 9.8144 9.8179 10.0416 10.0428 10.2834 10.2888 10.6579 10.6618 k = 0.0000 0.0000 0.3715 ( 6583 PWs) bands (ev): -18.3194 -18.3194 -17.8699 -17.8697 -17.0119 -17.0119 -16.8402 -16.8396 -16.4020 -16.4017 -16.3980 -16.3975 -16.3213 -16.3212 -16.3207 -16.3204 -7.4881 -7.4875 -7.2104 -7.2103 -5.5595 -5.5582 -4.5736 -4.5690 -4.4751 -4.4709 -4.3654 -4.3636 -4.1530 -4.1509 -4.1211 -4.1206 -2.4462 -2.4449 -1.6652 -1.6615 -1.5468 -1.5426 -1.4203 -1.4175 -1.2133 -1.2107 -1.1707 -1.1605 -1.0752 -1.0712 -0.9466 -0.9359 -0.7407 -0.7340 -0.4098 -0.4093 -0.2765 -0.2730 -0.2124 -0.2091 -0.1812 -0.1737 0.4750 0.4820 0.6006 0.6041 0.6736 0.6782 7.3980 7.3980 8.8847 8.8854 9.8078 9.8108 10.0644 10.0653 10.3130 10.3182 10.6547 10.6582 k = 0.0000 0.0000 0.3921 ( 6573 PWs) bands (ev): -18.3041 -18.3041 -17.8941 -17.8940 -17.0112 -17.0112 -16.8331 -16.8326 -16.4029 -16.4026 -16.3951 -16.3946 -16.3213 -16.3212 -16.3206 -16.3204 -7.5002 -7.4997 -7.2082 -7.2080 -5.5343 -5.5330 -4.5758 -4.5718 -4.4707 -4.4664 -4.3627 -4.3602 -4.1640 -4.1634 -4.1317 -4.1307 -2.4405 -2.4394 -1.6646 -1.6613 -1.5333 -1.5290 -1.4013 -1.3985 -1.2274 -1.2246 -1.1833 -1.1745 -1.0928 -1.0899 -0.9600 -0.9503 -0.7392 -0.7333 -0.4011 -0.4008 -0.2783 -0.2749 -0.2117 -0.2086 -0.1829 -0.1758 0.4860 0.4931 0.5957 0.5994 0.6769 0.6811 7.4754 7.4755 8.8016 8.8022 9.8016 9.8042 10.0866 10.0873 10.3413 10.3463 10.6524 10.6553 k = 0.0000 0.0000 0.4127 ( 6556 PWs) bands (ev): -18.2889 -18.2889 -17.9172 -17.9171 -17.0106 -17.0105 -16.8270 -16.8265 -16.4037 -16.4034 -16.3924 -16.3919 -16.3213 -16.3212 -16.3206 -16.3204 -7.5108 -7.5104 -7.2061 -7.2060 -5.5113 -5.5102 -4.5804 -4.5770 -4.4640 -4.4597 -4.3585 -4.3554 -4.1791 -4.1785 -4.1390 -4.1374 -2.4352 -2.4342 -1.6646 -1.6616 -1.5190 -1.5145 -1.3818 -1.3791 -1.2452 -1.2418 -1.1922 -1.1850 -1.1101 -1.1083 -0.9717 -0.9632 -0.7379 -0.7328 -0.3944 -0.3942 -0.2785 -0.2754 -0.2114 -0.2085 -0.1843 -0.1778 0.4966 0.5035 0.5904 0.5944 0.6798 0.6836 7.5540 7.5541 8.7179 8.7183 9.7960 9.7981 10.1076 10.1081 10.3678 10.3724 10.6506 10.6530 k = 0.0000 0.0000 0.4334 ( 6546 PWs) bands (ev): -18.2742 -18.2741 -17.9387 -17.9386 -17.0100 -17.0100 -16.8217 -16.8213 -16.4044 -16.4042 -16.3900 -16.3896 -16.3213 -16.3212 -16.3206 -16.3204 -7.5200 -7.5196 -7.2044 -7.2043 -5.4910 -5.4900 -4.5861 -4.5833 -4.4565 -4.4524 -4.3525 -4.3488 -4.1966 -4.1953 -4.1438 -4.1421 -2.4305 -2.4296 -1.6649 -1.6624 -1.5037 -1.4992 -1.3624 -1.3598 -1.2651 -1.2612 -1.1982 -1.1923 -1.1274 -1.1266 -0.9815 -0.9743 -0.7367 -0.7325 -0.3896 -0.3895 -0.2773 -0.2745 -0.2115 -0.2088 -0.1854 -0.1797 0.5066 0.5134 0.5848 0.5891 0.6825 0.6858 7.6330 7.6330 8.6343 8.6347 9.7910 9.7928 10.1267 10.1271 10.3917 10.3958 10.6492 10.6510 k = 0.0000 0.0000 0.4540 ( 6544 PWs) bands (ev): -18.2603 -18.2602 -17.9581 -17.9581 -17.0096 -17.0095 -16.8174 -16.8171 -16.4049 -16.4048 -16.3880 -16.3876 -16.3213 -16.3213 -16.3206 -16.3204 -7.5276 -7.5273 -7.2029 -7.2028 -5.4737 -5.4729 -4.5919 -4.5897 -4.4494 -4.4456 -4.3442 -4.3402 -4.2150 -4.2132 -4.1471 -4.1455 -2.4264 -2.4257 -1.6655 -1.6634 -1.4877 -1.4833 -1.3438 -1.3418 -1.2846 -1.2809 -1.2025 -1.1977 -1.1447 -1.1445 -0.9894 -0.9835 -0.7357 -0.7323 -0.3863 -0.3863 -0.2751 -0.2727 -0.2118 -0.2096 -0.1862 -0.1814 0.5162 0.5228 0.5790 0.5835 0.6848 0.6875 7.7109 7.7109 8.5525 8.5528 9.7868 9.7883 10.1435 10.1438 10.4123 10.4158 10.6480 10.6493 k = 0.0000 0.0000 0.4746 ( 6548 PWs) bands (ev): -18.2479 -18.2479 -17.9748 -17.9748 -17.0092 -17.0092 -16.8141 -16.8139 -16.4054 -16.4053 -16.3863 -16.3861 -16.3213 -16.3213 -16.3205 -16.3204 -7.5336 -7.5333 -7.2017 -7.2017 -5.4598 -5.4591 -4.5970 -4.5954 -4.4433 -4.4402 -4.3335 -4.3294 -4.2337 -4.2314 -4.1494 -4.1481 -2.4231 -2.4225 -1.6661 -1.6645 -1.4715 -1.4673 -1.3307 -1.3301 -1.2974 -1.2955 -1.2062 -1.2023 -1.1616 -1.1614 -0.9952 -0.9907 -0.7348 -0.7323 -0.3844 -0.3843 -0.2724 -0.2705 -0.2123 -0.2106 -0.1866 -0.1829 0.5252 0.5315 0.5729 0.5776 0.6868 0.6888 7.7854 7.7855 8.4749 8.4751 9.7835 9.7846 10.1572 10.1575 10.4291 10.4319 10.6469 10.6478 k = 0.0000 0.0000 0.4953 ( 6558 PWs) bands (ev): -18.2380 -18.2380 -17.9879 -17.9878 -17.0089 -17.0089 -16.8117 -16.8116 -16.4057 -16.4056 -16.3851 -16.3849 -16.3213 -16.3213 -16.3205 -16.3205 -7.5378 -7.5377 -7.2009 -7.2008 -5.4496 -5.4491 -4.6010 -4.5999 -4.4388 -4.4365 -4.3206 -4.3166 -4.2522 -4.2496 -4.1509 -4.1500 -2.4206 -2.4202 -1.6665 -1.6655 -1.4558 -1.4522 -1.3369 -1.3340 -1.2929 -1.2911 -1.2106 -1.2075 -1.1761 -1.1757 -0.9990 -0.9961 -0.7341 -0.7324 -0.3833 -0.3832 -0.2699 -0.2685 -0.2128 -0.2117 -0.1868 -0.1842 0.5336 0.5394 0.5668 0.5715 0.6883 0.6896 7.8521 7.8521 8.4060 8.4061 9.7812 9.7819 10.1675 10.1677 10.4416 10.4435 10.6461 10.6467 k = 0.0000 0.0000 0.5159 ( 6552 PWs) bands (ev): -18.2315 -18.2315 -17.9962 -17.9962 -17.0088 -17.0088 -16.8103 -16.8102 -16.4059 -16.4059 -16.3843 -16.3843 -16.3213 -16.3213 -16.3205 -16.3205 -7.5404 -7.5403 -7.2003 -7.2003 -5.4433 -5.4431 -4.6034 -4.6029 -4.4358 -4.4346 -4.3059 -4.3023 -4.2701 -4.2673 -4.1516 -4.1512 -2.4191 -2.4189 -1.6668 -1.6662 -1.4429 -1.4405 -1.3483 -1.3461 -1.2805 -1.2790 -1.2164 -1.2144 -1.1852 -1.1849 -1.0010 -0.9995 -0.7335 -0.7326 -0.3827 -0.3827 -0.2679 -0.2671 -0.2131 -0.2126 -0.1865 -0.1853 0.5412 0.5458 0.5613 0.5654 0.6893 0.6900 7.9021 7.9021 8.3546 8.3547 9.7798 9.7802 10.1738 10.1739 10.4495 10.4505 10.6456 10.6458 k = 0.0000 0.0000 0.5365 ( 6542 PWs) bands (ev): -18.2292 -18.2292 -17.9991 -17.9991 -17.0087 -17.0087 -16.8098 -16.8098 -16.4060 -16.4060 -16.3841 -16.3841 -16.3213 -16.3213 -16.3205 -16.3205 -7.5412 -7.5412 -7.2002 -7.2002 -5.4411 -5.4411 -4.6041 -4.6041 -4.4344 -4.4344 -4.2923 -4.2923 -4.2815 -4.2815 -4.1517 -4.1517 -2.4185 -2.4185 -1.6667 -1.6667 -1.4366 -1.4366 -1.3525 -1.3525 -1.2737 -1.2737 -1.2193 -1.2193 -1.1879 -1.1879 -1.0011 -1.0011 -0.7330 -0.7330 -0.3825 -0.3825 -0.2669 -0.2669 -0.2131 -0.2131 -0.1860 -0.1860 0.5468 0.5468 0.5605 0.5605 0.6899 0.6899 7.9216 7.9216 8.3346 8.3346 9.7795 9.7795 10.1760 10.1760 10.4525 10.4525 10.6455 10.6455 k = 0.0000 0.0000 0.5365 ( 6542 PWs) bands (ev): -18.2292 -18.2292 -17.9991 -17.9991 -17.0087 -17.0087 -16.8098 -16.8098 -16.4060 -16.4060 -16.3841 -16.3841 -16.3213 -16.3213 -16.3205 -16.3205 -7.5412 -7.5412 -7.2002 -7.2002 -5.4411 -5.4411 -4.6041 -4.6041 -4.4344 -4.4344 -4.2923 -4.2923 -4.2815 -4.2815 -4.1517 -4.1517 -2.4185 -2.4185 -1.6667 -1.6667 -1.4366 -1.4366 -1.3525 -1.3525 -1.2737 -1.2737 -1.2193 -1.2193 -1.1879 -1.1879 -1.0011 -1.0011 -0.7330 -0.7330 -0.3825 -0.3825 -0.2669 -0.2669 -0.2131 -0.2131 -0.1860 -0.1860 0.5468 0.5468 0.5605 0.5605 0.6899 0.6899 7.9216 7.9216 8.3346 8.3346 9.7795 9.7795 10.1760 10.1760 10.4525 10.4525 10.6455 10.6455 k =-0.0192 0.0075 0.5365 ( 6558 PWs) bands (ev): -18.2287 -18.2287 -17.9991 -17.9991 -17.0146 -17.0145 -16.8044 -16.8043 -16.4061 -16.4061 -16.3840 -16.3840 -16.3226 -16.3223 -16.3194 -16.3192 -7.5488 -7.5486 -7.1919 -7.1916 -5.4405 -5.4404 -4.6063 -4.6057 -4.4348 -4.4345 -4.2925 -4.2923 -4.2827 -4.2824 -4.1500 -4.1496 -2.4183 -2.4182 -1.6669 -1.6665 -1.4395 -1.4386 -1.3621 -1.3613 -1.2741 -1.2735 -1.2179 -1.2169 -1.1805 -1.1778 -1.0020 -1.0008 -0.7329 -0.7320 -0.3827 -0.3825 -0.2670 -0.2665 -0.2132 -0.2124 -0.1865 -0.1861 0.5465 0.5470 0.5603 0.5605 0.6897 0.6903 7.9236 7.9237 8.3358 8.3359 9.7806 9.7809 10.1758 10.1758 10.4514 10.4525 10.6467 10.6480 k =-0.0385 0.0150 0.5365 ( 6548 PWs) bands (ev): -18.2271 -18.2271 -17.9991 -17.9991 -17.0305 -17.0303 -16.7899 -16.7896 -16.4064 -16.4064 -16.3838 -16.3837 -16.3241 -16.3238 -16.3179 -16.3177 -7.5692 -7.5689 -7.1687 -7.1682 -5.4386 -5.4384 -4.6124 -4.6113 -4.4358 -4.4352 -4.2930 -4.2925 -4.2859 -4.2852 -4.1447 -4.1438 -2.4176 -2.4174 -1.6672 -1.6664 -1.4473 -1.4452 -1.3845 -1.3837 -1.2745 -1.2735 -1.2144 -1.2124 -1.1586 -1.1540 -1.0033 -1.0009 -0.7318 -0.7298 -0.3829 -0.3826 -0.2667 -0.2656 -0.2128 -0.2112 -0.1875 -0.1867 0.5462 0.5471 0.5599 0.5604 0.6896 0.6908 7.9296 7.9297 8.3394 8.3396 9.7843 9.7848 10.1751 10.1751 10.4494 10.4514 10.6516 10.6542 k =-0.0577 0.0225 0.5365 ( 6556 PWs) bands (ev): -18.2245 -18.2244 -17.9990 -17.9990 -17.0533 -17.0530 -16.7693 -16.7690 -16.4070 -16.4069 -16.3835 -16.3834 -16.3256 -16.3253 -16.3164 -16.3162 -7.5986 -7.5982 -7.1347 -7.1340 -5.4354 -5.4351 -4.6223 -4.6206 -4.4373 -4.4364 -4.2941 -4.2929 -4.2903 -4.2889 -4.1365 -4.1353 -2.4164 -2.4162 -1.6678 -1.6664 -1.4601 -1.4567 -1.4121 -1.4112 -1.2754 -1.2743 -1.2097 -1.2070 -1.1293 -1.1233 -1.0046 -1.0008 -0.7295 -0.7266 -0.3832 -0.3828 -0.2660 -0.2645 -0.2120 -0.2096 -0.1890 -0.1876 0.5458 0.5472 0.5593 0.5602 0.6897 0.6915 7.9397 7.9398 8.3454 8.3456 9.7905 9.7912 10.1739 10.1739 10.4466 10.4495 10.6597 10.6633 k =-0.0769 0.0299 0.5365 ( 6566 PWs) bands (ev): -18.2208 -18.2207 -17.9989 -17.9989 -17.0803 -17.0799 -16.7453 -16.7449 -16.4077 -16.4075 -16.3831 -16.3829 -16.3271 -16.3267 -16.3149 -16.3147 -7.6332 -7.6328 -7.0934 -7.0926 -5.4308 -5.4305 -4.6359 -4.6337 -4.4391 -4.4379 -4.2975 -4.2961 -4.2928 -4.2915 -4.1262 -4.1247 -2.4148 -2.4146 -1.6686 -1.6669 -1.4791 -1.4742 -1.4388 -1.4371 -1.2774 -1.2764 -1.2042 -1.2007 -1.0981 -1.0904 -1.0046 -0.9992 -0.7262 -0.7224 -0.3836 -0.3831 -0.2649 -0.2630 -0.2112 -0.2076 -0.1908 -0.1886 0.5453 0.5471 0.5587 0.5598 0.6899 0.6923 7.9537 7.9539 8.3537 8.3541 9.7991 9.8001 10.1720 10.1720 10.4432 10.4468 10.6698 10.6744 k =-0.0962 0.0374 0.5365 ( 6570 PWs) bands (ev): -18.2161 -18.2160 -17.9987 -17.9987 -17.1098 -17.1094 -16.7195 -16.7192 -16.4085 -16.4084 -16.3826 -16.3824 -16.3286 -16.3282 -16.3134 -16.3132 -7.6706 -7.6702 -7.0475 -7.0465 -5.4251 -5.4246 -4.6530 -4.6504 -4.4413 -4.4399 -4.3026 -4.3016 -4.2934 -4.2927 -4.1144 -4.1127 -2.4128 -2.4125 -1.6702 -1.6681 -1.5045 -1.4991 -1.4604 -1.4583 -1.2807 -1.2798 -1.1987 -1.1946 -1.0693 -1.0598 -1.0005 -0.9933 -0.7219 -0.7172 -0.3842 -0.3836 -0.2634 -0.2613 -0.2106 -0.2055 -0.1930 -0.1895 0.5448 0.5470 0.5579 0.5592 0.6903 0.6933 7.9716 7.9719 8.3645 8.3649 9.8101 9.8114 10.1692 10.1693 10.4393 10.4435 10.6798 10.6850 k =-0.1154 0.0449 0.5365 ( 6566 PWs) bands (ev): -18.2103 -18.2102 -17.9985 -17.9985 -17.1409 -17.1405 -16.6930 -16.6927 -16.4095 -16.4093 -16.3820 -16.3818 -16.3300 -16.3296 -16.3119 -16.3117 -7.7091 -7.7088 -6.9985 -6.9974 -5.4181 -5.4176 -4.6732 -4.6703 -4.4439 -4.4422 -4.3081 -4.3071 -4.2940 -4.2935 -4.1017 -4.0999 -2.4104 -2.4100 -1.6732 -1.6706 -1.5331 -1.5279 -1.4777 -1.4758 -1.2853 -1.2846 -1.1944 -1.1897 -1.0480 -1.0383 -0.9855 -0.9786 -0.7165 -0.7110 -0.3850 -0.3842 -0.2617 -0.2593 -0.2108 -0.2037 -0.1950 -0.1897 0.5442 0.5468 0.5569 0.5585 0.6909 0.6943 7.9934 7.9937 8.3776 8.3781 9.8234 9.8250 10.1652 10.1655 10.4349 10.4396 10.6846 10.6899 k =-0.1346 0.0524 0.5365 ( 6574 PWs) bands (ev): -18.2035 -18.2035 -17.9983 -17.9983 -17.1730 -17.1725 -16.6664 -16.6661 -16.4105 -16.4103 -16.3814 -16.3811 -16.3314 -16.3310 -16.3104 -16.3103 -7.7479 -7.7476 -6.9475 -6.9463 -5.4100 -5.4094 -4.6963 -4.6931 -4.4470 -4.4451 -4.3134 -4.3123 -4.2947 -4.2943 -4.0887 -4.0868 -2.4076 -2.4071 -1.6786 -1.6758 -1.5609 -1.5560 -1.4931 -1.4914 -1.2911 -1.2905 -1.1922 -1.1871 -1.0353 -1.0275 -0.9580 -0.9537 -0.7103 -0.7039 -0.3859 -0.3850 -0.2598 -0.2573 -0.2120 -0.2034 -0.1957 -0.1890 0.5436 0.5466 0.5559 0.5576 0.6917 0.6955 8.0189 8.0193 8.3930 8.3936 9.8389 9.8408 10.1597 10.1602 10.4299 10.4350 10.6757 10.6803 k =-0.1538 0.0599 0.5365 ( 6572 PWs) bands (ev): -18.1958 -18.1957 -17.9981 -17.9981 -17.2056 -17.2052 -16.6401 -16.6398 -16.4117 -16.4114 -16.3807 -16.3805 -16.3327 -16.3323 -16.3090 -16.3089 -7.7863 -7.7861 -6.8950 -6.8938 -5.4008 -5.4001 -4.7219 -4.7185 -4.4507 -4.4487 -4.3181 -4.3169 -4.2954 -4.2951 -4.0756 -4.0737 -2.4044 -2.4039 -1.6881 -1.6853 -1.5849 -1.5804 -1.5073 -1.5056 -1.2980 -1.2974 -1.1930 -1.1877 -1.0267 -1.0204 -0.9249 -0.9227 -0.7031 -0.6960 -0.3869 -0.3860 -0.2581 -0.2554 -0.2140 -0.2051 -0.1945 -0.1875 0.5430 0.5463 0.5548 0.5566 0.6926 0.6969 8.0481 8.0485 8.4106 8.4113 9.8564 9.8586 10.1521 10.1528 10.4240 10.4293 10.6499 10.6534 k =-0.1731 0.0674 0.5365 ( 6578 PWs) bands (ev): -18.1871 -18.1870 -17.9979 -17.9978 -17.2385 -17.2380 -16.6143 -16.6140 -16.4128 -16.4126 -16.3801 -16.3798 -16.3340 -16.3336 -16.3077 -16.3076 -7.8239 -7.8236 -6.8417 -6.8404 -5.3906 -5.3899 -4.7498 -4.7463 -4.4553 -4.4530 -4.3220 -4.3207 -4.2963 -4.2960 -4.0626 -4.0607 -2.4010 -2.4005 -1.7032 -1.7009 -1.6028 -1.5986 -1.5203 -1.5185 -1.3059 -1.3052 -1.1970 -1.1918 -1.0184 -1.0128 -0.8905 -0.8897 -0.6952 -0.6874 -0.3881 -0.3871 -0.2567 -0.2540 -0.2163 -0.2076 -0.1924 -0.1855 0.5424 0.5459 0.5536 0.5556 0.6938 0.6983 8.0809 8.0814 8.4305 8.4312 9.8755 9.8783 10.1416 10.1428 10.4165 10.4220 10.6124 10.6151 k =-0.1923 0.0749 0.5365 ( 6578 PWs) bands (ev): -18.1775 -18.1773 -17.9976 -17.9976 -17.2714 -17.2710 -16.5893 -16.5890 -16.4140 -16.4138 -16.3794 -16.3791 -16.3353 -16.3348 -16.3063 -16.3063 -7.8602 -7.8600 -6.7880 -6.7866 -5.3795 -5.3787 -4.7796 -4.7760 -4.4609 -4.4584 -4.3251 -4.3237 -4.2971 -4.2969 -4.0501 -4.0481 -2.3974 -2.3967 -1.7240 -1.7223 -1.6147 -1.6108 -1.5317 -1.5298 -1.3145 -1.3138 -1.2041 -1.1991 -1.0089 -1.0039 -0.8565 -0.8561 -0.6865 -0.6781 -0.3895 -0.3884 -0.2563 -0.2534 -0.2181 -0.2099 -0.1902 -0.1835 0.5418 0.5455 0.5523 0.5544 0.6950 0.6999 8.1171 8.1176 8.4524 8.4533 9.8961 9.8993 10.1276 10.1294 10.4064 10.4119 10.5681 10.5703 k =-0.2115 0.0823 0.5365 ( 6572 PWs) bands (ev): -18.1670 -18.1668 -17.9973 -17.9973 -17.3042 -17.3038 -16.5652 -16.5649 -16.4152 -16.4150 -16.3788 -16.3785 -16.3365 -16.3360 -16.3051 -16.3050 -7.8952 -7.8950 -6.7340 -6.7326 -5.3676 -5.3667 -4.8110 -4.8073 -4.4675 -4.4650 -4.3271 -4.3257 -4.2980 -4.2978 -4.0380 -4.0361 -2.3935 -2.3929 -1.7486 -1.7474 -1.6227 -1.6188 -1.5411 -1.5391 -1.3238 -1.3230 -1.2140 -1.2093 -0.9982 -0.9937 -0.8236 -0.8227 -0.6772 -0.6682 -0.3912 -0.3899 -0.2571 -0.2540 -0.2191 -0.2114 -0.1881 -0.1815 0.5412 0.5451 0.5510 0.5532 0.6965 0.7015 8.1566 8.1572 8.4765 8.4773 9.9172 9.9212 10.1095 10.1121 10.3912 10.3964 10.5213 10.5233 k =-0.2308 0.0898 0.5365 ( 6580 PWs) bands (ev): -18.1556 -18.1555 -17.9970 -17.9970 -17.3368 -17.3364 -16.5422 -16.5419 -16.4164 -16.4162 -16.3781 -16.3778 -16.3376 -16.3372 -16.3039 -16.3038 -7.9285 -7.9284 -6.6802 -6.6787 -5.3549 -5.3540 -4.8437 -4.8400 -4.4752 -4.4726 -4.3282 -4.3268 -4.2989 -4.2987 -4.0265 -4.0247 -2.3896 -2.3889 -1.7749 -1.7739 -1.6288 -1.6250 -1.5480 -1.5459 -1.3336 -1.3328 -1.2262 -1.2218 -0.9864 -0.9824 -0.7917 -0.7904 -0.6672 -0.6577 -0.3930 -0.3915 -0.2595 -0.2561 -0.2187 -0.2117 -0.1863 -0.1798 0.5406 0.5446 0.5497 0.5519 0.6980 0.7032 8.1993 8.1998 8.5024 8.5033 9.9373 9.9424 10.0871 10.0910 10.3665 10.3710 10.4784 10.4807 k =-0.2500 0.0973 0.5365 ( 6574 PWs) bands (ev): -18.1435 -18.1433 -17.9967 -17.9967 -17.3690 -17.3686 -16.5203 -16.5200 -16.4176 -16.4173 -16.3775 -16.3772 -16.3387 -16.3383 -16.3027 -16.3027 -7.9601 -7.9600 -6.6268 -6.6253 -5.3417 -5.3408 -4.8774 -4.8737 -4.4839 -4.4813 -4.3284 -4.3270 -4.2999 -4.2997 -4.0158 -4.0139 -2.3855 -2.3848 -1.8014 -1.8006 -1.6345 -1.6308 -1.5522 -1.5500 -1.3438 -1.3429 -1.2401 -1.2359 -0.9741 -0.9705 -0.7611 -0.7593 -0.6568 -0.6468 -0.3951 -0.3932 -0.2633 -0.2596 -0.2172 -0.2109 -0.1849 -0.1785 0.5401 0.5441 0.5485 0.5506 0.6997 0.7049 8.2449 8.2455 8.5301 8.5311 9.9523 9.9588 10.0634 10.0691 10.3279 10.3316 10.4466 10.4493 k =-0.2692 0.1048 0.5365 ( 6570 PWs) bands (ev): -18.1306 -18.1304 -17.9964 -17.9964 -17.4006 -17.4002 -16.4997 -16.4994 -16.4187 -16.4184 -16.3769 -16.3767 -16.3397 -16.3393 -16.3016 -16.3016 -7.9898 -7.9897 -6.5742 -6.5726 -5.3281 -5.3271 -4.9118 -4.9081 -4.4935 -4.4910 -4.3278 -4.3265 -4.3008 -4.3006 -4.0057 -4.0040 -2.3815 -2.3808 -1.8273 -1.8266 -1.6404 -1.6369 -1.5536 -1.5514 -1.3542 -1.3533 -1.2553 -1.2512 -0.9617 -0.9585 -0.7319 -0.7297 -0.6460 -0.6355 -0.3975 -0.3952 -0.2682 -0.2642 -0.2148 -0.2093 -0.1839 -0.1775 0.5396 0.5436 0.5472 0.5493 0.7015 0.7066 8.2933 8.2939 8.5595 8.5605 9.9520 9.9588 10.0488 10.0553 10.2780 10.2814 10.4262 10.4290 k =-0.2885 0.1123 0.5365 ( 6558 PWs) bands (ev): -18.1171 -18.1170 -17.9962 -17.9961 -17.4315 -17.4311 -16.4805 -16.4802 -16.4198 -16.4194 -16.3763 -16.3761 -16.3406 -16.3402 -16.3006 -16.3006 -8.0175 -8.0174 -6.5226 -6.5209 -5.3142 -5.3132 -4.9466 -4.9430 -4.5039 -4.5014 -4.3265 -4.3253 -4.3017 -4.3016 -3.9964 -3.9948 -2.3776 -2.3768 -1.8520 -1.8514 -1.6465 -1.6433 -1.5526 -1.5503 -1.3646 -1.3637 -1.2714 -1.2674 -0.9493 -0.9465 -0.7044 -0.7018 -0.6348 -0.6240 -0.4001 -0.3973 -0.2737 -0.2696 -0.2120 -0.2071 -0.1833 -0.1771 0.5391 0.5431 0.5460 0.5480 0.7033 0.7084 8.3441 8.3447 8.5903 8.5913 9.9268 9.9314 10.0517 10.0572 10.2254 10.2293 10.4129 10.4155 k =-0.3077 0.1198 0.5365 ( 6562 PWs) bands (ev): -18.1032 -18.1030 -17.9959 -17.9959 -17.4615 -17.4612 -16.4628 -16.4625 -16.4207 -16.4203 -16.3758 -16.3756 -16.3415 -16.3411 -16.2997 -16.2997 -8.0432 -8.0431 -6.4723 -6.4707 -5.3003 -5.2993 -4.9814 -4.9779 -4.5147 -4.5124 -4.3247 -4.3236 -4.3026 -4.3025 -3.9880 -3.9864 -2.3737 -2.3730 -1.8753 -1.8747 -1.6526 -1.6498 -1.5495 -1.5470 -1.3750 -1.3741 -1.2882 -1.2841 -0.9374 -0.9349 -0.6786 -0.6756 -0.6234 -0.6124 -0.4032 -0.3998 -0.2794 -0.2754 -0.2089 -0.2046 -0.1831 -0.1770 0.5387 0.5426 0.5448 0.5467 0.7052 0.7101 8.3973 8.3979 8.6222 8.6232 9.8834 9.8861 10.0555 10.0611 10.1821 10.1869 10.4037 10.4060 k =-0.3269 0.1273 0.5365 ( 6558 PWs) bands (ev): -18.0888 -18.0886 -17.9956 -17.9956 -17.4906 -17.4902 -16.4468 -16.4464 -16.4214 -16.4209 -16.3753 -16.3751 -16.3422 -16.3419 -16.2988 -16.2988 -8.0666 -8.0665 -6.4239 -6.4222 -5.2865 -5.2855 -5.0158 -5.0124 -4.5258 -4.5236 -4.3225 -4.3215 -4.3035 -4.3033 -3.9803 -3.9789 -2.3700 -2.3693 -1.8967 -1.8962 -1.6586 -1.6561 -1.5447 -1.5420 -1.3851 -1.3842 -1.3052 -1.3011 -0.9261 -0.9238 -0.6548 -0.6513 -0.6119 -0.6007 -0.4067 -0.4026 -0.2852 -0.2813 -0.2057 -0.2020 -0.1833 -0.1774 0.5383 0.5421 0.5437 0.5455 0.7071 0.7117 8.4523 8.4529 8.6549 8.6559 9.8305 9.8320 10.0370 10.0419 10.1679 10.1719 10.3974 10.3994 k =-0.3462 0.1347 0.5365 ( 6548 PWs) bands (ev): -18.0743 -18.0741 -17.9954 -17.9954 -17.5183 -17.5179 -16.4333 -16.4326 -16.4213 -16.4205 -16.3749 -16.3747 -16.3430 -16.3427 -16.2981 -16.2980 -8.0877 -8.0877 -6.3777 -6.3760 -5.2731 -5.2721 -5.0494 -5.0462 -4.5369 -4.5349 -4.3202 -4.3193 -4.3042 -4.3041 -3.9735 -3.9722 -2.3666 -2.3659 -1.9163 -1.9158 -1.6641 -1.6619 -1.5384 -1.5355 -1.3948 -1.3940 -1.3224 -1.3183 -0.9155 -0.9135 -0.6329 -0.6290 -0.6003 -0.5891 -0.4105 -0.4058 -0.2908 -0.2871 -0.2027 -0.1994 -0.1839 -0.1783 0.5380 0.5416 0.5427 0.5444 0.7090 0.7132 8.5089 8.5095 8.6880 8.6890 9.7722 9.7730 9.9948 9.9981 10.1821 10.1842 10.3931 10.3949 k =-0.3654 0.1422 0.5365 ( 6534 PWs) bands (ev): -18.0598 -18.0596 -17.9951 -17.9951 -17.5445 -17.5442 -16.4264 -16.4258 -16.4156 -16.4150 -16.3744 -16.3743 -16.3436 -16.3433 -16.2974 -16.2973 -8.1066 -8.1065 -6.3343 -6.3327 -5.2603 -5.2594 -5.0816 -5.0786 -4.5476 -4.5458 -4.3178 -4.3170 -4.3050 -4.3048 -3.9675 -3.9663 -2.3635 -2.3628 -1.9338 -1.9333 -1.6691 -1.6672 -1.5310 -1.5277 -1.4039 -1.4031 -1.3396 -1.3354 -0.9059 -0.9042 -0.6131 -0.6087 -0.5890 -0.5779 -0.4148 -0.4095 -0.2961 -0.2927 -0.1998 -0.1969 -0.1846 -0.1794 0.5378 0.5412 0.5418 0.5433 0.7108 0.7147 8.5664 8.5670 8.7209 8.7219 9.7109 9.7112 9.9446 9.9469 10.2071 10.2085 10.3903 10.3920 k =-0.3846 0.1497 0.5365 ( 6534 PWs) bands (ev): -18.0456 -18.0455 -17.9949 -17.9949 -17.5688 -17.5686 -16.4256 -16.4254 -16.4053 -16.4050 -16.3741 -16.3739 -16.3441 -16.3439 -16.2968 -16.2967 -8.1230 -8.1229 -6.2942 -6.2927 -5.2484 -5.2475 -5.1118 -5.1091 -4.5578 -4.5562 -4.3155 -4.3148 -4.3056 -4.3055 -3.9623 -3.9612 -2.3606 -2.3600 -1.9491 -1.9487 -1.6734 -1.6717 -1.5225 -1.5190 -1.4122 -1.4116 -1.3566 -1.3523 -0.8973 -0.8958 -0.5954 -0.5907 -0.5779 -0.5673 -0.4195 -0.4136 -0.3008 -0.2978 -0.1972 -0.1947 -0.1856 -0.1808 0.5376 0.5407 0.5411 0.5423 0.7124 0.7159 8.6242 8.6249 8.7530 8.7539 9.6483 9.6485 9.8942 9.8960 10.2356 10.2372 10.3886 10.3901 k =-0.4038 0.1572 0.5365 ( 6542 PWs) bands (ev): -18.0322 -18.0321 -17.9947 -17.9947 -17.5909 -17.5907 -16.4259 -16.4257 -16.3958 -16.3956 -16.3737 -16.3736 -16.3446 -16.3444 -16.2963 -16.2962 -8.1370 -8.1369 -6.2582 -6.2569 -5.2376 -5.2369 -5.1394 -5.1370 -4.5671 -4.5657 -4.3133 -4.3128 -4.3062 -4.3060 -3.9579 -3.9570 -2.3582 -2.3577 -1.9622 -1.9619 -1.6769 -1.6755 -1.5130 -1.5093 -1.4196 -1.4191 -1.3732 -1.3689 -0.8899 -0.8886 -0.5798 -0.5751 -0.5673 -0.5575 -0.4243 -0.4182 -0.3049 -0.3023 -0.1949 -0.1928 -0.1865 -0.1823 0.5375 0.5403 0.5404 0.5415 0.7140 0.7169 8.6813 8.6819 8.7833 8.7841 9.5862 9.5864 9.8470 9.8484 10.2650 10.2673 10.3877 10.3891 k =-0.4231 0.1647 0.5365 ( 6542 PWs) bands (ev): -18.0200 -18.0198 -17.9946 -17.9946 -17.6103 -17.6101 -16.4262 -16.4261 -16.3879 -16.3878 -16.3734 -16.3733 -16.3450 -16.3449 -16.2958 -16.2958 -8.1485 -8.1485 -6.2271 -6.2259 -5.2283 -5.2277 -5.1636 -5.1616 -4.5751 -4.5740 -4.3114 -4.3111 -4.3066 -4.3065 -3.9543 -3.9536 -2.3561 -2.3557 -1.9730 -1.9727 -1.6797 -1.6786 -1.5027 -1.4989 -1.4259 -1.4255 -1.3895 -1.3851 -0.8836 -0.8827 -0.5663 -0.5622 -0.5575 -0.5489 -0.4292 -0.4231 -0.3083 -0.3061 -0.1929 -0.1913 -0.1874 -0.1839 0.5374 0.5397 0.5401 0.5408 0.7154 0.7178 8.7362 8.7367 8.8108 8.8116 9.5267 9.5270 9.8051 9.8062 10.2942 10.2972 10.3872 10.3886 k =-0.4423 0.1722 0.5365 ( 6542 PWs) bands (ev): -18.0095 -18.0094 -17.9945 -17.9945 -17.6263 -17.6262 -16.4265 -16.4265 -16.3818 -16.3817 -16.3730 -16.3729 -16.3453 -16.3452 -16.2955 -16.2955 -8.1575 -8.1575 -6.2017 -6.2007 -5.2208 -5.2203 -5.1834 -5.1819 -4.5817 -4.5808 -4.3099 -4.3097 -4.3069 -4.3068 -3.9515 -3.9510 -2.3544 -2.3541 -1.9814 -1.9812 -1.6819 -1.6810 -1.4917 -1.4878 -1.4310 -1.4307 -1.4051 -1.4007 -0.8787 -0.8780 -0.5551 -0.5524 -0.5487 -0.5419 -0.4336 -0.4281 -0.3108 -0.3091 -0.1912 -0.1901 -0.1881 -0.1854 0.5374 0.5392 0.5398 0.5403 0.7165 0.7184 8.7864 8.7869 8.8344 8.8350 9.4725 9.4728 9.7701 9.7709 10.3225 10.3261 10.3871 10.3885 k =-0.4615 0.1796 0.5365 ( 6548 PWs) bands (ev): -18.0013 -18.0013 -17.9944 -17.9944 -17.6384 -17.6383 -16.4268 -16.4268 -16.3777 -16.3776 -16.3724 -16.3724 -16.3455 -16.3454 -16.2953 -16.2953 -8.1639 -8.1639 -6.1827 -6.1820 -5.2152 -5.2149 -5.1982 -5.1971 -4.5865 -4.5859 -4.3089 -4.3088 -4.3071 -4.3069 -3.9495 -3.9491 -2.3532 -2.3530 -1.9875 -1.9873 -1.6833 -1.6827 -1.4802 -1.4764 -1.4347 -1.4345 -1.4197 -1.4154 -0.8751 -0.8746 -0.5465 -0.5454 -0.5415 -0.5367 -0.4370 -0.4328 -0.3126 -0.3114 -0.1900 -0.1892 -0.1885 -0.1868 0.5375 0.5387 0.5396 0.5399 0.7175 0.7187 8.8284 8.8288 8.8526 8.8530 9.4275 9.4278 9.7437 9.7443 10.3490 10.3529 10.3871 10.3887 k =-0.4808 0.1871 0.5365 ( 6562 PWs) bands (ev): -17.9962 -17.9961 -17.9943 -17.9943 -17.6460 -17.6459 -16.4269 -16.4269 -16.3757 -16.3756 -16.3716 -16.3716 -16.3456 -16.3456 -16.2951 -16.2951 -8.1678 -8.1678 -6.1709 -6.1706 -5.2121 -5.2119 -5.2069 -5.2064 -4.5895 -4.5892 -4.3084 -4.3084 -4.3070 -4.3068 -3.9483 -3.9481 -2.3525 -2.3524 -1.9911 -1.9910 -1.6841 -1.6838 -1.4689 -1.4657 -1.4372 -1.4367 -1.4324 -1.4286 -0.8729 -0.8727 -0.5412 -0.5411 -0.5364 -0.5337 -0.4389 -0.4365 -0.3135 -0.3129 -0.1892 -0.1889 -0.1886 -0.1878 0.5377 0.5383 0.5395 0.5396 0.7182 0.7188 8.8571 8.8573 8.8644 8.8646 9.3968 9.3970 9.7273 9.7275 10.3723 10.3751 10.3872 10.3897 k =-0.5000 0.1946 0.5365 ( 6542 PWs) bands (ev): -17.9946 -17.9946 -17.9940 -17.9940 -17.6485 -17.6485 -16.4270 -16.4270 -16.3751 -16.3751 -16.3712 -16.3712 -16.3457 -16.3457 -16.2951 -16.2951 -8.1691 -8.1691 -6.1668 -6.1668 -5.2119 -5.2119 -5.2088 -5.2088 -4.5904 -4.5904 -4.3083 -4.3083 -4.3068 -4.3068 -3.9478 -3.9478 -2.3522 -2.3522 -1.9923 -1.9923 -1.6843 -1.6843 -1.4613 -1.4613 -1.4387 -1.4387 -1.4362 -1.4362 -0.8721 -0.8721 -0.5395 -0.5395 -0.5337 -0.5337 -0.4387 -0.4387 -0.3136 -0.3136 -0.1886 -0.1886 -0.1886 -0.1886 0.5380 0.5380 0.5395 0.5395 0.7186 0.7186 8.8664 8.8664 8.8698 8.8698 9.3858 9.3858 9.7218 9.7218 10.3839 10.3839 10.3906 10.3906 k =-0.5000 0.1946 0.5365 ( 6542 PWs) bands (ev): -17.9946 -17.9946 -17.9940 -17.9940 -17.6485 -17.6485 -16.4270 -16.4270 -16.3751 -16.3751 -16.3712 -16.3712 -16.3457 -16.3457 -16.2951 -16.2951 -8.1691 -8.1691 -6.1668 -6.1668 -5.2119 -5.2119 -5.2088 -5.2088 -4.5904 -4.5904 -4.3083 -4.3083 -4.3068 -4.3068 -3.9478 -3.9478 -2.3522 -2.3522 -1.9923 -1.9923 -1.6843 -1.6843 -1.4613 -1.4613 -1.4387 -1.4387 -1.4362 -1.4362 -0.8721 -0.8721 -0.5395 -0.5395 -0.5337 -0.5337 -0.4387 -0.4387 -0.3136 -0.3136 -0.1886 -0.1886 -0.1886 -0.1886 0.5380 0.5380 0.5395 0.5395 0.7186 0.7186 8.8664 8.8664 8.8698 8.8698 9.3858 9.3858 9.7218 9.7218 10.3839 10.3839 10.3906 10.3906 k =-0.4865 0.1894 0.5220 ( 6562 PWs) bands (ev): -17.9967 -17.9966 -17.9938 -17.9937 -17.6460 -17.6459 -16.4269 -16.4269 -16.3757 -16.3756 -16.3716 -16.3716 -16.3456 -16.3456 -16.2951 -16.2951 -8.1678 -8.1678 -6.1709 -6.1705 -5.2124 -5.2121 -5.2067 -5.2062 -4.5895 -4.5892 -4.3087 -4.3087 -4.3067 -4.3065 -3.9483 -3.9481 -2.3525 -2.3524 -1.9911 -1.9910 -1.6841 -1.6838 -1.4688 -1.4656 -1.4377 -1.4369 -1.4321 -1.4285 -0.8729 -0.8727 -0.5413 -0.5410 -0.5362 -0.5338 -0.4389 -0.4365 -0.3135 -0.3129 -0.1893 -0.1888 -0.1887 -0.1878 0.5376 0.5383 0.5396 0.5396 0.7182 0.7188 8.8519 8.8522 8.8700 8.8701 9.3964 9.3966 9.7273 9.7276 10.3734 10.3765 10.3854 10.3886 k =-0.4730 0.1841 0.5075 ( 6554 PWs) bands (ev): -18.0034 -18.0033 -17.9922 -17.9921 -17.6386 -17.6385 -16.4268 -16.4268 -16.3775 -16.3774 -16.3725 -16.3725 -16.3455 -16.3454 -16.2953 -16.2953 -8.1640 -8.1640 -6.1825 -6.1818 -5.2165 -5.2159 -5.1971 -5.1962 -4.5866 -4.5860 -4.3110 -4.3109 -4.3050 -4.3047 -3.9495 -3.9491 -2.3532 -2.3530 -1.9876 -1.9874 -1.6833 -1.6827 -1.4797 -1.4758 -1.4363 -1.4356 -1.4188 -1.4150 -0.8751 -0.8746 -0.5473 -0.5452 -0.5403 -0.5367 -0.4371 -0.4329 -0.3126 -0.3114 -0.1904 -0.1895 -0.1883 -0.1864 0.5371 0.5384 0.5401 0.5402 0.7175 0.7187 8.8086 8.8090 8.8753 8.8756 9.4235 9.4237 9.7447 9.7453 10.3533 10.3581 10.3799 10.3828 k =-0.4595 0.1788 0.4930 ( 6536 PWs) bands (ev): -18.0140 -18.0139 -17.9895 -17.9894 -17.6269 -17.6267 -16.4265 -16.4265 -16.3813 -16.3811 -16.3734 -16.3733 -16.3453 -16.3452 -16.2955 -16.2955 -8.1576 -8.1576 -6.2010 -6.2001 -5.2236 -5.2227 -5.1811 -5.1798 -4.5817 -4.5809 -4.3151 -4.3150 -4.3018 -4.3014 -3.9515 -3.9509 -2.3545 -2.3541 -1.9817 -1.9814 -1.6818 -1.6810 -1.4905 -1.4864 -1.4342 -1.4333 -1.4032 -1.3996 -0.8787 -0.8780 -0.5566 -0.5524 -0.5458 -0.5416 -0.4339 -0.4285 -0.3108 -0.3092 -0.1921 -0.1907 -0.1874 -0.1847 0.5360 0.5379 0.5413 0.5414 0.7165 0.7184 8.7463 8.7469 8.8843 8.8848 9.4571 9.4573 9.7753 9.7763 10.3317 10.3365 10.3715 10.3749 k =-0.4459 0.1736 0.4785 ( 6538 PWs) bands (ev): -18.0277 -18.0276 -17.9857 -17.9857 -17.6116 -17.6113 -16.4262 -16.4261 -16.3869 -16.3867 -16.3742 -16.3741 -16.3450 -16.3449 -16.2958 -16.2958 -8.1488 -8.1487 -6.2258 -6.2246 -5.2333 -5.2323 -5.1596 -5.1580 -4.5751 -4.5740 -4.3208 -4.3207 -4.2973 -4.2968 -3.9542 -3.9535 -2.3562 -2.3558 -1.9735 -1.9732 -1.6795 -1.6784 -1.5004 -1.4963 -1.4313 -1.4303 -1.3865 -1.3832 -0.8838 -0.8829 -0.5682 -0.5623 -0.5529 -0.5479 -0.4298 -0.4238 -0.3083 -0.3062 -0.1944 -0.1925 -0.1861 -0.1826 0.5345 0.5370 0.5430 0.5432 0.7153 0.7178 8.6724 8.6729 8.8969 8.8974 9.4891 9.4893 9.8197 9.8211 10.3099 10.3143 10.3604 10.3643 k =-0.4324 0.1683 0.4640 ( 6538 PWs) bands (ev): -18.0439 -18.0438 -17.9809 -17.9808 -17.5934 -17.5931 -16.4258 -16.4257 -16.3942 -16.3939 -16.3751 -16.3750 -16.3446 -16.3445 -16.2962 -16.2962 -8.1374 -8.1374 -6.2559 -6.2545 -5.2455 -5.2442 -5.1337 -5.1318 -4.5668 -4.5655 -4.3280 -4.3278 -4.2916 -4.2909 -3.9577 -3.9568 -2.3585 -2.3579 -1.9634 -1.9630 -1.6761 -1.6748 -1.5094 -1.5054 -1.4276 -1.4264 -1.3691 -1.3660 -0.8905 -0.8893 -0.5812 -0.5742 -0.5614 -0.5556 -0.4255 -0.4193 -0.3051 -0.3026 -0.1972 -0.1948 -0.1845 -0.1803 0.5326 0.5356 0.5453 0.5456 0.7138 0.7169 8.5914 8.5920 8.9128 8.9135 9.5159 9.5162 9.8761 9.8781 10.2885 10.2923 10.3474 10.3517 k =-0.4189 0.1631 0.4495 ( 6536 PWs) bands (ev): -18.0618 -18.0617 -17.9750 -17.9749 -17.5730 -17.5727 -16.4256 -16.4254 -16.4030 -16.4027 -16.3760 -16.3759 -16.3442 -16.3440 -16.2967 -16.2967 -8.1237 -8.1236 -6.2903 -6.2888 -5.2599 -5.2585 -5.1041 -5.1020 -4.5571 -4.5557 -4.3367 -4.3364 -4.2846 -4.2838 -3.9619 -3.9609 -2.3613 -2.3607 -1.9513 -1.9508 -1.6716 -1.6701 -1.5174 -1.5136 -1.4232 -1.4217 -1.3511 -1.3483 -0.8987 -0.8973 -0.5952 -0.5875 -0.5711 -0.5645 -0.4211 -0.4150 -0.3015 -0.2987 -0.2004 -0.1975 -0.1828 -0.1780 0.5303 0.5339 0.5480 0.5484 0.7121 0.7158 8.5062 8.5068 8.9319 8.9327 9.5374 9.5379 9.9408 9.9435 10.2684 10.2712 10.3334 10.3379 k =-0.4054 0.1578 0.4350 ( 6542 PWs) bands (ev): -18.0810 -18.0809 -17.9681 -17.9680 -17.5509 -17.5506 -16.4259 -16.4254 -16.4128 -16.4123 -16.3771 -16.3770 -16.3437 -16.3434 -16.2973 -16.2973 -8.1075 -8.1075 -6.3282 -6.3266 -5.2764 -5.2747 -5.0718 -5.0695 -4.5463 -4.5447 -4.3466 -4.3463 -4.2765 -4.2756 -3.9669 -3.9657 -2.3647 -2.3640 -1.9377 -1.9370 -1.6656 -1.6639 -1.5243 -1.5208 -1.4180 -1.4164 -1.3327 -1.3302 -0.9086 -0.9070 -0.6097 -0.6017 -0.5817 -0.5744 -0.4167 -0.4108 -0.2976 -0.2946 -0.2039 -0.2004 -0.1811 -0.1757 0.5276 0.5317 0.5512 0.5516 0.7102 0.7144 8.4185 8.4190 8.9540 8.9550 9.5550 9.5556 10.0083 10.0119 10.2509 10.2519 10.3204 10.3247 k =-0.3919 0.1525 0.4205 ( 6540 PWs) bands (ev): -18.1010 -18.1009 -17.9601 -17.9600 -17.5276 -17.5273 -16.4301 -16.4294 -16.4202 -16.4194 -16.3784 -16.3782 -16.3430 -16.3428 -16.2980 -16.2979 -8.0891 -8.0890 -6.3688 -6.3671 -5.2947 -5.2929 -5.0375 -5.0350 -4.5344 -4.5328 -4.3577 -4.3574 -4.2673 -4.2663 -3.9726 -3.9712 -2.3687 -2.3678 -1.9229 -1.9221 -1.6577 -1.6560 -1.5303 -1.5270 -1.4122 -1.4103 -1.3142 -1.3118 -0.9201 -0.9183 -0.6246 -0.6164 -0.5930 -0.5850 -0.4124 -0.4069 -0.2939 -0.2907 -0.2076 -0.2034 -0.1794 -0.1737 0.5245 0.5290 0.5547 0.5552 0.7080 0.7127 8.3293 8.3299 8.9789 8.9800 9.5701 9.5709 10.0699 10.0750 10.2359 10.2379 10.3131 10.3168 k =-0.3784 0.1473 0.4060 ( 6544 PWs) bands (ev): -18.1215 -18.1214 -17.9512 -17.9510 -17.5035 -17.5031 -16.4417 -16.4412 -16.4212 -16.4206 -16.3797 -16.3795 -16.3424 -16.3421 -16.2987 -16.2987 -8.0684 -8.0683 -6.4114 -6.4096 -5.3146 -5.3126 -5.0019 -4.9992 -4.5218 -4.5201 -4.3698 -4.3695 -4.2571 -4.2560 -3.9790 -3.9774 -2.3732 -2.3723 -1.9072 -1.9062 -1.6478 -1.6460 -1.5354 -1.5325 -1.4059 -1.4037 -1.2957 -1.2934 -0.9333 -0.9313 -0.6397 -0.6312 -0.6046 -0.5961 -0.4083 -0.4031 -0.2907 -0.2874 -0.2110 -0.2062 -0.1780 -0.1718 0.5210 0.5260 0.5585 0.5591 0.7056 0.7108 8.2395 8.2400 9.0063 9.0074 9.5837 9.5845 10.1112 10.1185 10.2242 10.2301 10.3238 10.3264 k =-0.3649 0.1420 0.3915 ( 6562 PWs) bands (ev): -18.1422 -18.1421 -17.9412 -17.9410 -17.4787 -17.4783 -16.4563 -16.4559 -16.4206 -16.4202 -16.3812 -16.3810 -16.3416 -16.3413 -16.2995 -16.2995 -8.0455 -8.0455 -6.4554 -6.4536 -5.3359 -5.3339 -4.9654 -4.9627 -4.5087 -4.5070 -4.3829 -4.3825 -4.2459 -4.2447 -3.9860 -3.9843 -2.3783 -2.3773 -1.8913 -1.8901 -1.6354 -1.6337 -1.5396 -1.5370 -1.3991 -1.3967 -1.2775 -1.2750 -0.9480 -0.9458 -0.6545 -0.6460 -0.6162 -0.6072 -0.4042 -0.3994 -0.2885 -0.2852 -0.2140 -0.2085 -0.1768 -0.1703 0.5170 0.5224 0.5625 0.5632 0.7030 0.7087 8.1496 8.1501 9.0359 9.0371 9.5964 9.5974 10.1239 10.1320 10.2124 10.2206 10.3664 10.3680 k =-0.3514 0.1368 0.3770 ( 6564 PWs) bands (ev): -18.1629 -18.1628 -17.9302 -17.9300 -17.4536 -17.4532 -16.4726 -16.4723 -16.4197 -16.4193 -16.3828 -16.3826 -16.3408 -16.3405 -16.3004 -16.3003 -8.0206 -8.0206 -6.5004 -6.4986 -5.3586 -5.3565 -4.9285 -4.9257 -4.4953 -4.4936 -4.3966 -4.3962 -4.2339 -4.2326 -3.9936 -3.9917 -2.3839 -2.3828 -1.8756 -1.8741 -1.6204 -1.6189 -1.5427 -1.5405 -1.3919 -1.3893 -1.2599 -1.2569 -0.9640 -0.9616 -0.6691 -0.6604 -0.6276 -0.6182 -0.4002 -0.3959 -0.2877 -0.2843 -0.2161 -0.2101 -0.1758 -0.1690 0.5125 0.5183 0.5668 0.5675 0.7002 0.7063 8.0600 8.0604 9.0674 9.0686 9.6087 9.6098 10.1189 10.1265 10.1968 10.2054 10.4330 10.4337 k =-0.3378 0.1315 0.3625 ( 6572 PWs) bands (ev): -18.1835 -18.1835 -17.9182 -17.9181 -17.4283 -17.4278 -16.4903 -16.4900 -16.4187 -16.4184 -16.3845 -16.3843 -16.3400 -16.3396 -16.3013 -16.3012 -7.9937 -7.9937 -6.5459 -6.5441 -5.3824 -5.3803 -4.8917 -4.8888 -4.4819 -4.4802 -4.4109 -4.4102 -4.2211 -4.2198 -4.0017 -3.9996 -2.3900 -2.3888 -1.8604 -1.8587 -1.6031 -1.6021 -1.5443 -1.5424 -1.3847 -1.3819 -1.2430 -1.2393 -0.9809 -0.9782 -0.6832 -0.6744 -0.6385 -0.6288 -0.3965 -0.3925 -0.2885 -0.2850 -0.2171 -0.2105 -0.1752 -0.1681 0.5076 0.5137 0.5712 0.5720 0.6972 0.7037 7.9710 7.9714 9.1005 9.1017 9.6207 9.6219 10.1072 10.1143 10.1783 10.1870 10.5088 10.5089 k =-0.3243 0.1262 0.3480 ( 6576 PWs) bands (ev): -18.2039 -18.2038 -17.9053 -17.9051 -17.4029 -17.4024 -16.5093 -16.5090 -16.4176 -16.4173 -16.3863 -16.3861 -16.3391 -16.3387 -16.3023 -16.3022 -7.9650 -7.9649 -6.5915 -6.5897 -5.4073 -5.4051 -4.8552 -4.8522 -4.4693 -4.4674 -4.4252 -4.4238 -4.2076 -4.2063 -4.0102 -4.0079 -2.3965 -2.3952 -1.8461 -1.8441 -1.5855 -1.5847 -1.5431 -1.5407 -1.3777 -1.3745 -1.2272 -1.2228 -0.9980 -0.9951 -0.6967 -0.6877 -0.6489 -0.6389 -0.3931 -0.3895 -0.2911 -0.2874 -0.2167 -0.2098 -0.1749 -0.1675 0.5022 0.5086 0.5758 0.5766 0.6940 0.7009 7.8828 7.8832 9.1347 9.1360 9.6327 9.6340 10.0936 10.1000 10.1587 10.1673 10.5701 10.5724 k =-0.3108 0.1210 0.3335 ( 6580 PWs) bands (ev): -18.2239 -18.2238 -17.8915 -17.8913 -17.3777 -17.3772 -16.5295 -16.5292 -16.4164 -16.4162 -16.3882 -16.3880 -16.3382 -16.3377 -16.3033 -16.3032 -7.9345 -7.9344 -6.6369 -6.6352 -5.4330 -5.4308 -4.8192 -4.8162 -4.4612 -4.4574 -4.4371 -4.4335 -4.1936 -4.1923 -4.0190 -4.0166 -2.4033 -2.4020 -1.8329 -1.8307 -1.5736 -1.5713 -1.5339 -1.5300 -1.3711 -1.3677 -1.2130 -1.2078 -1.0144 -1.0113 -0.7096 -0.7003 -0.6586 -0.6483 -0.3903 -0.3872 -0.2948 -0.2909 -0.2152 -0.2082 -0.1749 -0.1673 0.4962 0.5029 0.5804 0.5813 0.6907 0.6979 7.7959 7.7963 9.1698 9.1711 9.6447 9.6462 10.0797 10.0856 10.1389 10.1474 10.5833 10.5878 k =-0.2973 0.1157 0.3190 ( 6582 PWs) bands (ev): -18.2434 -18.2434 -17.8768 -17.8766 -17.3526 -17.3521 -16.5508 -16.5505 -16.4153 -16.4151 -16.3901 -16.3899 -16.3372 -16.3367 -16.3043 -16.3042 -7.9024 -7.9023 -6.6819 -6.6802 -5.4596 -5.4574 -4.7841 -4.7810 -4.4660 -4.4622 -4.4346 -4.4308 -4.1791 -4.1779 -4.0280 -4.0254 -2.4104 -2.4090 -1.8209 -1.8184 -1.5696 -1.5671 -1.5125 -1.5082 -1.3656 -1.3620 -1.2008 -1.1949 -1.0290 -1.0254 -0.7216 -0.7120 -0.6675 -0.6571 -0.3885 -0.3859 -0.2992 -0.2949 -0.2129 -0.2057 -0.1752 -0.1673 0.4896 0.4965 0.5850 0.5859 0.6873 0.6947 7.7103 7.7107 9.2054 9.2066 9.6567 9.6583 10.0663 10.0718 10.1195 10.1278 10.5898 10.5943 k =-0.2838 0.1105 0.3045 ( 6580 PWs) bands (ev): -18.2625 -18.2624 -17.8612 -17.8610 -17.3279 -17.3274 -16.5731 -16.5728 -16.4143 -16.4140 -16.3920 -16.3918 -16.3362 -16.3357 -16.3054 -16.3053 -7.8688 -7.8688 -6.7262 -6.7246 -5.4869 -5.4847 -4.7499 -4.7467 -4.4791 -4.4763 -4.4232 -4.4205 -4.1644 -4.1631 -4.0370 -4.0342 -2.4178 -2.4163 -1.8099 -1.8071 -1.5696 -1.5675 -1.4837 -1.4797 -1.3619 -1.3580 -1.1912 -1.1848 -1.0401 -1.0358 -0.7328 -0.7228 -0.6758 -0.6651 -0.3883 -0.3862 -0.3033 -0.2987 -0.2100 -0.2028 -0.1757 -0.1676 0.4825 0.4896 0.5896 0.5906 0.6838 0.6914 7.6264 7.6267 9.2411 9.2423 9.6688 9.6705 10.0537 10.0588 10.1009 10.1090 10.5953 10.5995 k =-0.2703 0.1052 0.2900 ( 6582 PWs) bands (ev): -18.2809 -18.2808 -17.8448 -17.8446 -17.3036 -17.3031 -16.5964 -16.5961 -16.4134 -16.4131 -16.3938 -16.3936 -16.3352 -16.3347 -16.3065 -16.3064 -7.8340 -7.8339 -6.7696 -6.7680 -5.5149 -5.5126 -4.7168 -4.7135 -4.4942 -4.4917 -4.4111 -4.4088 -4.1495 -4.1483 -4.0458 -4.0428 -2.4253 -2.4238 -1.7998 -1.7969 -1.5712 -1.5694 -1.4513 -1.4474 -1.3608 -1.3568 -1.1844 -1.1779 -1.0466 -1.0411 -0.7431 -0.7327 -0.6833 -0.6724 -0.3904 -0.3888 -0.3062 -0.3012 -0.2069 -0.1995 -0.1765 -0.1680 0.4749 0.4820 0.5942 0.5952 0.6801 0.6879 7.5443 7.5446 9.2766 9.2778 9.6809 9.6827 10.0420 10.0469 10.0832 10.0911 10.6007 10.6046 k =-0.2568 0.0999 0.2755 ( 6586 PWs) bands (ev): -18.2987 -18.2986 -17.8276 -17.8274 -17.2798 -17.2793 -16.6204 -16.6201 -16.4128 -16.4124 -16.3955 -16.3952 -16.3341 -16.3336 -16.3076 -16.3075 -7.7980 -7.7979 -6.8118 -6.8103 -5.5433 -5.5411 -4.6851 -4.6816 -4.5095 -4.5072 -4.3994 -4.3974 -4.1347 -4.1336 -4.0541 -4.0510 -2.4328 -2.4313 -1.7905 -1.7874 -1.5735 -1.5721 -1.4168 -1.4130 -1.3632 -1.3593 -1.1796 -1.1734 -1.0476 -1.0406 -0.7526 -0.7416 -0.6901 -0.6790 -0.3953 -0.3941 -0.3071 -0.3019 -0.2039 -0.1963 -0.1773 -0.1685 0.4666 0.4737 0.5986 0.5996 0.6764 0.6842 7.4642 7.4645 9.3115 9.3126 9.6930 9.6949 10.0314 10.0359 10.0668 10.0744 10.6062 10.6098 k =-0.2432 0.0947 0.2610 ( 6590 PWs) bands (ev): -18.3158 -18.3157 -17.8097 -17.8094 -17.2566 -17.2561 -16.6453 -16.6450 -16.4126 -16.4120 -16.3969 -16.3965 -16.3331 -16.3326 -16.3087 -16.3086 -7.7610 -7.7609 -6.8528 -6.8514 -5.5723 -5.5701 -4.6549 -4.6512 -4.5247 -4.5223 -4.3885 -4.3867 -4.1202 -4.1192 -4.0615 -4.0583 -2.4403 -2.4388 -1.7818 -1.7786 -1.5763 -1.5752 -1.3817 -1.3776 -1.3691 -1.3663 -1.1752 -1.1697 -1.0436 -1.0349 -0.7611 -0.7495 -0.6963 -0.6850 -0.4032 -0.4023 -0.3057 -0.3005 -0.2013 -0.1935 -0.1778 -0.1689 0.4577 0.4648 0.6030 0.6040 0.6726 0.6804 7.3864 7.3867 9.3455 9.3466 9.7050 9.7071 10.0217 10.0260 10.0518 10.0590 10.6122 10.6155 k =-0.2297 0.0894 0.2465 ( 6582 PWs) bands (ev): -18.3321 -18.3321 -17.7910 -17.7908 -17.2341 -17.2336 -16.6707 -16.6704 -16.4130 -16.4122 -16.3978 -16.3972 -16.3321 -16.3316 -16.3097 -16.3097 -7.7232 -7.7232 -6.8924 -6.8910 -5.6015 -5.5994 -4.6268 -4.6225 -4.5393 -4.5366 -4.3786 -4.3769 -4.1067 -4.1062 -4.0670 -4.0641 -2.4478 -2.4463 -1.7737 -1.7703 -1.5796 -1.5786 -1.3820 -1.3783 -1.3443 -1.3409 -1.1695 -1.1650 -1.0355 -1.0253 -0.7687 -0.7564 -0.7019 -0.6904 -0.4138 -0.4129 -0.3022 -0.2970 -0.1992 -0.1914 -0.1776 -0.1689 0.4482 0.4552 0.6071 0.6082 0.6688 0.6766 7.3111 7.3113 9.3782 9.3795 9.7170 9.7192 10.0129 10.0171 10.0383 10.0450 10.6188 10.6219 k =-0.2162 0.0842 0.2320 ( 6586 PWs) bands (ev): -18.3477 -18.3477 -17.7718 -17.7716 -17.2124 -17.2118 -16.6967 -16.6964 -16.4139 -16.4131 -16.3981 -16.3974 -16.3310 -16.3305 -16.3108 -16.3107 -7.6849 -7.6849 -6.9304 -6.9291 -5.6310 -5.6289 -4.6024 -4.5968 -4.5519 -4.5482 -4.3700 -4.3683 -4.0970 -4.0960 -4.0682 -4.0663 -2.4551 -2.4536 -1.7659 -1.7625 -1.5832 -1.5825 -1.3973 -1.3942 -1.3086 -1.3052 -1.1615 -1.1580 -1.0245 -1.0128 -0.7754 -0.7625 -0.7070 -0.6953 -0.4266 -0.4257 -0.2969 -0.2919 -0.1981 -0.1906 -0.1763 -0.1683 0.4382 0.4450 0.6112 0.6122 0.6650 0.6726 7.2385 7.2386 9.4096 9.4109 9.7288 9.7311 10.0048 10.0089 10.0265 10.0324 10.6264 10.6293 k =-0.2027 0.0789 0.2175 ( 6582 PWs) bands (ev): -18.3625 -18.3625 -17.7520 -17.7518 -17.1915 -17.1909 -16.7231 -16.7228 -16.4154 -16.4145 -16.3978 -16.3971 -16.3300 -16.3295 -16.3119 -16.3118 -7.6463 -7.6462 -6.9666 -6.9654 -5.6607 -5.6586 -4.5888 -4.5825 -4.5542 -4.5500 -4.3628 -4.3610 -4.0944 -4.0915 -4.0620 -4.0617 -2.4622 -2.4607 -1.7585 -1.7551 -1.5873 -1.5867 -1.4160 -1.4133 -1.2739 -1.2707 -1.1509 -1.1485 -1.0111 -0.9982 -0.7813 -0.7676 -0.7116 -0.6997 -0.4411 -0.4402 -0.2904 -0.2855 -0.1980 -0.1909 -0.1739 -0.1670 0.4275 0.4342 0.6150 0.6160 0.6612 0.6686 7.1687 7.1689 9.4392 9.4407 9.7405 9.7429 9.9972 10.0015 10.0164 10.0213 10.6350 10.6378 k =-0.1892 0.0736 0.2030 ( 6590 PWs) bands (ev): -18.3765 -18.3764 -17.7318 -17.7315 -17.1715 -17.1709 -16.7498 -16.7495 -16.4172 -16.4164 -16.3972 -16.3965 -16.3290 -16.3285 -16.3129 -16.3128 -7.6075 -7.6074 -7.0011 -6.9999 -5.6903 -5.6883 -4.5930 -4.5893 -4.5363 -4.5349 -4.3571 -4.3552 -4.0958 -4.0921 -4.0514 -4.0508 -2.4691 -2.4676 -1.7514 -1.7479 -1.5919 -1.5914 -1.4368 -1.4345 -1.2411 -1.2381 -1.1382 -1.1366 -0.9955 -0.9817 -0.7863 -0.7720 -0.7157 -0.7037 -0.4570 -0.4560 -0.2829 -0.2781 -0.1989 -0.1918 -0.1708 -0.1650 0.4164 0.4228 0.6186 0.6196 0.6575 0.6646 7.1021 7.1023 9.4671 9.4687 9.7519 9.7544 9.9900 9.9947 10.0080 10.0118 10.6450 10.6477 k =-0.1757 0.0684 0.1885 ( 6594 PWs) bands (ev): -18.3896 -18.3895 -17.7111 -17.7109 -17.1524 -17.1519 -16.7766 -16.7763 -16.4194 -16.4185 -16.3963 -16.3956 -16.3280 -16.3276 -16.3139 -16.3138 -7.5689 -7.5688 -7.0336 -7.0325 -5.7198 -5.7179 -4.6037 -4.6011 -4.5145 -4.5141 -4.3528 -4.3509 -4.0979 -4.0938 -4.0391 -4.0383 -2.4756 -2.4742 -1.7445 -1.7410 -1.5969 -1.5965 -1.4587 -1.4566 -1.2108 -1.2081 -1.1240 -1.1230 -0.9777 -0.9634 -0.7906 -0.7757 -0.7195 -0.7073 -0.4738 -0.4729 -0.2749 -0.2702 -0.2002 -0.1928 -0.1674 -0.1626 0.4047 0.4108 0.6220 0.6230 0.6538 0.6607 7.0389 7.0390 9.4930 9.4947 9.7631 9.7656 9.9832 9.9885 10.0008 10.0038 10.6564 10.6591 k =-0.1622 0.0631 0.1740 ( 6598 PWs) bands (ev): -18.4018 -18.4018 -17.6902 -17.6900 -17.1345 -17.1339 -16.8034 -16.8031 -16.4216 -16.4208 -16.3953 -16.3947 -16.3271 -16.3267 -16.3149 -16.3148 -7.5307 -7.5307 -7.0641 -7.0631 -5.7489 -5.7471 -4.6154 -4.6133 -4.4935 -4.4930 -4.3501 -4.3481 -4.0993 -4.0952 -4.0266 -4.0257 -2.4818 -2.4804 -1.7378 -1.7344 -1.6025 -1.6021 -1.4808 -1.4788 -1.1834 -1.1809 -1.1091 -1.1082 -0.9576 -0.9432 -0.7940 -0.7787 -0.7228 -0.7106 -0.4915 -0.4905 -0.2668 -0.2620 -0.2016 -0.1937 -0.1639 -0.1598 0.3927 0.3984 0.6251 0.6261 0.6502 0.6567 6.9792 6.9793 9.5168 9.5187 9.7739 9.7765 9.9770 9.9828 9.9946 9.9973 10.6694 10.6720 k =-0.1486 0.0579 0.1595 ( 6592 PWs) bands (ev): -18.4131 -18.4131 -17.6692 -17.6690 -17.1176 -17.1171 -16.8300 -16.8297 -16.4239 -16.4232 -16.3942 -16.3936 -16.3262 -16.3258 -16.3158 -16.3157 -7.4934 -7.4933 -7.0925 -7.0916 -5.7775 -5.7758 -4.6269 -4.6250 -4.4737 -4.4730 -4.3488 -4.3468 -4.0998 -4.0957 -4.0143 -4.0135 -2.4876 -2.4863 -1.7314 -1.7280 -1.6087 -1.6082 -1.5024 -1.5004 -1.1588 -1.1564 -1.0944 -1.0931 -0.9354 -0.9214 -0.7968 -0.7812 -0.7256 -0.7135 -0.5097 -0.5088 -0.2593 -0.2543 -0.2024 -0.1938 -0.1604 -0.1569 0.3803 0.3856 0.6280 0.6290 0.6468 0.6529 6.9233 6.9234 9.5386 9.5406 9.7843 9.7869 9.9716 9.9778 9.9892 9.9919 10.6840 10.6868 k =-0.1351 0.0526 0.1450 ( 6588 PWs) bands (ev): -18.4235 -18.4235 -17.6482 -17.6480 -17.1019 -17.1015 -16.8562 -16.8559 -16.4262 -16.4256 -16.3931 -16.3926 -16.3254 -16.3250 -16.3166 -16.3165 -7.4571 -7.4570 -7.1186 -7.1178 -5.8053 -5.8037 -4.6377 -4.6360 -4.4553 -4.4545 -4.3488 -4.3468 -4.0993 -4.0954 -4.0027 -4.0019 -2.4930 -2.4917 -1.7251 -1.7218 -1.6156 -1.6149 -1.5227 -1.5208 -1.1366 -1.1344 -1.0804 -1.0787 -0.9116 -0.8981 -0.7988 -0.7832 -0.7280 -0.7160 -0.5283 -0.5274 -0.2530 -0.2477 -0.2016 -0.1925 -0.1570 -0.1539 0.3677 0.3726 0.6305 0.6316 0.6437 0.6492 6.8714 6.8715 9.5583 9.5604 9.7942 9.7969 9.9670 9.9734 9.9843 9.9872 10.7004 10.7032 k =-0.1216 0.0473 0.1305 ( 6586 PWs) bands (ev): -18.4329 -18.4329 -17.6275 -17.6272 -17.0875 -17.0871 -16.8818 -16.8815 -16.4285 -16.4279 -16.3921 -16.3916 -16.3246 -16.3242 -16.3174 -16.3173 -7.4223 -7.4222 -7.1425 -7.1418 -5.8321 -5.8306 -4.6477 -4.6462 -4.4385 -4.4377 -4.3497 -4.3478 -4.0980 -4.0943 -3.9918 -3.9911 -2.4979 -2.4967 -1.7190 -1.7158 -1.6232 -1.6223 -1.5414 -1.5395 -1.1166 -1.1144 -1.0678 -1.0656 -0.8868 -0.8740 -0.8001 -0.7848 -0.7299 -0.7183 -0.5471 -0.5463 -0.2486 -0.2436 -0.1984 -0.1892 -0.1538 -0.1511 0.3550 0.3595 0.6327 0.6339 0.6408 0.6457 6.8237 6.8238 9.5760 9.5780 9.8035 9.8062 9.9633 9.9696 9.9800 9.9831 10.7186 10.7215 k =-0.1081 0.0421 0.1160 ( 6594 PWs) bands (ev): -18.4414 -18.4414 -17.6072 -17.6069 -17.0744 -17.0740 -16.9065 -16.9062 -16.4306 -16.4301 -16.3911 -16.3907 -16.3239 -16.3236 -16.3181 -16.3181 -7.3895 -7.3893 -7.1641 -7.1634 -5.8575 -5.8562 -4.6569 -4.6555 -4.4233 -4.4225 -4.3513 -4.3496 -4.0961 -4.0927 -3.9818 -3.9812 -2.5023 -2.5012 -1.7132 -1.7101 -1.6314 -1.6304 -1.5580 -1.5561 -1.0981 -1.0961 -1.0568 -1.0541 -0.8620 -0.8497 -0.8006 -0.7859 -0.7312 -0.7201 -0.5658 -0.5652 -0.2465 -0.2421 -0.1923 -0.1839 -0.1507 -0.1484 0.3425 0.3465 0.6341 0.6360 0.6386 0.6426 6.7804 6.7805 9.5916 9.5936 9.8122 9.8148 9.9604 9.9666 9.9761 9.9793 10.7385 10.7416 k =-0.0946 0.0368 0.1015 ( 6608 PWs) bands (ev): -18.4489 -18.4489 -17.5877 -17.5874 -17.0627 -17.0623 -16.9299 -16.9297 -16.4326 -16.4321 -16.3902 -16.3898 -16.3232 -16.3229 -16.3188 -16.3187 -7.3589 -7.3588 -7.1832 -7.1826 -5.8812 -5.8800 -4.6650 -4.6638 -4.4098 -4.4091 -4.3535 -4.3519 -4.0937 -4.0907 -3.9728 -3.9722 -2.5062 -2.5053 -1.7076 -1.7046 -1.6400 -1.6390 -1.5722 -1.5705 -1.0812 -1.0794 -1.0474 -1.0443 -0.8386 -0.8262 -0.7998 -0.7866 -0.7317 -0.7214 -0.5844 -0.5839 -0.2463 -0.2429 -0.1841 -0.1768 -0.1479 -0.1459 0.3302 0.3338 0.6336 0.6373 0.6380 0.6405 6.7417 6.7418 9.6052 9.6072 9.8202 9.8228 9.9583 9.9640 9.9725 9.9758 10.7602 10.7634 k =-0.0811 0.0316 0.0870 ( 6608 PWs) bands (ev): -18.4555 -18.4555 -17.5692 -17.5690 -17.0524 -17.0520 -16.9518 -16.9516 -16.4344 -16.4340 -16.3893 -16.3890 -16.3227 -16.3224 -16.3193 -16.3193 -7.3311 -7.3310 -7.1999 -7.1994 -5.9029 -5.9019 -4.6722 -4.6712 -4.3981 -4.3974 -4.3558 -4.3545 -4.0912 -4.0886 -3.9648 -3.9643 -2.5097 -2.5088 -1.7023 -1.6995 -1.6488 -1.6479 -1.5841 -1.5825 -1.0658 -1.0641 -1.0393 -1.0361 -0.8193 -0.8058 -0.7954 -0.7859 -0.7315 -0.7222 -0.6026 -0.6022 -0.2475 -0.2449 -0.1749 -0.1687 -0.1454 -0.1436 0.3186 0.3217 0.6319 0.6355 0.6395 0.6406 6.7078 6.7078 9.6169 9.6187 9.8274 9.8299 9.9567 9.9620 9.9694 9.9725 10.7833 10.7867 k =-0.0676 0.0263 0.0725 ( 6612 PWs) bands (ev): -18.4610 -18.4610 -17.5523 -17.5521 -17.0436 -17.0433 -16.9717 -16.9715 -16.4360 -16.4356 -16.3886 -16.3883 -16.3222 -16.3220 -16.3198 -16.3198 -7.3065 -7.3064 -7.2141 -7.2137 -5.9222 -5.9213 -4.6783 -4.6774 -4.3882 -4.3875 -4.3582 -4.3570 -4.0887 -4.0865 -3.9579 -3.9575 -2.5126 -2.5118 -1.6974 -1.6949 -1.6572 -1.6564 -1.5938 -1.5925 -1.0520 -1.0505 -1.0327 -1.0295 -0.8089 -0.7962 -0.7812 -0.7787 -0.7302 -0.7224 -0.6201 -0.6199 -0.2493 -0.2474 -0.1655 -0.1605 -0.1431 -0.1417 0.3079 0.3105 0.6301 0.6332 0.6409 0.6416 6.6788 6.6789 9.6268 9.6284 9.8338 9.8360 9.9556 9.9603 9.9668 9.9696 10.8078 10.8113 k =-0.0541 0.0210 0.0580 ( 6627 PWs) bands (ev): -18.4656 -18.4656 -17.5374 -17.5372 -17.0363 -17.0361 -16.9891 -16.9889 -16.4373 -16.4370 -16.3880 -16.3878 -16.3218 -16.3216 -16.3202 -16.3202 -7.2856 -7.2855 -7.2257 -7.2254 -5.9386 -5.9379 -4.6833 -4.6826 -4.3800 -4.3795 -4.3603 -4.3593 -4.0863 -4.0845 -3.9522 -3.9519 -2.5149 -2.5143 -1.6932 -1.6910 -1.6646 -1.6640 -1.6017 -1.6007 -1.0401 -1.0389 -1.0272 -1.0244 -0.8052 -0.7944 -0.7663 -0.7623 -0.7280 -0.7218 -0.6369 -0.6365 -0.2514 -0.2501 -0.1568 -0.1528 -0.1412 -0.1401 0.2985 0.3005 0.6286 0.6311 0.6421 0.6425 6.6549 6.6549 9.6348 9.6361 9.8392 9.8412 9.9548 9.9587 9.9648 9.9671 10.8332 10.8368 k =-0.0405 0.0158 0.0435 ( 6619 PWs) bands (ev): -18.4691 -18.4691 -17.5250 -17.5248 -17.0306 -17.0304 -17.0034 -17.0032 -16.4384 -16.4382 -16.3875 -16.3873 -16.3214 -16.3213 -16.3205 -16.3205 -7.2688 -7.2688 -7.2348 -7.2346 -5.9519 -5.9513 -4.6873 -4.6867 -4.3738 -4.3734 -4.3619 -4.3611 -4.0843 -4.0830 -3.9477 -3.9475 -2.5167 -2.5163 -1.6899 -1.6880 -1.6704 -1.6699 -1.6078 -1.6071 -1.0303 -1.0293 -1.0229 -1.0206 -0.8031 -0.7948 -0.7520 -0.7473 -0.7248 -0.7206 -0.6523 -0.6518 -0.2534 -0.2525 -0.1493 -0.1463 -0.1396 -0.1388 0.2907 0.2922 0.6275 0.6294 0.6430 0.6433 6.6362 6.6362 9.6410 9.6420 9.8437 9.8453 9.9542 9.9572 9.9634 9.9651 10.8589 10.8624 k =-0.0270 0.0105 0.0290 ( 6611 PWs) bands (ev): -18.4717 -18.4717 -17.5156 -17.5155 -17.0266 -17.0264 -17.0140 -17.0139 -16.4392 -16.4390 -16.3871 -16.3870 -16.3212 -16.3211 -16.3208 -16.3207 -7.2566 -7.2565 -7.2413 -7.2411 -5.9615 -5.9612 -4.6900 -4.6897 -4.3697 -4.3694 -4.3627 -4.3622 -4.0827 -4.0818 -3.9445 -3.9443 -2.5180 -2.5177 -1.6879 -1.6866 -1.6738 -1.6736 -1.6123 -1.6118 -1.0229 -1.0223 -1.0197 -1.0181 -0.8014 -0.7957 -0.7402 -0.7358 -0.7206 -0.7185 -0.6659 -0.6652 -0.2550 -0.2544 -0.1435 -0.1415 -0.1382 -0.1378 0.2849 0.2859 0.6267 0.6280 0.6436 0.6439 6.6227 6.6227 9.6455 9.6462 9.8471 9.8482 9.9538 9.9558 9.9626 9.9637 10.8834 10.8864 k =-0.0135 0.0053 0.0145 ( 6609 PWs) bands (ev): -18.4732 -18.4732 -17.5097 -17.5097 -17.0244 -17.0243 -17.0204 -17.0203 -16.4396 -16.4395 -16.3869 -16.3868 -16.3210 -16.3210 -16.3209 -16.3209 -7.2492 -7.2492 -7.2450 -7.2450 -5.9674 -5.9672 -4.6917 -4.6915 -4.3678 -4.3677 -4.3626 -4.3623 -4.0816 -4.0812 -3.9425 -3.9424 -2.5188 -2.5186 -1.6873 -1.6867 -1.6751 -1.6750 -1.6150 -1.6148 -1.0183 -1.0181 -1.0176 -1.0168 -0.7998 -0.7970 -0.7321 -0.7293 -0.7158 -0.7153 -0.6764 -0.6757 -0.2560 -0.2557 -0.1399 -0.1391 -0.1370 -0.1370 0.2814 0.2819 0.6264 0.6271 0.6441 0.6442 6.6146 6.6146 9.6482 9.6486 9.8493 9.8499 9.9537 9.9547 9.9623 9.9628 10.9034 10.9048 k = 0.0000 0.0000 0.0000 ( 6633 PWs) bands (ev): -18.4737 -18.4737 -17.5077 -17.5077 -17.0244 -17.0244 -17.0218 -17.0218 -16.4397 -16.4397 -16.3868 -16.3868 -16.3210 -16.3210 -16.3209 -16.3209 -7.2474 -7.2474 -7.2456 -7.2456 -5.9694 -5.9694 -4.6922 -4.6922 -4.3674 -4.3674 -4.3622 -4.3622 -4.0811 -4.0811 -3.9418 -3.9418 -2.5190 -2.5190 -1.6872 -1.6872 -1.6753 -1.6753 -1.6159 -1.6159 -1.0168 -1.0168 -1.0166 -1.0166 -0.7983 -0.7983 -0.7284 -0.7284 -0.7132 -0.7132 -0.6805 -0.6805 -0.2562 -0.2562 -0.1387 -0.1387 -0.1364 -0.1364 0.2803 0.2803 0.6265 0.6265 0.6442 0.6442 6.6119 6.6119 9.6493 9.6493 9.8503 9.8503 9.9540 9.9540 9.9624 9.9624 10.9104 10.9108 k = 0.0000 0.0000 0.0000 ( 6633 PWs) bands (ev): -18.4737 -18.4737 -17.5077 -17.5077 -17.0244 -17.0244 -17.0218 -17.0218 -16.4397 -16.4397 -16.3868 -16.3868 -16.3210 -16.3210 -16.3209 -16.3209 -7.2474 -7.2474 -7.2456 -7.2456 -5.9694 -5.9694 -4.6922 -4.6922 -4.3674 -4.3674 -4.3622 -4.3622 -4.0811 -4.0811 -3.9418 -3.9418 -2.5190 -2.5190 -1.6872 -1.6872 -1.6753 -1.6753 -1.6159 -1.6159 -1.0168 -1.0168 -1.0166 -1.0166 -0.7983 -0.7983 -0.7284 -0.7284 -0.7132 -0.7132 -0.6805 -0.6805 -0.2562 -0.2562 -0.1387 -0.1387 -0.1364 -0.1364 0.2803 0.2803 0.6265 0.6265 0.6442 0.6442 6.6119 6.6119 9.6493 9.6493 9.8503 9.8503 9.9540 9.9540 9.9624 9.9624 10.9107 10.9111 k = 0.0076 0.0195-0.0000 ( 6605 PWs) bands (ev): -18.4732 -18.4732 -17.5071 -17.5071 -17.0248 -17.0248 -17.0222 -17.0222 -16.4398 -16.4398 -16.3868 -16.3868 -16.3212 -16.3212 -16.3211 -16.3211 -7.2463 -7.2463 -7.2446 -7.2446 -5.9711 -5.9711 -4.6928 -4.6928 -4.3669 -4.3669 -4.3617 -4.3617 -4.0813 -4.0813 -3.9410 -3.9410 -2.5192 -2.5192 -1.6880 -1.6880 -1.6761 -1.6761 -1.6162 -1.6162 -1.0158 -1.0158 -1.0155 -1.0155 -0.8004 -0.8004 -0.7282 -0.7282 -0.7129 -0.7129 -0.6807 -0.6807 -0.2554 -0.2554 -0.1383 -0.1383 -0.1361 -0.1361 0.2804 0.2804 0.6261 0.6261 0.6438 0.6438 6.6147 6.6147 9.6512 9.6512 9.8510 9.8510 9.9546 9.9546 9.9630 9.9630 10.9100 10.9116 k = 0.0152 0.0389-0.0000 ( 6601 PWs) bands (ev): -18.4718 -18.4718 -17.5054 -17.5054 -17.0262 -17.0262 -17.0236 -17.0236 -16.4400 -16.4400 -16.3868 -16.3868 -16.3220 -16.3219 -16.3218 -16.3218 -7.2433 -7.2433 -7.2415 -7.2415 -5.9764 -5.9764 -4.6950 -4.6950 -4.3654 -4.3654 -4.3602 -4.3602 -4.0817 -4.0817 -3.9387 -3.9387 -2.5198 -2.5198 -1.6905 -1.6905 -1.6787 -1.6787 -1.6172 -1.6172 -1.0130 -1.0130 -1.0123 -1.0123 -0.8065 -0.8065 -0.7275 -0.7275 -0.7121 -0.7121 -0.6815 -0.6815 -0.2528 -0.2528 -0.1373 -0.1373 -0.1350 -0.1350 0.2807 0.2807 0.6246 0.6246 0.6426 0.6426 6.6229 6.6229 9.6570 9.6570 9.8533 9.8533 9.9564 9.9564 9.9648 9.9648 10.9095 10.9100 k = 0.0227 0.0584-0.0000 ( 6601 PWs) bands (ev): -18.4694 -18.4694 -17.5025 -17.5025 -17.0285 -17.0285 -17.0259 -17.0259 -16.4403 -16.4403 -16.3867 -16.3867 -16.3232 -16.3231 -16.3229 -16.3228 -7.2381 -7.2381 -7.2364 -7.2364 -5.9851 -5.9851 -4.6985 -4.6985 -4.3629 -4.3629 -4.3578 -4.3578 -4.0826 -4.0826 -3.9346 -3.9346 -2.5208 -2.5208 -1.6946 -1.6946 -1.6829 -1.6829 -1.6188 -1.6188 -1.0083 -1.0083 -1.0072 -1.0072 -0.8167 -0.8167 -0.7263 -0.7263 -0.7107 -0.7107 -0.6829 -0.6829 -0.2487 -0.2487 -0.1355 -0.1355 -0.1333 -0.1333 0.2812 0.2812 0.6220 0.6220 0.6406 0.6406 6.6366 6.6366 9.6667 9.6667 9.8572 9.8572 9.9593 9.9593 9.9677 9.9677 10.9067 10.9069 k = 0.0303 0.0779-0.0000 ( 6597 PWs) bands (ev): -18.4660 -18.4660 -17.4984 -17.4984 -17.0317 -17.0317 -17.0292 -17.0292 -16.4407 -16.4407 -16.3867 -16.3867 -16.3248 -16.3248 -16.3244 -16.3244 -7.2310 -7.2310 -7.2292 -7.2292 -5.9972 -5.9972 -4.7033 -4.7033 -4.3595 -4.3595 -4.3543 -4.3543 -4.0840 -4.0840 -3.9289 -3.9289 -2.5223 -2.5223 -1.7001 -1.7001 -1.6886 -1.6886 -1.6211 -1.6211 -1.0020 -1.0019 -1.0005 -1.0005 -0.8308 -0.8308 -0.7243 -0.7243 -0.7088 -0.7088 -0.6847 -0.6847 -0.2432 -0.2432 -0.1330 -0.1330 -0.1308 -0.1308 0.2819 0.2819 0.6181 0.6182 0.6382 0.6382 6.6557 6.6557 9.6801 9.6801 9.8626 9.8626 9.9633 9.9633 9.9717 9.9717 10.9043 10.9044 k = 0.0379 0.0973-0.0000 ( 6597 PWs) bands (ev): -18.4617 -18.4617 -17.4932 -17.4932 -17.0358 -17.0358 -17.0334 -17.0334 -16.4413 -16.4413 -16.3867 -16.3867 -16.3268 -16.3268 -16.3263 -16.3263 -7.2218 -7.2218 -7.2201 -7.2201 -6.0127 -6.0127 -4.7095 -4.7095 -4.3551 -4.3551 -4.3500 -4.3500 -4.0860 -4.0860 -3.9216 -3.9216 -2.5242 -2.5242 -1.7068 -1.7068 -1.6956 -1.6956 -1.6240 -1.6240 -0.9943 -0.9943 -0.9923 -0.9923 -0.8485 -0.8485 -0.7216 -0.7216 -0.7061 -0.7061 -0.6871 -0.6871 -0.2366 -0.2366 -0.1298 -0.1298 -0.1277 -0.1277 0.2827 0.2827 0.6128 0.6128 0.6355 0.6355 6.6800 6.6800 9.6972 9.6972 9.8697 9.8697 9.9683 9.9683 9.9768 9.9768 10.9007 10.9013 k = 0.0455 0.1168-0.0000 ( 6589 PWs) bands (ev): -18.4564 -18.4564 -17.4868 -17.4868 -17.0409 -17.0409 -17.0385 -17.0385 -16.4419 -16.4419 -16.3866 -16.3866 -16.3292 -16.3292 -16.3286 -16.3286 -7.2106 -7.2106 -7.2089 -7.2089 -6.0312 -6.0312 -4.7171 -4.7171 -4.3498 -4.3498 -4.3447 -4.3447 -4.0888 -4.0888 -3.9125 -3.9125 -2.5265 -2.5265 -1.7146 -1.7146 -1.7036 -1.7036 -1.6275 -1.6275 -0.9856 -0.9856 -0.9830 -0.9830 -0.8696 -0.8696 -0.7179 -0.7179 -0.7027 -0.7027 -0.6900 -0.6900 -0.2291 -0.2291 -0.1259 -0.1259 -0.1237 -0.1237 0.2837 0.2837 0.6061 0.6061 0.6324 0.6324 6.7096 6.7096 9.7177 9.7177 9.8783 9.8783 9.9742 9.9742 9.9828 9.9828 10.8963 10.8984 k = 0.0530 0.1362-0.0000 ( 6581 PWs) bands (ev): -18.4502 -18.4502 -17.4793 -17.4793 -17.0470 -17.0470 -17.0446 -17.0446 -16.4427 -16.4427 -16.3866 -16.3866 -16.3319 -16.3319 -16.3312 -16.3312 -7.1975 -7.1975 -7.1958 -7.1958 -6.0528 -6.0528 -4.7259 -4.7259 -4.3436 -4.3436 -4.3386 -4.3386 -4.0923 -4.0923 -3.9018 -3.9018 -2.5292 -2.5292 -1.7231 -1.7231 -1.7123 -1.7123 -1.6316 -1.6316 -0.9763 -0.9763 -0.9729 -0.9729 -0.8937 -0.8937 -0.7132 -0.7132 -0.6985 -0.6985 -0.6933 -0.6933 -0.2210 -0.2210 -0.1212 -0.1212 -0.1191 -0.1191 0.2848 0.2848 0.5978 0.5978 0.6291 0.6291 6.7442 6.7442 9.7415 9.7415 9.8888 9.8888 9.9810 9.9810 9.9897 9.9897 10.8749 10.8776 k = 0.0606 0.1557-0.0000 ( 6561 PWs) bands (ev): -18.4431 -18.4431 -17.4706 -17.4706 -17.0540 -17.0540 -17.0517 -17.0517 -16.4435 -16.4435 -16.3866 -16.3866 -16.3349 -16.3349 -16.3341 -16.3341 -7.1825 -7.1825 -7.1808 -7.1808 -6.0773 -6.0773 -4.7360 -4.7360 -4.3366 -4.3366 -4.3317 -4.3317 -4.0968 -4.0968 -3.8896 -3.8896 -2.5323 -2.5323 -1.7322 -1.7322 -1.7217 -1.7217 -1.6361 -1.6361 -0.9668 -0.9668 -0.9623 -0.9623 -0.9202 -0.9202 -0.7075 -0.7075 -0.6971 -0.6971 -0.6932 -0.6931 -0.2125 -0.2125 -0.1157 -0.1157 -0.1136 -0.1136 0.2859 0.2859 0.5883 0.5883 0.6254 0.6254 6.7837 6.7837 9.7682 9.7682 9.9012 9.9012 9.9884 9.9884 9.9972 9.9972 10.8405 10.8405 k = 0.0682 0.1752-0.0000 ( 6569 PWs) bands (ev): -18.4351 -18.4351 -17.4609 -17.4609 -17.0620 -17.0620 -17.0597 -17.0597 -16.4444 -16.4444 -16.3866 -16.3866 -16.3382 -16.3382 -16.3373 -16.3373 -7.1656 -7.1656 -7.1639 -7.1639 -6.1045 -6.1045 -4.7473 -4.7473 -4.3289 -4.3289 -4.3240 -4.3240 -4.1022 -4.1022 -3.8760 -3.8760 -2.5358 -2.5358 -1.7416 -1.7416 -1.7314 -1.7314 -1.6412 -1.6412 -0.9603 -0.9603 -0.9519 -0.9519 -0.9460 -0.9460 -0.7024 -0.7024 -0.6995 -0.6995 -0.6870 -0.6870 -0.2038 -0.2038 -0.1095 -0.1095 -0.1073 -0.1073 0.2871 0.2871 0.5776 0.5776 0.6212 0.6212 6.8279 6.8279 9.7973 9.7973 9.9158 9.9158 9.9964 9.9964 10.0053 10.0053 10.8056 10.8056 k = 0.0758 0.1946-0.0000 ( 6557 PWs) bands (ev): -18.4262 -18.4262 -17.4500 -17.4500 -17.0709 -17.0709 -17.0688 -17.0688 -16.4454 -16.4454 -16.3866 -16.3866 -16.3417 -16.3416 -16.3407 -16.3406 -7.1468 -7.1468 -7.1452 -7.1452 -6.1342 -6.1342 -4.7598 -4.7598 -4.3204 -4.3204 -4.3156 -4.3156 -4.1084 -4.1084 -3.8612 -3.8612 -2.5398 -2.5398 -1.7511 -1.7511 -1.7411 -1.7411 -1.6467 -1.6467 -0.9833 -0.9833 -0.9453 -0.9453 -0.9409 -0.9409 -0.7063 -0.7063 -0.6921 -0.6921 -0.6798 -0.6797 -0.1952 -0.1952 -0.1024 -0.1024 -0.1002 -0.1002 0.2881 0.2881 0.5659 0.5659 0.6165 0.6165 6.8767 6.8767 9.8280 9.8280 9.9332 9.9332 10.0049 10.0049 10.0138 10.0138 10.7711 10.7711 k = 0.0833 0.2141-0.0000 ( 6566 PWs) bands (ev): -18.4164 -18.4164 -17.4381 -17.4381 -17.0809 -17.0809 -17.0788 -17.0788 -16.4465 -16.4465 -16.3866 -16.3866 -16.3453 -16.3453 -16.3442 -16.3442 -7.1263 -7.1263 -7.1247 -7.1247 -6.1663 -6.1663 -4.7734 -4.7734 -4.3112 -4.3112 -4.3065 -4.3065 -4.1155 -4.1155 -3.8453 -3.8453 -2.5441 -2.5441 -1.7605 -1.7605 -1.7508 -1.7508 -1.6526 -1.6526 -1.0162 -1.0162 -0.9366 -0.9366 -0.9308 -0.9308 -0.7113 -0.7113 -0.6829 -0.6829 -0.6714 -0.6714 -0.1869 -0.1869 -0.0945 -0.0944 -0.0922 -0.0922 0.2889 0.2889 0.5535 0.5535 0.6111 0.6111 6.9299 6.9299 9.8590 9.8590 9.9543 9.9543 10.0135 10.0135 10.0226 10.0226 10.7375 10.7375 k = 0.0909 0.2336-0.0000 ( 6582 PWs) bands (ev): -18.4058 -18.4058 -17.4251 -17.4251 -17.0918 -17.0918 -17.0898 -17.0898 -16.4475 -16.4475 -16.3867 -16.3867 -16.3490 -16.3490 -16.3478 -16.3478 -7.1040 -7.1040 -7.1024 -7.1024 -6.2006 -6.2006 -4.7882 -4.7882 -4.3015 -4.3015 -4.2969 -4.2969 -4.1235 -4.1235 -3.8286 -3.8286 -2.5488 -2.5488 -1.7696 -1.7696 -1.7602 -1.7602 -1.6590 -1.6590 -1.0510 -1.0510 -0.9281 -0.9281 -0.9213 -0.9213 -0.7167 -0.7167 -0.6725 -0.6725 -0.6619 -0.6619 -0.1790 -0.1790 -0.0857 -0.0857 -0.0833 -0.0833 0.2894 0.2894 0.5405 0.5405 0.6051 0.6051 6.9871 6.9871 9.8887 9.8887 9.9803 9.9803 10.0222 10.0222 10.0314 10.0314 10.7054 10.7054 k = 0.0985 0.2530-0.0000 ( 6574 PWs) bands (ev): -18.3944 -18.3944 -17.4110 -17.4110 -17.1037 -17.1037 -17.1018 -17.1018 -16.4487 -16.4487 -16.3868 -16.3868 -16.3528 -16.3528 -16.3515 -16.3515 -7.0800 -7.0800 -7.0785 -7.0785 -6.2369 -6.2369 -4.8040 -4.8040 -4.2913 -4.2913 -4.2867 -4.2867 -4.1322 -4.1322 -3.8112 -3.8112 -2.5539 -2.5539 -1.7783 -1.7783 -1.7692 -1.7692 -1.6657 -1.6657 -1.0873 -1.0873 -0.9202 -0.9202 -0.9124 -0.9124 -0.7224 -0.7224 -0.6611 -0.6611 -0.6515 -0.6515 -0.1716 -0.1716 -0.0760 -0.0760 -0.0735 -0.0735 0.2891 0.2891 0.5273 0.5273 0.5982 0.5982 7.0483 7.0483 9.9158 9.9158 10.0117 10.0117 10.0310 10.0310 10.0401 10.0401 10.6754 10.6754 k = 0.1061 0.2725-0.0000 ( 6574 PWs) bands (ev): -18.3821 -18.3821 -17.3959 -17.3959 -17.1166 -17.1166 -17.1148 -17.1148 -16.4498 -16.4498 -16.3869 -16.3869 -16.3566 -16.3565 -16.3552 -16.3552 -7.0545 -7.0544 -7.0529 -7.0529 -6.2751 -6.2751 -4.8209 -4.8209 -4.2806 -4.2806 -4.2761 -4.2761 -4.1417 -4.1417 -3.7934 -3.7934 -2.5593 -2.5593 -1.7864 -1.7864 -1.7776 -1.7776 -1.6727 -1.6727 -1.1246 -1.1246 -0.9129 -0.9129 -0.9043 -0.9042 -0.7284 -0.7284 -0.6488 -0.6488 -0.6401 -0.6401 -0.1649 -0.1649 -0.0654 -0.0654 -0.0627 -0.0627 0.2880 0.2880 0.5143 0.5143 0.5905 0.5905 7.1132 7.1132 9.9399 9.9399 10.0369 10.0369 10.0455 10.0455 10.0541 10.0541 10.6481 10.6481 k = 0.1136 0.2919-0.0000 ( 6602 PWs) bands (ev): -18.3691 -18.3691 -17.3798 -17.3798 -17.1305 -17.1305 -17.1288 -17.1288 -16.4510 -16.4510 -16.3871 -16.3871 -16.3603 -16.3603 -16.3588 -16.3588 -7.0273 -7.0273 -7.0258 -7.0258 -6.3149 -6.3149 -4.8388 -4.8388 -4.2696 -4.2696 -4.2652 -4.2652 -4.1518 -4.1518 -3.7752 -3.7752 -2.5650 -2.5650 -1.7938 -1.7938 -1.7852 -1.7852 -1.6802 -1.6802 -1.1628 -1.1628 -0.9063 -0.9063 -0.8968 -0.8968 -0.7347 -0.7347 -0.6359 -0.6359 -0.6280 -0.6280 -0.1589 -0.1589 -0.0538 -0.0538 -0.0510 -0.0510 0.2855 0.2855 0.5019 0.5019 0.5819 0.5819 7.1815 7.1815 9.9616 9.9616 10.0451 10.0451 10.0546 10.0546 10.0933 10.0933 10.6244 10.6244 k = 0.1212 0.3114-0.0000 ( 6578 PWs) bands (ev): -18.3553 -18.3553 -17.3627 -17.3627 -17.1453 -17.1453 -17.1437 -17.1437 -16.4521 -16.4521 -16.3873 -16.3873 -16.3640 -16.3640 -16.3624 -16.3624 -6.9986 -6.9986 -6.9971 -6.9971 -6.3563 -6.3563 -4.8577 -4.8577 -4.2583 -4.2583 -4.2540 -4.2540 -4.1626 -4.1626 -3.7569 -3.7569 -2.5710 -2.5710 -1.8004 -1.8004 -1.7920 -1.7920 -1.6879 -1.6879 -1.2015 -1.2015 -0.9002 -0.9002 -0.8900 -0.8900 -0.7412 -0.7412 -0.6225 -0.6225 -0.6154 -0.6154 -0.1539 -0.1539 -0.0413 -0.0413 -0.0382 -0.0382 0.2812 0.2812 0.4906 0.4906 0.5724 0.5724 7.2531 7.2531 9.9815 9.9815 10.0516 10.0516 10.0613 10.0613 10.1374 10.1374 10.6051 10.6051 k = 0.1288 0.3309-0.0000 ( 6590 PWs) bands (ev): -18.3408 -18.3408 -17.3447 -17.3447 -17.1610 -17.1610 -17.1596 -17.1596 -16.4532 -16.4532 -16.3875 -16.3875 -16.3675 -16.3675 -16.3658 -16.3658 -6.9685 -6.9685 -6.9671 -6.9671 -6.3991 -6.3991 -4.8776 -4.8776 -4.2468 -4.2468 -4.2426 -4.2426 -4.1741 -4.1741 -3.7386 -3.7386 -2.5773 -2.5773 -1.8061 -1.8061 -1.7979 -1.7979 -1.6961 -1.6961 -1.2405 -1.2405 -0.8946 -0.8946 -0.8838 -0.8838 -0.7478 -0.7478 -0.6088 -0.6088 -0.6024 -0.6024 -0.1498 -0.1498 -0.0279 -0.0279 -0.0245 -0.0245 0.2746 0.2746 0.4807 0.4807 0.5620 0.5620 7.3276 7.3276 9.9999 9.9999 10.0570 10.0570 10.0667 10.0667 10.1823 10.1823 10.5916 10.5916 k = 0.1364 0.3503-0.0000 ( 6582 PWs) bands (ev): -18.3256 -18.3256 -17.3257 -17.3257 -17.1777 -17.1777 -17.1763 -17.1763 -16.4543 -16.4543 -16.3879 -16.3879 -16.3709 -16.3709 -16.3691 -16.3691 -6.9370 -6.9370 -6.9356 -6.9356 -6.4431 -6.4431 -4.8984 -4.8984 -4.2352 -4.2352 -4.2311 -4.2311 -4.1860 -4.1860 -3.7205 -3.7205 -2.5837 -2.5837 -1.8107 -1.8107 -1.8028 -1.8028 -1.7048 -1.7048 -1.2795 -1.2795 -0.8892 -0.8892 -0.8779 -0.8779 -0.7546 -0.7546 -0.5952 -0.5952 -0.5892 -0.5892 -0.1467 -0.1467 -0.0135 -0.0135 -0.0098 -0.0098 0.2655 0.2655 0.4726 0.4726 0.5510 0.5510 7.4048 7.4048 10.0170 10.0170 10.0610 10.0610 10.0708 10.0708 10.2261 10.2261 10.5854 10.5854 k = 0.1439 0.3698-0.0000 ( 6582 PWs) bands (ev): -18.3098 -18.3098 -17.3059 -17.3059 -17.1952 -17.1952 -17.1940 -17.1940 -16.4554 -16.4554 -16.3882 -16.3882 -16.3741 -16.3741 -16.3723 -16.3723 -6.9042 -6.9042 -6.9028 -6.9028 -6.4883 -6.4883 -4.9202 -4.9202 -4.2236 -4.2236 -4.2197 -4.2197 -4.1984 -4.1984 -3.7028 -3.7028 -2.5903 -2.5903 -1.8144 -1.8144 -1.8067 -1.8067 -1.7139 -1.7139 -1.3183 -1.3183 -0.8841 -0.8841 -0.8724 -0.8724 -0.7615 -0.7615 -0.5816 -0.5816 -0.5761 -0.5761 -0.1447 -0.1447 0.0017 0.0018 0.0059 0.0059 0.2537 0.2537 0.4660 0.4660 0.5395 0.5395 7.4844 7.4844 10.0325 10.0325 10.0636 10.0636 10.0734 10.0734 10.2665 10.2665 10.5886 10.5886 k = 0.1515 0.3893-0.0000 ( 6602 PWs) bands (ev): -18.2933 -18.2933 -17.2851 -17.2851 -17.2136 -17.2136 -17.2125 -17.2125 -16.4564 -16.4564 -16.3886 -16.3886 -16.3771 -16.3771 -16.3752 -16.3752 -6.8701 -6.8701 -6.8688 -6.8688 -6.5344 -6.5344 -4.9428 -4.9428 -4.2132 -4.2132 -4.2113 -4.2113 -4.2072 -4.2072 -3.6855 -3.6855 -2.5970 -2.5970 -1.8170 -1.8170 -1.8095 -1.8095 -1.7237 -1.7237 -1.3564 -1.3564 -0.8790 -0.8790 -0.8670 -0.8670 -0.7686 -0.7686 -0.5684 -0.5684 -0.5632 -0.5632 -0.1438 -0.1438 0.0179 0.0179 0.0225 0.0225 0.2391 0.2391 0.4603 0.4603 0.5282 0.5282 7.5663 7.5663 10.0461 10.0461 10.0645 10.0645 10.0743 10.0743 10.3015 10.3015 10.6030 10.6030 k = 0.1591 0.4087-0.0000 ( 6602 PWs) bands (ev): -18.2763 -18.2763 -17.2636 -17.2636 -17.2328 -17.2328 -17.2317 -17.2317 -16.4573 -16.4573 -16.3891 -16.3891 -16.3799 -16.3799 -16.3779 -16.3779 -6.8349 -6.8349 -6.8336 -6.8336 -6.5814 -6.5814 -4.9664 -4.9664 -4.2251 -4.2251 -4.2006 -4.2006 -4.1966 -4.1966 -3.6688 -3.6688 -2.6037 -2.6037 -1.8184 -1.8184 -1.8111 -1.8111 -1.7341 -1.7341 -1.3937 -1.3937 -0.8738 -0.8738 -0.8615 -0.8615 -0.7756 -0.7756 -0.5556 -0.5556 -0.5506 -0.5506 -0.1440 -0.1440 0.0349 0.0349 0.0399 0.0399 0.2221 0.2221 0.4542 0.4542 0.5183 0.5183 7.6500 7.6500 10.0572 10.0572 10.0637 10.0637 10.0735 10.0735 10.3299 10.3299 10.6292 10.6292 k = 0.1667 0.4282-0.0000 ( 6610 PWs) bands (ev): -18.2587 -18.2587 -17.2528 -17.2528 -17.2517 -17.2517 -17.2410 -17.2410 -16.4581 -16.4581 -16.3897 -16.3897 -16.3824 -16.3824 -16.3804 -16.3804 -6.7986 -6.7986 -6.7973 -6.7973 -6.6291 -6.6291 -4.9908 -4.9908 -4.2388 -4.2388 -4.1895 -4.1895 -4.1856 -4.1856 -3.6529 -3.6529 -2.6103 -2.6103 -1.8188 -1.8188 -1.8116 -1.8116 -1.7454 -1.7454 -1.4297 -1.4297 -0.8684 -0.8684 -0.8560 -0.8560 -0.7827 -0.7827 -0.5434 -0.5434 -0.5385 -0.5385 -0.1454 -0.1454 0.0527 0.0527 0.0581 0.0581 0.2031 0.2031 0.4455 0.4455 0.5114 0.5114 7.7355 7.7355 10.0603 10.0603 10.0657 10.0657 10.0719 10.0719 10.3523 10.3523 10.6662 10.6662 k = 0.1742 0.4476-0.0000 ( 6598 PWs) bands (ev): -18.2407 -18.2407 -17.2733 -17.2733 -17.2724 -17.2724 -17.2180 -17.2180 -16.4588 -16.4588 -16.3903 -16.3903 -16.3846 -16.3846 -16.3826 -16.3826 -6.7612 -6.7612 -6.7600 -6.7600 -6.6775 -6.6775 -5.0161 -5.0161 -4.2528 -4.2528 -4.1786 -4.1786 -4.1749 -4.1749 -3.6379 -3.6379 -2.6168 -2.6168 -1.8180 -1.8180 -1.8110 -1.8110 -1.7577 -1.7577 -1.4641 -1.4641 -0.8627 -0.8627 -0.8503 -0.8503 -0.7898 -0.7898 -0.5317 -0.5317 -0.5268 -0.5268 -0.1478 -0.1478 0.0712 0.0712 0.0770 0.0770 0.1825 0.1825 0.4330 0.4330 0.5085 0.5085 7.8224 7.8224 10.0557 10.0557 10.0643 10.0643 10.0749 10.0749 10.3703 10.3703 10.7113 10.7113 k = 0.1818 0.4671-0.0000 ( 6606 PWs) bands (ev): -18.2222 -18.2222 -17.2946 -17.2946 -17.2938 -17.2938 -17.1941 -17.1941 -16.4594 -16.4594 -16.3910 -16.3910 -16.3866 -16.3866 -16.3846 -16.3846 -6.7271 -6.7271 -6.7222 -6.7222 -6.7215 -6.7215 -5.0423 -5.0423 -4.2670 -4.2670 -4.1682 -4.1682 -4.1645 -4.1645 -3.6238 -3.6238 -2.6232 -2.6232 -1.8161 -1.8161 -1.8092 -1.8092 -1.7711 -1.7711 -1.4967 -1.4967 -0.8566 -0.8566 -0.8442 -0.8442 -0.7968 -0.7968 -0.5207 -0.5207 -0.5158 -0.5158 -0.1514 -0.1514 0.0903 0.0903 0.0965 0.0965 0.1606 0.1606 0.4164 0.4164 0.5095 0.5095 7.9104 7.9104 10.0490 10.0490 10.0577 10.0577 10.0788 10.0788 10.3856 10.3856 10.7614 10.7614 k = 0.1894 0.4866-0.0000 ( 6586 PWs) bands (ev): -18.2032 -18.2032 -17.3164 -17.3164 -17.3157 -17.3157 -17.1695 -17.1695 -16.4598 -16.4598 -16.3918 -16.3918 -16.3883 -16.3883 -16.3864 -16.3864 -6.7757 -6.7757 -6.6834 -6.6834 -6.6824 -6.6824 -5.0692 -5.0692 -4.2815 -4.2815 -4.1582 -4.1582 -4.1546 -4.1546 -3.6108 -3.6108 -2.6292 -2.6292 -1.8131 -1.8131 -1.8064 -1.8064 -1.7859 -1.7859 -1.5271 -1.5271 -0.8500 -0.8500 -0.8378 -0.8378 -0.8038 -0.8038 -0.5104 -0.5104 -0.5054 -0.5054 -0.1561 -0.1561 0.1098 0.1098 0.1165 0.1165 0.1382 0.1382 0.3964 0.3964 0.5132 0.5132 7.9994 7.9994 10.0402 10.0402 10.0488 10.0488 10.0808 10.0808 10.3990 10.3990 10.8135 10.8135 k = 0.1970 0.5060-0.0000 ( 6590 PWs) bands (ev): -18.1839 -18.1839 -17.3387 -17.3387 -17.3381 -17.3381 -17.1443 -17.1443 -16.4601 -16.4601 -16.3927 -16.3927 -16.3897 -16.3897 -16.3879 -16.3879 -6.8253 -6.8253 -6.6433 -6.6433 -6.6423 -6.6423 -5.0971 -5.0971 -4.2962 -4.2962 -4.1488 -4.1488 -4.1452 -4.1452 -3.5990 -3.5990 -2.6349 -2.6349 -1.8092 -1.8092 -1.8038 -1.8038 -1.8006 -1.8006 -1.5551 -1.5551 -0.8429 -0.8429 -0.8310 -0.8310 -0.8105 -0.8105 -0.5007 -0.5007 -0.4957 -0.4957 -0.1620 -0.1620 0.1143 0.1143 0.1304 0.1304 0.1370 0.1370 0.3739 0.3739 0.5189 0.5189 8.0891 8.0891 10.0293 10.0293 10.0377 10.0377 10.0811 10.0811 10.4104 10.4104 10.8576 10.8594 k = 0.2045 0.5255-0.0000 ( 6582 PWs) bands (ev): -18.1644 -18.1644 -17.3615 -17.3615 -17.3609 -17.3609 -17.1185 -17.1185 -16.4602 -16.4602 -16.3936 -16.3936 -16.3909 -16.3909 -16.3892 -16.3892 -6.8752 -6.8752 -6.6024 -6.6024 -6.6014 -6.6014 -5.1257 -5.1257 -4.3109 -4.3109 -4.1399 -4.1399 -4.1364 -4.1364 -3.5885 -3.5885 -2.6401 -2.6401 -1.8202 -1.8202 -1.8038 -1.8038 -1.7972 -1.7972 -1.5804 -1.5804 -0.8352 -0.8352 -0.8248 -0.8248 -0.8160 -0.8160 -0.4916 -0.4916 -0.4865 -0.4865 -0.1690 -0.1690 0.0913 0.0913 0.1504 0.1504 0.1576 0.1576 0.3491 0.3491 0.5258 0.5258 8.1792 8.1792 10.0165 10.0165 10.0246 10.0246 10.0800 10.0800 10.4194 10.4194 10.8627 10.8640 k = 0.2121 0.5450-0.0000 ( 6586 PWs) bands (ev): -18.1445 -18.1445 -17.3846 -17.3846 -17.3841 -17.3841 -17.0922 -17.0922 -16.4602 -16.4602 -16.3945 -16.3945 -16.3920 -16.3920 -16.3902 -16.3902 -6.9252 -6.9252 -6.5608 -6.5608 -6.5598 -6.5598 -5.1551 -5.1551 -4.3257 -4.3257 -4.1317 -4.1317 -4.1283 -4.1283 -3.5794 -3.5794 -2.6447 -2.6447 -1.8392 -1.8392 -1.7979 -1.7979 -1.7914 -1.7913 -1.6032 -1.6032 -0.8275 -0.8275 -0.8257 -0.8257 -0.8131 -0.8131 -0.4832 -0.4832 -0.4780 -0.4780 -0.1772 -0.1772 0.0681 0.0681 0.1708 0.1708 0.1784 0.1784 0.3225 0.3225 0.5335 0.5335 8.2695 8.2695 10.0017 10.0017 10.0095 10.0095 10.0777 10.0777 10.4248 10.4248 10.8674 10.8690 k = 0.2197 0.5644-0.0000 ( 6594 PWs) bands (ev): -18.1245 -18.1245 -17.4081 -17.4081 -17.4077 -17.4077 -17.0653 -17.0653 -16.4599 -16.4599 -16.3953 -16.3953 -16.3929 -16.3929 -16.3910 -16.3910 -6.9752 -6.9752 -6.5186 -6.5186 -6.5175 -6.5175 -5.1853 -5.1853 -4.3405 -4.3405 -4.1242 -4.1242 -4.1208 -4.1208 -3.5717 -3.5717 -2.6487 -2.6487 -1.8593 -1.8593 -1.7910 -1.7910 -1.7845 -1.7845 -1.6235 -1.6235 -0.8327 -0.8327 -0.8175 -0.8175 -0.8048 -0.8048 -0.4754 -0.4754 -0.4701 -0.4701 -0.1866 -0.1866 0.0453 0.0453 0.1912 0.1913 0.1993 0.1993 0.2941 0.2941 0.5416 0.5416 8.3597 8.3597 9.9849 9.9849 9.9924 9.9924 10.0743 10.0743 10.4257 10.4257 10.8717 10.8728 k = 0.2273 0.5839-0.0000 ( 6586 PWs) bands (ev): -18.1042 -18.1042 -17.4318 -17.4318 -17.4314 -17.4314 -17.0380 -17.0380 -16.4594 -16.4594 -16.3960 -16.3960 -16.3937 -16.3937 -16.3917 -16.3917 -7.0252 -7.0252 -6.4757 -6.4757 -6.4746 -6.4746 -5.2163 -5.2163 -4.3552 -4.3552 -4.1175 -4.1175 -4.1141 -4.1141 -3.5656 -3.5656 -2.6520 -2.6520 -1.8803 -1.8803 -1.7832 -1.7832 -1.7768 -1.7768 -1.6416 -1.6416 -0.8393 -0.8393 -0.8076 -0.8076 -0.7953 -0.7953 -0.4681 -0.4681 -0.4627 -0.4627 -0.1972 -0.1972 0.0229 0.0229 0.2116 0.2116 0.2200 0.2200 0.2644 0.2644 0.5501 0.5501 8.4497 8.4497 9.9663 9.9663 9.9733 9.9733 10.0700 10.0700 10.4213 10.4213 10.8755 10.8808 k = 0.2348 0.6033-0.0000 ( 6578 PWs) bands (ev): -18.0839 -18.0839 -17.4556 -17.4556 -17.4554 -17.4554 -17.0103 -17.0103 -16.4587 -16.4587 -16.3967 -16.3967 -16.3944 -16.3944 -16.3921 -16.3921 -7.0751 -7.0751 -6.4324 -6.4324 -6.4312 -6.4312 -5.2479 -5.2479 -4.3698 -4.3698 -4.1115 -4.1115 -4.1082 -4.1082 -3.5611 -3.5611 -2.6545 -2.6545 -1.9016 -1.9016 -1.7747 -1.7747 -1.7683 -1.7683 -1.6577 -1.6577 -0.8459 -0.8459 -0.7970 -0.7970 -0.7850 -0.7850 -0.4613 -0.4613 -0.4558 -0.4558 -0.2091 -0.2091 0.0013 0.0013 0.2292 0.2292 0.2356 0.2356 0.2409 0.2409 0.5587 0.5587 8.5392 8.5392 9.9457 9.9457 9.9524 9.9524 10.0648 10.0648 10.4110 10.4110 10.8780 10.8813 k = 0.2424 0.6228-0.0000 ( 6578 PWs) bands (ev): -18.0636 -18.0636 -17.4796 -17.4796 -17.4794 -17.4794 -16.9823 -16.9823 -16.4578 -16.4578 -16.3973 -16.3973 -16.3949 -16.3949 -16.3924 -16.3924 -7.1248 -7.1248 -6.3886 -6.3885 -6.3874 -6.3873 -5.2803 -5.2803 -4.3843 -4.3843 -4.1064 -4.1064 -4.1031 -4.1031 -3.5582 -3.5582 -2.6561 -2.6561 -1.9229 -1.9229 -1.7655 -1.7655 -1.7591 -1.7591 -1.6722 -1.6722 -0.8525 -0.8525 -0.7856 -0.7856 -0.7740 -0.7740 -0.4549 -0.4549 -0.4493 -0.4493 -0.2222 -0.2222 -0.0194 -0.0194 0.2004 0.2004 0.2522 0.2522 0.2609 0.2609 0.5674 0.5674 8.6279 8.6279 9.9233 9.9233 9.9296 9.9296 10.0586 10.0586 10.3952 10.3952 10.8801 10.8806 k = 0.2500 0.6423-0.0000 ( 6570 PWs) bands (ev): -18.0432 -18.0432 -17.5036 -17.5036 -17.5035 -17.5035 -16.9539 -16.9539 -16.4566 -16.4566 -16.3981 -16.3981 -16.3952 -16.3952 -16.3925 -16.3925 -7.1742 -7.1742 -6.3444 -6.3443 -6.3431 -6.3431 -5.3133 -5.3133 -4.3985 -4.3985 -4.1021 -4.1021 -4.0988 -4.0988 -3.5569 -3.5569 -2.6567 -2.6567 -1.9439 -1.9439 -1.7558 -1.7558 -1.7493 -1.7493 -1.6854 -1.6854 -0.8590 -0.8590 -0.7735 -0.7735 -0.7622 -0.7622 -0.4489 -0.4489 -0.4431 -0.4431 -0.2365 -0.2365 -0.0393 -0.0393 0.1671 0.1671 0.2717 0.2717 0.2808 0.2808 0.5759 0.5759 8.7157 8.7157 9.8991 9.8991 9.9049 9.9049 10.0511 10.0511 10.3744 10.3744 10.8796 10.8834 k = 0.2576 0.6617-0.0000 ( 6566 PWs) bands (ev): -18.0229 -18.0229 -17.5277 -17.5277 -17.5275 -17.5275 -16.9254 -16.9254 -16.4552 -16.4552 -16.3989 -16.3989 -16.3953 -16.3953 -16.3924 -16.3924 -7.2233 -7.2233 -6.2998 -6.2998 -6.2985 -6.2985 -5.3469 -5.3469 -4.4125 -4.4125 -4.0987 -4.0987 -4.0954 -4.0954 -3.5574 -3.5574 -2.6563 -2.6563 -1.9642 -1.9642 -1.7456 -1.7456 -1.7389 -1.7389 -1.6974 -1.6974 -0.8654 -0.8654 -0.7607 -0.7607 -0.7497 -0.7497 -0.4431 -0.4431 -0.4373 -0.4373 -0.2521 -0.2521 -0.0582 -0.0582 0.1329 0.1329 0.2908 0.2908 0.3001 0.3001 0.5843 0.5843 8.8023 8.8023 9.8730 9.8730 9.8784 9.8784 10.0422 10.0422 10.3496 10.3496 10.8769 10.8792 k = 0.2651 0.6812-0.0000 ( 6574 PWs) bands (ev): -18.0027 -18.0027 -17.5516 -17.5516 -17.5514 -17.5514 -16.8967 -16.8967 -16.4535 -16.4535 -16.3997 -16.3997 -16.3953 -16.3953 -16.3922 -16.3922 -7.2719 -7.2719 -6.2550 -6.2550 -6.2536 -6.2536 -5.3811 -5.3811 -4.4261 -4.4261 -4.0962 -4.0962 -4.0930 -4.0930 -3.5595 -3.5595 -2.6548 -2.6548 -1.9834 -1.9834 -1.7354 -1.7354 -1.7280 -1.7280 -1.7082 -1.7082 -0.8718 -0.8718 -0.7473 -0.7473 -0.7367 -0.7367 -0.4376 -0.4376 -0.4316 -0.4316 -0.2690 -0.2690 -0.0763 -0.0762 0.0981 0.0981 0.3094 0.3094 0.3189 0.3189 0.5925 0.5925 8.8876 8.8876 9.8452 9.8452 9.8501 9.8501 10.0315 10.0315 10.3221 10.3221 10.8723 10.8737 k = 0.2727 0.7007-0.0000 ( 6558 PWs) bands (ev): -17.9827 -17.9827 -17.5754 -17.5754 -17.5752 -17.5752 -16.8678 -16.8678 -16.4516 -16.4516 -16.4007 -16.4007 -16.3950 -16.3950 -16.3918 -16.3918 -7.3200 -7.3200 -6.2100 -6.2100 -6.2085 -6.2085 -5.4157 -5.4157 -4.4394 -4.4394 -4.0946 -4.0946 -4.0914 -4.0914 -3.5633 -3.5633 -2.6523 -2.6523 -2.0014 -2.0014 -1.7281 -1.7281 -1.7171 -1.7171 -1.7148 -1.7148 -0.8780 -0.8780 -0.7334 -0.7334 -0.7232 -0.7232 -0.4322 -0.4322 -0.4261 -0.4261 -0.2870 -0.2870 -0.0934 -0.0934 0.0630 0.0630 0.3273 0.3273 0.3371 0.3371 0.6006 0.6006 8.9713 8.9713 9.8155 9.8155 9.8201 9.8201 10.0188 10.0188 10.2931 10.2931 10.8649 10.8712 k = 0.2803 0.7201-0.0000 ( 6566 PWs) bands (ev): -17.9630 -17.9630 -17.5990 -17.5990 -17.5988 -17.5988 -16.8390 -16.8390 -16.4494 -16.4494 -16.4016 -16.4016 -16.3946 -16.3946 -16.3913 -16.3913 -7.3675 -7.3675 -6.1649 -6.1649 -6.1633 -6.1633 -5.4507 -5.4507 -4.4523 -4.4523 -4.0940 -4.0940 -4.0907 -4.0907 -3.5688 -3.5688 -2.6485 -2.6485 -2.0181 -2.0181 -1.7331 -1.7331 -1.7091 -1.7091 -1.7049 -1.7049 -0.8842 -0.8842 -0.7190 -0.7190 -0.7092 -0.7092 -0.4269 -0.4269 -0.4206 -0.4206 -0.3064 -0.3064 -0.1099 -0.1099 0.0280 0.0280 0.3445 0.3446 0.3545 0.3545 0.6083 0.6083 9.0533 9.0533 9.7841 9.7841 9.7883 9.7883 10.0037 10.0037 10.2637 10.2637 10.8544 10.8617 k = 0.2879 0.7396-0.0000 ( 6582 PWs) bands (ev): -17.9435 -17.9435 -17.6223 -17.6223 -17.6221 -17.6221 -16.8101 -16.8101 -16.4469 -16.4469 -16.4026 -16.4026 -16.3941 -16.3941 -16.3907 -16.3907 -7.4143 -7.4143 -6.1197 -6.1197 -6.1180 -6.1180 -5.4861 -5.4861 -4.4648 -4.4648 -4.0943 -4.0943 -4.0910 -4.0910 -3.5759 -3.5759 -2.6437 -2.6437 -2.0331 -2.0331 -1.7424 -1.7424 -1.6980 -1.6980 -1.6930 -1.6930 -0.8903 -0.8903 -0.7043 -0.7043 -0.6950 -0.6950 -0.4215 -0.4215 -0.4151 -0.4151 -0.3270 -0.3270 -0.1258 -0.1258 -0.0067 -0.0067 0.3610 0.3610 0.3711 0.3711 0.6158 0.6158 9.1332 9.1332 9.7510 9.7510 9.7548 9.7548 9.9859 9.9859 10.2348 10.2348 10.8402 10.8447 k = 0.2955 0.7590-0.0000 ( 6558 PWs) bands (ev): -17.9243 -17.9243 -17.6453 -17.6453 -17.6450 -17.6450 -16.7814 -16.7814 -16.4442 -16.4442 -16.4035 -16.4035 -16.3935 -16.3934 -16.3901 -16.3901 -7.4604 -7.4604 -6.0745 -6.0745 -6.0727 -6.0727 -5.5217 -5.5217 -4.4768 -4.4768 -4.0955 -4.0955 -4.0922 -4.0922 -3.5846 -3.5846 -2.6376 -2.6376 -2.0465 -2.0465 -1.7520 -1.7520 -1.6861 -1.6861 -1.6808 -1.6808 -0.8963 -0.8963 -0.6895 -0.6895 -0.6806 -0.6806 -0.4161 -0.4160 -0.4094 -0.4094 -0.3490 -0.3490 -0.1414 -0.1414 -0.0404 -0.0404 0.3767 0.3767 0.3869 0.3870 0.6230 0.6230 9.2108 9.2108 9.7163 9.7163 9.7197 9.7197 9.9655 9.9655 10.2072 10.2072 10.8237 10.8267 k = 0.3030 0.7785-0.0000 ( 6558 PWs) bands (ev): -17.9055 -17.9055 -17.6679 -17.6679 -17.6676 -17.6676 -16.7528 -16.7528 -16.4412 -16.4412 -16.4045 -16.4045 -16.3927 -16.3927 -16.3893 -16.3893 -7.5057 -7.5057 -6.0294 -6.0294 -6.0274 -6.0274 -5.5575 -5.5575 -4.4882 -4.4882 -4.0976 -4.0976 -4.0943 -4.0943 -3.5948 -3.5948 -2.6305 -2.6305 -2.0581 -2.0581 -1.7617 -1.7617 -1.6738 -1.6738 -1.6684 -1.6684 -0.9022 -0.9022 -0.6747 -0.6747 -0.6663 -0.6663 -0.4105 -0.4105 -0.4036 -0.4036 -0.3723 -0.3723 -0.1570 -0.1570 -0.0727 -0.0727 0.3916 0.3916 0.4019 0.4019 0.6299 0.6299 9.2860 9.2860 9.6800 9.6800 9.6831 9.6831 9.9426 9.9426 10.1813 10.1813 10.8032 10.8053 k = 0.3106 0.7980-0.0000 ( 6550 PWs) bands (ev): -17.8872 -17.8872 -17.6901 -17.6901 -17.6898 -17.6898 -16.7245 -16.7245 -16.4380 -16.4380 -16.4053 -16.4053 -16.3920 -16.3920 -16.3885 -16.3885 -7.5500 -7.5500 -5.9843 -5.9843 -5.9823 -5.9823 -5.5933 -5.5933 -4.4991 -4.4991 -4.1007 -4.1007 -4.0973 -4.0973 -3.6063 -3.6063 -2.6222 -2.6222 -2.0678 -2.0678 -1.7712 -1.7712 -1.6614 -1.6613 -1.6559 -1.6559 -0.9081 -0.9081 -0.6601 -0.6601 -0.6521 -0.6521 -0.4071 -0.4071 -0.3989 -0.3989 -0.3933 -0.3932 -0.1728 -0.1728 -0.1027 -0.1027 0.4056 0.4056 0.4160 0.4160 0.6365 0.6365 9.3582 9.3582 9.6421 9.6422 9.6450 9.6450 9.9173 9.9173 10.1574 10.1574 10.7807 10.7846 k = 0.3182 0.8174-0.0000 ( 6558 PWs) bands (ev): -17.8693 -17.8693 -17.7118 -17.7118 -17.7115 -17.7115 -16.6965 -16.6965 -16.4347 -16.4347 -16.4061 -16.4061 -16.3911 -16.3911 -16.3876 -16.3876 -7.5934 -7.5934 -5.9395 -5.9395 -5.9374 -5.9374 -5.6290 -5.6290 -4.5095 -4.5095 -4.1046 -4.1046 -4.1013 -4.1013 -3.6191 -3.6191 -2.6129 -2.6129 -2.0756 -2.0756 -1.7808 -1.7808 -1.6488 -1.6488 -1.6433 -1.6433 -0.9141 -0.9141 -0.6459 -0.6459 -0.6383 -0.6383 -0.4273 -0.4273 -0.3961 -0.3961 -0.3896 -0.3896 -0.1894 -0.1894 -0.1297 -0.1297 0.4187 0.4188 0.4292 0.4292 0.6428 0.6428 9.4271 9.4271 9.6029 9.6029 9.6055 9.6055 9.8905 9.8905 10.1356 10.1356 10.7561 10.7575 k = 0.3258 0.8369-0.0000 ( 6566 PWs) bands (ev): -17.8519 -17.8519 -17.7330 -17.7330 -17.7326 -17.7326 -16.6689 -16.6689 -16.4312 -16.4312 -16.4068 -16.4068 -16.3902 -16.3902 -16.3867 -16.3867 -7.6358 -7.6358 -5.8950 -5.8950 -5.8927 -5.8927 -5.6646 -5.6646 -4.5192 -4.5192 -4.1095 -4.1095 -4.1061 -4.1061 -3.6332 -3.6332 -2.6025 -2.6025 -2.0815 -2.0815 -1.7903 -1.7903 -1.6361 -1.6361 -1.6307 -1.6306 -0.9201 -0.9201 -0.6324 -0.6324 -0.6251 -0.6251 -0.4562 -0.4562 -0.3892 -0.3892 -0.3823 -0.3823 -0.2071 -0.2071 -0.1531 -0.1531 0.4310 0.4310 0.4415 0.4415 0.6489 0.6489 9.4917 9.4917 9.5625 9.5625 9.5650 9.5650 9.8628 9.8628 10.1160 10.1160 10.7297 10.7309 k = 0.3258 0.8369-0.0000 ( 6566 PWs) bands (ev): -17.8519 -17.8519 -17.7330 -17.7330 -17.7326 -17.7326 -16.6689 -16.6689 -16.4312 -16.4312 -16.4068 -16.4068 -16.3902 -16.3902 -16.3867 -16.3867 -7.6358 -7.6358 -5.8950 -5.8950 -5.8927 -5.8927 -5.6646 -5.6646 -4.5192 -4.5192 -4.1095 -4.1095 -4.1061 -4.1061 -3.6332 -3.6332 -2.6025 -2.6025 -2.0815 -2.0815 -1.7903 -1.7903 -1.6361 -1.6361 -1.6307 -1.6306 -0.9201 -0.9201 -0.6324 -0.6324 -0.6251 -0.6251 -0.4562 -0.4562 -0.3892 -0.3892 -0.3823 -0.3823 -0.2071 -0.2071 -0.1531 -0.1531 0.4310 0.4310 0.4415 0.4415 0.6489 0.6489 9.4917 9.4917 9.5625 9.5625 9.5650 9.5650 9.8628 9.8628 10.1160 10.1160 10.7295 10.7301 k = 0.3230 0.8299 0.0192 ( 6564 PWs) bands (ev): -17.8605 -17.8604 -17.7254 -17.7252 -17.7225 -17.7223 -16.6793 -16.6793 -16.4325 -16.4323 -16.4068 -16.4066 -16.3906 -16.3904 -16.3870 -16.3869 -7.6201 -7.6201 -5.9176 -5.9161 -5.9106 -5.9092 -5.6453 -5.6450 -4.5156 -4.5156 -4.1078 -4.1076 -4.1044 -4.1042 -3.6285 -3.6284 -2.6058 -2.6058 -2.0800 -2.0798 -1.7882 -1.7869 -1.6410 -1.6387 -1.6354 -1.6333 -0.9192 -0.9190 -0.6388 -0.6379 -0.6309 -0.6304 -0.4464 -0.4441 -0.3932 -0.3909 -0.3860 -0.3839 -0.2003 -0.1999 -0.1443 -0.1435 0.4266 0.4270 0.4371 0.4374 0.6465 0.6468 9.4623 9.4624 9.5713 9.5724 9.5814 9.5827 9.8801 9.8808 10.1260 10.1263 10.7373 10.7406 k = 0.3203 0.8230 0.0383 ( 6562 PWs) bands (ev): -17.8722 -17.8722 -17.7179 -17.7177 -17.7081 -17.7079 -16.6909 -16.6908 -16.4337 -16.4334 -16.4068 -16.4064 -16.3908 -16.3904 -16.3873 -16.3868 -7.6030 -7.6030 -5.9499 -5.9484 -5.9273 -5.9259 -5.6170 -5.6164 -4.5116 -4.5115 -4.1065 -4.1059 -4.1026 -4.1019 -3.6248 -3.6247 -2.6078 -2.6077 -2.0790 -2.0785 -1.7874 -1.7848 -1.6461 -1.6406 -1.6373 -1.6322 -0.9206 -0.9202 -0.6487 -0.6471 -0.6365 -0.6358 -0.4385 -0.4337 -0.3976 -0.3946 -0.3867 -0.3820 -0.1931 -0.1920 -0.1326 -0.1310 0.4222 0.4232 0.4327 0.4335 0.6440 0.6445 9.4278 9.4280 9.5678 9.5697 9.5975 9.5997 9.9106 9.9119 10.1427 10.1434 10.7395 10.7445 k = 0.3176 0.8160 0.0575 ( 6571 PWs) bands (ev): -17.8855 -17.8854 -17.7103 -17.7101 -17.6913 -17.6911 -16.7036 -16.7035 -16.4348 -16.4344 -16.4070 -16.4064 -16.3911 -16.3902 -16.3874 -16.3864 -7.5847 -7.5846 -5.9869 -5.9854 -5.9444 -5.9430 -5.5842 -5.5835 -4.5072 -4.5071 -4.1060 -4.1050 -4.1002 -4.0991 -3.6221 -3.6220 -2.6086 -2.6084 -2.0786 -2.0779 -1.7876 -1.7839 -1.6517 -1.6461 -1.6326 -1.6274 -0.9244 -0.9238 -0.6629 -0.6606 -0.6406 -0.6399 -0.4352 -0.4291 -0.4027 -0.3998 -0.3804 -0.3740 -0.1861 -0.1839 -0.1183 -0.1161 0.4176 0.4196 0.4282 0.4299 0.6412 0.6420 9.3927 9.3931 9.5564 9.5590 9.6096 9.6124 9.9496 9.9513 10.1658 10.1668 10.7353 10.7409 k = 0.3149 0.8091 0.0766 ( 6577 PWs) bands (ev): -17.8993 -17.8992 -17.7027 -17.7025 -17.6733 -17.6731 -16.7172 -16.7171 -16.4358 -16.4354 -16.4072 -16.4065 -16.3915 -16.3901 -16.3874 -16.3858 -7.5651 -7.5650 -6.0259 -6.0245 -5.9619 -5.9605 -5.5495 -5.5487 -4.5026 -4.5025 -4.1063 -4.1050 -4.0968 -4.0956 -3.6205 -3.6203 -2.6081 -2.6079 -2.0789 -2.0780 -1.7883 -1.7835 -1.6576 -1.6520 -1.6246 -1.6196 -0.9305 -0.9297 -0.6803 -0.6774 -0.6436 -0.6428 -0.4371 -0.4311 -0.4083 -0.4039 -0.3676 -0.3607 -0.1794 -0.1760 -0.1018 -0.0990 0.4130 0.4163 0.4237 0.4267 0.6383 0.6393 9.3582 9.3588 9.5408 9.5438 9.6177 9.6210 9.9922 9.9943 10.1946 10.1959 10.7271 10.7330 k = 0.3122 0.8021 0.0958 ( 6581 PWs) bands (ev): -17.9129 -17.9128 -17.6950 -17.6948 -17.6547 -17.6545 -16.7318 -16.7316 -16.4366 -16.4362 -16.4075 -16.4066 -16.3919 -16.3901 -16.3870 -16.3849 -7.5445 -7.5444 -6.0656 -6.0643 -5.9796 -5.9783 -5.5144 -5.5135 -4.4978 -4.4976 -4.1073 -4.1059 -4.0928 -4.0915 -3.6200 -3.6197 -2.6064 -2.6061 -2.0800 -2.0790 -1.7886 -1.7831 -1.6640 -1.6582 -1.6141 -1.6093 -0.9389 -0.9378 -0.7004 -0.6970 -0.6457 -0.6448 -0.4425 -0.4367 -0.4130 -0.4073 -0.3515 -0.3445 -0.1729 -0.1685 -0.0836 -0.0805 0.4082 0.4131 0.4193 0.4240 0.6352 0.6363 9.3249 9.3257 9.5236 9.5268 9.6228 9.6263 10.0351 10.0376 10.2284 10.2300 10.7156 10.7215 k = 0.3095 0.7952 0.1150 ( 6579 PWs) bands (ev): -17.9262 -17.9261 -17.6872 -17.6871 -17.6359 -17.6357 -16.7471 -16.7469 -16.4374 -16.4368 -16.4078 -16.4068 -16.3924 -16.3904 -16.3863 -16.3839 -7.5231 -7.5230 -6.1051 -6.1038 -5.9976 -5.9963 -5.4794 -5.4784 -4.4929 -4.4927 -4.1090 -4.1074 -4.0880 -4.0866 -3.6205 -3.6202 -2.6035 -2.6032 -2.0821 -2.0810 -1.7882 -1.7820 -1.6707 -1.6648 -1.6016 -1.5971 -0.9494 -0.9478 -0.7228 -0.7189 -0.6469 -0.6459 -0.4494 -0.4438 -0.4168 -0.4105 -0.3344 -0.3271 -0.1665 -0.1612 -0.0643 -0.0609 0.4033 0.4098 0.4157 0.4219 0.6318 0.6331 9.2931 9.2942 9.5060 9.5095 9.6255 9.6292 10.0759 10.0787 10.2665 10.2684 10.7015 10.7074 k = 0.3068 0.7882 0.1341 ( 6571 PWs) bands (ev): -17.9388 -17.9388 -17.6795 -17.6793 -17.6172 -17.6170 -16.7630 -16.7628 -16.4380 -16.4374 -16.4081 -16.4070 -16.3930 -16.3909 -16.3854 -16.3828 -7.5010 -7.5009 -6.1439 -6.1427 -6.0157 -6.0144 -5.4450 -5.4440 -4.4879 -4.4877 -4.1113 -4.1096 -4.0824 -4.0810 -3.6221 -3.6217 -2.5996 -2.5991 -2.0850 -2.0839 -1.7866 -1.7800 -1.6779 -1.6718 -1.5877 -1.5835 -0.9615 -0.9597 -0.7470 -0.7427 -0.6474 -0.6464 -0.4568 -0.4512 -0.4201 -0.4134 -0.3175 -0.3098 -0.1600 -0.1538 -0.0441 -0.0406 0.3983 0.4057 0.4132 0.4204 0.6283 0.6297 9.2633 9.2645 9.4891 9.4927 9.6268 9.6305 10.1132 10.1162 10.3081 10.3102 10.6859 10.6915 k = 0.3041 0.7813 0.1533 ( 6580 PWs) bands (ev): -17.9508 -17.9508 -17.6716 -17.6715 -17.5988 -17.5986 -16.7794 -16.7792 -16.4385 -16.4378 -16.4084 -16.4073 -16.3936 -16.3914 -16.3844 -16.3816 -7.4785 -7.4783 -6.1815 -6.1803 -6.0338 -6.0326 -5.4115 -5.4105 -4.4829 -4.4826 -4.1142 -4.1124 -4.0762 -4.0747 -3.6248 -3.6244 -2.5945 -2.5940 -2.0887 -2.0876 -1.7837 -1.7767 -1.6854 -1.6791 -1.5729 -1.5689 -0.9752 -0.9729 -0.7728 -0.7681 -0.6472 -0.6462 -0.4640 -0.4585 -0.4230 -0.4162 -0.3016 -0.2935 -0.1531 -0.1461 -0.0235 -0.0199 0.3931 0.4010 0.4119 0.4196 0.6245 0.6261 9.2355 9.2369 9.4733 9.4771 9.6270 9.6308 10.1461 10.1493 10.3521 10.3546 10.6695 10.6748 k = 0.3014 0.7743 0.1725 ( 6582 PWs) bands (ev): -17.9621 -17.9620 -17.6638 -17.6636 -17.5808 -17.5806 -16.7961 -16.7959 -16.4388 -16.4381 -16.4087 -16.4076 -16.3942 -16.3921 -16.3833 -16.3803 -7.4556 -7.4554 -6.2176 -6.2165 -6.0520 -6.0509 -5.3792 -5.3781 -4.4779 -4.4776 -4.1178 -4.1158 -4.0692 -4.0677 -3.6286 -3.6282 -2.5886 -2.5880 -2.0931 -2.0920 -1.7795 -1.7722 -1.6932 -1.6867 -1.5572 -1.5536 -0.9900 -0.9874 -0.7997 -0.7948 -0.6464 -0.6455 -0.4708 -0.4653 -0.4257 -0.4189 -0.2872 -0.2789 -0.1452 -0.1378 -0.0028 0.0009 0.3879 0.3959 0.4117 0.4196 0.6205 0.6222 9.2102 9.2117 9.4590 9.4629 9.6270 9.6308 10.1741 10.1773 10.3975 10.4002 10.6532 10.6581 k = 0.2987 0.7674 0.1916 ( 6581 PWs) bands (ev): -17.9725 -17.9724 -17.6558 -17.6557 -17.5636 -17.5634 -16.8131 -16.8128 -16.4390 -16.4382 -16.4090 -16.4079 -16.3949 -16.3928 -16.3822 -16.3791 -7.4328 -7.4325 -6.2518 -6.2508 -6.0701 -6.0690 -5.3482 -5.3469 -4.4728 -4.4725 -4.1219 -4.1197 -4.0614 -4.0600 -3.6336 -3.6331 -2.5819 -2.5811 -2.0977 -2.0966 -1.7743 -1.7667 -1.7013 -1.6944 -1.5412 -1.5379 -1.0056 -1.0027 -0.8276 -0.8224 -0.6453 -0.6444 -0.4772 -0.4716 -0.4283 -0.4216 -0.2749 -0.2665 -0.1362 -0.1286 0.0178 0.0216 0.3825 0.3906 0.4123 0.4204 0.6163 0.6181 9.1873 9.1890 9.4464 9.4504 9.6269 9.6307 10.1970 10.2001 10.4429 10.4459 10.6381 10.6425 k = 0.2960 0.7604 0.2108 ( 6584 PWs) bands (ev): -17.9822 -17.9821 -17.6479 -17.6477 -17.5471 -17.5469 -16.8301 -16.8298 -16.4391 -16.4382 -16.4093 -16.4081 -16.3957 -16.3935 -16.3811 -16.3779 -7.4102 -7.4099 -6.2840 -6.2830 -6.0882 -6.0871 -5.3187 -5.3173 -4.4676 -4.4674 -4.1265 -4.1242 -4.0530 -4.0515 -3.6396 -3.6391 -2.5744 -2.5735 -2.1026 -2.1014 -1.7685 -1.7606 -1.7092 -1.7021 -1.5248 -1.5219 -1.0219 -1.0187 -0.8560 -0.8507 -0.6437 -0.6430 -0.4830 -0.4773 -0.4309 -0.4243 -0.2649 -0.2568 -0.1257 -0.1184 0.0382 0.0420 0.3771 0.3852 0.4138 0.4219 0.6118 0.6138 9.1672 9.1690 9.4356 9.4397 9.6273 9.6311 10.2144 10.2173 10.4865 10.4900 10.6255 10.6292 k = 0.2933 0.7535 0.2299 ( 6590 PWs) bands (ev): -17.9909 -17.9908 -17.6398 -17.6397 -17.5316 -17.5314 -16.8470 -16.8466 -16.4390 -16.4381 -16.4096 -16.4084 -16.3965 -16.3943 -16.3799 -16.3767 -7.3881 -7.3878 -6.3138 -6.3129 -6.1060 -6.1050 -5.2907 -5.2892 -4.4623 -4.4621 -4.1317 -4.1292 -4.0439 -4.0424 -3.6466 -3.6461 -2.5664 -2.5654 -2.1072 -2.1059 -1.7631 -1.7548 -1.7163 -1.7089 -1.5083 -1.5058 -1.0385 -1.0350 -0.8848 -0.8794 -0.6419 -0.6412 -0.4883 -0.4825 -0.4335 -0.4271 -0.2574 -0.2497 -0.1138 -0.1071 0.0582 0.0621 0.3717 0.3797 0.4160 0.4242 0.6072 0.6094 9.1498 9.1517 9.4266 9.4308 9.6283 9.6320 10.2260 10.2286 10.5252 10.5293 10.6183 10.6213 k = 0.2906 0.7465 0.2491 ( 6580 PWs) bands (ev): -17.9989 -17.9988 -17.6318 -17.6316 -17.5172 -17.5171 -16.8635 -16.8632 -16.4387 -16.4378 -16.4100 -16.4087 -16.3973 -16.3951 -16.3788 -16.3755 -7.3668 -7.3664 -6.3410 -6.3401 -6.1236 -6.1226 -5.2645 -5.2627 -4.4569 -4.4567 -4.1373 -4.1346 -4.0342 -4.0327 -3.6547 -3.6542 -2.5580 -2.5568 -2.1114 -2.1099 -1.7598 -1.7518 -1.7204 -1.7133 -1.4917 -1.4896 -1.0552 -1.0516 -0.9136 -0.9082 -0.6399 -0.6392 -0.4931 -0.4871 -0.4362 -0.4300 -0.2521 -0.2452 -0.1009 -0.0949 0.0776 0.0816 0.3662 0.3742 0.4190 0.4273 0.6025 0.6047 9.1353 9.1373 9.4196 9.4239 9.6301 9.6338 10.2313 10.2336 10.5525 10.5572 10.6227 10.6252 k = 0.2879 0.7396 0.2683 ( 6582 PWs) bands (ev): -18.0060 -18.0059 -17.6236 -17.6235 -17.5042 -17.5040 -16.8796 -16.8792 -16.4383 -16.4374 -16.4103 -16.4090 -16.3981 -16.3960 -16.3778 -16.3744 -7.3466 -7.3461 -6.3652 -6.3644 -6.1410 -6.1401 -5.2401 -5.2381 -4.4513 -4.4511 -4.1434 -4.1405 -4.0239 -4.0224 -3.6638 -3.6632 -2.5494 -2.5480 -2.1148 -2.1132 -1.7612 -1.7546 -1.7186 -1.7134 -1.4752 -1.4735 -1.0719 -1.0681 -0.9421 -0.9367 -0.6376 -0.6369 -0.4975 -0.4913 -0.4391 -0.4330 -0.2489 -0.2427 -0.0872 -0.0821 0.0964 0.1005 0.3608 0.3687 0.4227 0.4312 0.5976 0.6000 9.1236 9.1258 9.4146 9.4188 9.6329 9.6366 10.2300 10.2319 10.5637 10.5677 10.6433 10.6457 k = 0.2852 0.7326 0.2874 ( 6580 PWs) bands (ev): -18.0123 -18.0122 -17.6155 -17.6153 -17.4926 -17.4925 -16.8950 -16.8946 -16.4378 -16.4368 -16.4107 -16.4094 -16.3989 -16.3969 -16.3768 -16.3733 -7.3277 -7.3272 -6.3863 -6.3856 -6.1581 -6.1572 -5.2175 -5.2153 -4.4455 -4.4452 -4.1499 -4.1468 -4.0130 -4.0116 -3.6737 -3.6731 -2.5408 -2.5392 -2.1173 -2.1154 -1.7678 -1.7621 -1.7122 -1.7086 -1.4588 -1.4574 -1.0884 -1.0846 -0.9702 -0.9649 -0.6351 -0.6344 -0.5014 -0.4950 -0.4422 -0.4363 -0.2473 -0.2419 -0.0732 -0.0691 0.1143 0.1185 0.3555 0.3632 0.4271 0.4356 0.5926 0.5951 9.1150 9.1172 9.4114 9.4157 9.6368 9.6404 10.2221 10.2236 10.5669 10.5699 10.6704 10.6730 k = 0.2825 0.7257 0.3066 ( 6589 PWs) bands (ev): -18.0178 -18.0176 -17.6073 -17.6071 -17.4827 -17.4825 -16.9095 -16.9090 -16.4372 -16.4362 -16.4111 -16.4097 -16.3998 -16.3978 -16.3758 -16.3723 -7.3105 -7.3099 -6.4040 -6.4033 -6.1749 -6.1740 -5.1969 -5.1945 -4.4393 -4.4391 -4.1568 -4.1534 -4.0017 -4.0003 -3.6846 -3.6839 -2.5323 -2.5305 -2.1186 -2.1164 -1.7779 -1.7723 -1.7038 -1.7007 -1.4426 -1.4414 -1.1046 -1.1007 -0.9977 -0.9923 -0.6325 -0.6316 -0.5048 -0.4982 -0.4456 -0.4399 -0.2471 -0.2424 -0.0594 -0.0561 0.1313 0.1358 0.3502 0.3577 0.4320 0.4407 0.5875 0.5902 9.1092 9.1114 9.4101 9.4143 9.6419 9.6455 10.2076 10.2089 10.5692 10.5717 10.6954 10.6982 k = 0.2798 0.7187 0.3258 ( 6591 PWs) bands (ev): -18.0225 -18.0223 -17.5990 -17.5989 -17.4745 -17.4744 -16.9229 -16.9224 -16.4364 -16.4354 -16.4115 -16.4101 -16.4006 -16.3987 -16.3749 -16.3713 -7.2951 -7.2944 -6.4182 -6.4176 -6.1913 -6.1904 -5.1783 -5.1757 -4.4329 -4.4326 -4.1640 -4.1603 -3.9900 -3.9886 -3.6961 -3.6954 -2.5241 -2.5221 -2.1184 -2.1161 -1.7898 -1.7840 -1.6945 -1.6917 -1.4267 -1.4255 -1.1202 -1.1164 -1.0242 -1.0188 -0.6296 -0.6286 -0.5079 -0.5011 -0.4492 -0.4438 -0.2479 -0.2438 -0.0460 -0.0435 0.1473 0.1520 0.3451 0.3524 0.4374 0.4463 0.5824 0.5852 9.1063 9.1086 9.4105 9.4148 9.6482 9.6518 10.1872 10.1883 10.5727 10.5750 10.7150 10.7180 k = 0.2771 0.7118 0.3449 ( 6591 PWs) bands (ev): -18.0264 -18.0262 -17.5907 -17.5906 -17.4683 -17.4682 -16.9351 -16.9346 -16.4356 -16.4345 -16.4121 -16.4106 -16.4014 -16.3996 -16.3740 -16.3704 -7.2818 -7.2810 -6.4288 -6.4282 -6.2073 -6.2064 -5.1617 -5.1589 -4.4262 -4.4258 -4.1714 -4.1675 -3.9779 -3.9765 -3.7084 -3.7076 -2.5164 -2.5142 -2.1168 -2.1143 -1.8028 -1.7969 -1.6851 -1.6823 -1.4111 -1.4098 -1.1352 -1.1315 -1.0496 -1.0443 -0.6264 -0.6253 -0.5105 -0.5035 -0.4532 -0.4481 -0.2494 -0.2458 -0.0334 -0.0315 0.1622 0.1673 0.3401 0.3471 0.4432 0.4523 0.5774 0.5803 9.1061 9.1084 9.4126 9.4168 9.6558 9.6593 10.1615 10.1626 10.5776 10.5797 10.7281 10.7313 k = 0.2743 0.7048 0.3641 ( 6589 PWs) bands (ev): -18.0296 -18.0295 -17.5824 -17.5823 -17.4641 -17.4639 -16.9460 -16.9454 -16.4346 -16.4335 -16.4126 -16.4111 -16.4022 -16.4005 -16.3733 -16.3695 -7.2706 -7.2697 -6.4358 -6.4353 -6.2228 -6.2220 -5.1471 -5.1440 -4.4192 -4.4188 -4.1790 -4.1748 -3.9656 -3.9642 -3.7212 -3.7204 -2.5093 -2.5068 -2.1137 -2.1109 -1.8166 -1.8105 -1.6758 -1.6731 -1.3957 -1.3941 -1.1496 -1.1460 -1.0738 -1.0684 -0.6231 -0.6218 -0.5127 -0.5055 -0.4576 -0.4527 -0.2514 -0.2482 -0.0217 -0.0204 0.1760 0.1815 0.3354 0.3421 0.4493 0.4585 0.5724 0.5755 9.1086 9.1109 9.4162 9.4204 9.6647 9.6681 10.1314 10.1326 10.5835 10.5855 10.7354 10.7387 k = 0.2716 0.6979 0.3832 ( 6583 PWs) bands (ev): -18.0322 -18.0320 -17.5740 -17.5739 -17.4619 -17.4618 -16.9553 -16.9547 -16.4335 -16.4323 -16.4133 -16.4117 -16.4029 -16.4013 -16.3725 -16.3688 -7.2615 -7.2606 -6.4393 -6.4388 -6.2380 -6.2372 -5.1346 -5.1312 -4.4120 -4.4115 -4.1866 -4.1821 -3.9529 -3.9516 -3.7345 -3.7337 -2.5028 -2.5002 -2.1090 -2.1061 -1.8310 -1.8247 -1.6671 -1.6644 -1.3806 -1.3786 -1.1631 -1.1597 -1.0966 -1.0912 -0.6195 -0.6181 -0.5145 -0.5072 -0.4623 -0.4577 -0.2537 -0.2508 -0.0110 -0.0102 0.1885 0.1945 0.3308 0.3372 0.4555 0.4649 0.5677 0.5709 9.1135 9.1158 9.4211 9.4252 9.6747 9.6781 10.0977 10.0989 10.5898 10.5917 10.7383 10.7416 k = 0.2689 0.6909 0.4024 ( 6591 PWs) bands (ev): -18.0341 -18.0339 -17.5657 -17.5655 -17.4617 -17.4616 -16.9631 -16.9625 -16.4324 -16.4312 -16.4140 -16.4123 -16.4035 -16.4020 -16.3719 -16.3681 -7.2545 -7.2535 -6.4395 -6.4390 -6.2526 -6.2518 -5.1239 -5.1204 -4.4048 -4.4043 -4.1942 -4.1893 -3.9401 -3.9387 -3.7482 -3.7473 -2.4972 -2.4943 -2.1030 -2.0999 -1.8456 -1.8392 -1.6591 -1.6565 -1.3657 -1.3633 -1.1758 -1.1726 -1.1179 -1.1123 -0.6157 -0.6142 -0.5160 -0.5085 -0.4673 -0.4630 -0.2561 -0.2534 -0.0015 -0.0011 0.1998 0.2063 0.3266 0.3325 0.4617 0.4713 0.5631 0.5664 9.1206 9.1229 9.4271 9.4311 9.6859 9.6891 10.0611 10.0625 10.5959 10.5978 10.7385 10.7419 k = 0.2662 0.6840 0.4216 ( 6592 PWs) bands (ev): -18.0355 -18.0353 -17.5573 -17.5572 -17.4634 -17.4633 -16.9695 -16.9688 -16.4312 -16.4299 -16.4148 -16.4131 -16.4040 -16.4027 -16.3713 -16.3675 -7.2495 -7.2484 -6.4368 -6.4363 -6.2667 -6.2659 -5.1151 -5.1114 -4.3978 -4.3971 -4.2015 -4.1964 -3.9271 -3.9257 -3.7621 -3.7612 -2.4923 -2.4893 -2.0958 -2.0926 -1.8601 -1.8537 -1.6521 -1.6495 -1.3510 -1.3482 -1.1877 -1.1845 -1.1376 -1.1318 -0.6117 -0.6102 -0.5170 -0.5093 -0.4725 -0.4685 -0.2584 -0.2560 0.0066 0.0069 0.2097 0.2168 0.3228 0.3281 0.4677 0.4774 0.5589 0.5623 9.1297 9.1319 9.4338 9.4377 9.6981 9.7012 10.0227 10.0243 10.6011 10.6031 10.7373 10.7411 k = 0.2635 0.6770 0.4407 ( 6593 PWs) bands (ev): -18.0364 -18.0362 -17.5490 -17.5488 -17.4669 -17.4668 -16.9744 -16.9736 -16.4299 -16.4286 -16.4157 -16.4140 -16.4044 -16.4033 -16.3709 -16.3669 -7.2461 -7.2449 -6.4317 -6.4312 -6.2801 -6.2794 -5.1081 -5.1042 -4.3911 -4.3904 -4.2084 -4.2029 -3.9140 -3.9126 -3.7763 -3.7753 -2.4882 -2.4850 -2.0878 -2.0846 -1.8743 -1.8679 -1.6461 -1.6436 -1.3365 -1.3333 -1.1988 -1.1955 -1.1555 -1.1492 -0.6077 -0.6061 -0.5177 -0.5098 -0.4778 -0.4741 -0.2606 -0.2583 0.0133 0.0137 0.2182 0.2260 0.3193 0.3240 0.4733 0.4832 0.5552 0.5585 9.1402 9.1423 9.4408 9.4445 9.7110 9.7141 9.9836 9.9853 10.6052 10.6075 10.7361 10.7403 k = 0.2608 0.6701 0.4599 ( 6597 PWs) bands (ev): -18.0369 -18.0367 -17.5407 -17.5405 -17.4719 -17.4718 -16.9779 -16.9772 -16.4286 -16.4273 -16.4167 -16.4150 -16.4048 -16.4039 -16.3705 -16.3665 -7.2440 -7.2428 -6.4248 -6.4243 -6.2926 -6.2919 -5.1026 -5.0986 -4.3851 -4.3842 -4.2146 -4.2088 -3.9007 -3.8993 -3.7904 -3.7894 -2.4849 -2.4816 -2.0796 -2.0763 -1.8876 -1.8811 -1.6413 -1.6388 -1.3220 -1.3186 -1.2097 -1.2057 -1.1712 -1.1644 -0.6037 -0.6022 -0.5180 -0.5099 -0.4830 -0.4796 -0.2625 -0.2604 0.0186 0.0193 0.2253 0.2338 0.3164 0.3204 0.4783 0.4883 0.5520 0.5551 9.1517 9.1537 9.4477 9.4511 9.7244 9.7272 9.9451 9.9471 10.6080 10.6106 10.7353 10.7402 k = 0.2581 0.6631 0.4791 ( 6593 PWs) bands (ev): -18.0371 -18.0369 -17.5325 -17.5324 -17.4780 -17.4779 -16.9804 -16.9796 -16.4274 -16.4260 -16.4177 -16.4160 -16.4050 -16.4043 -16.3702 -16.3662 -7.2430 -7.2418 -6.4170 -6.4164 -6.3038 -6.3032 -5.0987 -5.0946 -4.3800 -4.3790 -4.2199 -4.2138 -3.8873 -3.8859 -3.8046 -3.8036 -2.4824 -2.4789 -2.0717 -2.0686 -1.8992 -1.8929 -1.6377 -1.6353 -1.3078 -1.3042 -1.2206 -1.2157 -1.1843 -1.1767 -0.6001 -0.5985 -0.5180 -0.5096 -0.4880 -0.4848 -0.2641 -0.2621 0.0227 0.0236 0.2309 0.2400 0.3140 0.3174 0.4825 0.4926 0.5494 0.5524 9.1633 9.1651 9.4536 9.4567 9.7375 9.7401 9.9096 9.9116 10.6095 10.6124 10.7352 10.7407 k = 0.2554 0.6562 0.4982 ( 6583 PWs) bands (ev): -18.0371 -18.0369 -17.5248 -17.5246 -17.4847 -17.4846 -16.9818 -16.9810 -16.4263 -16.4248 -16.4186 -16.4170 -16.4051 -16.4046 -16.3699 -16.3659 -7.2427 -7.2414 -6.4094 -6.4088 -6.3132 -6.3127 -5.0961 -5.0919 -4.3761 -4.3750 -4.2239 -4.2175 -3.8739 -3.8725 -3.8186 -3.8176 -2.4805 -2.4770 -2.0650 -2.0621 -1.9085 -1.9022 -1.6353 -1.6329 -1.2939 -1.2904 -1.2320 -1.2259 -1.1937 -1.1854 -0.5970 -0.5955 -0.5179 -0.5090 -0.4923 -0.4891 -0.2654 -0.2633 0.0256 0.0266 0.2349 0.2446 0.3123 0.3152 0.4856 0.4958 0.5477 0.5503 9.1739 9.1755 9.4580 9.4608 9.7491 9.7513 9.8798 9.8819 10.6102 10.6133 10.7358 10.7417 k = 0.2527 0.6492 0.5174 ( 6579 PWs) bands (ev): -18.0370 -18.0368 -17.5181 -17.5180 -17.4910 -17.4909 -16.9825 -16.9817 -16.4254 -16.4238 -16.4194 -16.4178 -16.4051 -16.4049 -16.3698 -16.3658 -7.2428 -7.2415 -6.4036 -6.4030 -6.3196 -6.3193 -5.0946 -5.0904 -4.3737 -4.3725 -4.2264 -4.2198 -3.8606 -3.8590 -3.8323 -3.8315 -2.4795 -2.4759 -2.0605 -2.0579 -1.9145 -1.9083 -1.6339 -1.6316 -1.2813 -1.2785 -1.2431 -1.2360 -1.1992 -1.1906 -0.5949 -0.5933 -0.5177 -0.5082 -0.4955 -0.4921 -0.2661 -0.2641 0.0273 0.0283 0.2372 0.2473 0.3113 0.3138 0.4876 0.4977 0.5467 0.5491 9.1821 9.1834 9.4604 9.4629 9.7571 9.7585 9.8600 9.8620 10.6102 10.6135 10.7364 10.7426 k = 0.2500 0.6423 0.5365 ( 6568 PWs) bands (ev): -18.0369 -18.0367 -17.5150 -17.5148 -17.4940 -17.4940 -16.9827 -16.9819 -16.4250 -16.4234 -16.4197 -16.4182 -16.4051 -16.4050 -16.3698 -16.3657 -7.2428 -7.2416 -6.4013 -6.4008 -6.3219 -6.3218 -5.0942 -5.0899 -4.3729 -4.3717 -4.2272 -4.2206 -3.8504 -3.8463 -3.8445 -3.8424 -2.4791 -2.4755 -2.0590 -2.0564 -1.9165 -1.9104 -1.6335 -1.6312 -1.2741 -1.2733 -1.2492 -1.2413 -1.2010 -1.1922 -0.5941 -0.5926 -0.5176 -0.5078 -0.4967 -0.4931 -0.2664 -0.2644 0.0278 0.0289 0.2380 0.2482 0.3110 0.3134 0.4882 0.4984 0.5464 0.5487 9.1854 9.1867 9.4610 9.4633 9.7597 9.7605 9.8534 9.8553 10.6102 10.6135 10.7367 10.7430 k = 0.2500 0.6423 0.5365 ( 6568 PWs) bands (ev): -18.0369 -18.0367 -17.5150 -17.5148 -17.4940 -17.4940 -16.9827 -16.9819 -16.4250 -16.4234 -16.4197 -16.4182 -16.4051 -16.4050 -16.3698 -16.3657 -7.2428 -7.2416 -6.4013 -6.4008 -6.3219 -6.3218 -5.0942 -5.0899 -4.3729 -4.3717 -4.2272 -4.2206 -3.8504 -3.8463 -3.8445 -3.8424 -2.4791 -2.4755 -2.0590 -2.0564 -1.9165 -1.9104 -1.6335 -1.6312 -1.2741 -1.2733 -1.2492 -1.2413 -1.2010 -1.1922 -0.5941 -0.5926 -0.5176 -0.5078 -0.4967 -0.4931 -0.2664 -0.2644 0.0278 0.0289 0.2380 0.2482 0.3110 0.3134 0.4882 0.4984 0.5464 0.5487 9.1854 9.1867 9.4610 9.4633 9.7597 9.7605 9.8534 9.8553 10.6102 10.6135 10.7367 10.7430 k = 0.2368 0.6474 0.5224 ( 6582 PWs) bands (ev): -18.0369 -18.0367 -17.5149 -17.5148 -17.4941 -17.4940 -16.9826 -16.9818 -16.4254 -16.4239 -16.4194 -16.4178 -16.4051 -16.4049 -16.3698 -16.3658 -7.2426 -7.2413 -6.4012 -6.4006 -6.3221 -6.3218 -5.0947 -5.0905 -4.3737 -4.3725 -4.2263 -4.2198 -3.8610 -3.8594 -3.8317 -3.8309 -2.4795 -2.4759 -2.0608 -2.0581 -1.9144 -1.9082 -1.6340 -1.6316 -1.2819 -1.2790 -1.2426 -1.2355 -1.1991 -1.1904 -0.5950 -0.5934 -0.5173 -0.5076 -0.4960 -0.4923 -0.2661 -0.2641 0.0274 0.0284 0.2378 0.2480 0.3107 0.3131 0.4875 0.4977 0.5466 0.5490 9.1822 9.1836 9.4617 9.4642 9.7572 9.7586 9.8588 9.8608 10.6107 10.6140 10.7363 10.7426 k = 0.2237 0.6525 0.5083 ( 6590 PWs) bands (ev): -18.0370 -18.0368 -17.5149 -17.5146 -17.4943 -17.4941 -16.9824 -16.9815 -16.4264 -16.4250 -16.4186 -16.4170 -16.4051 -16.4046 -16.3700 -16.3660 -7.2419 -7.2406 -6.4009 -6.4002 -6.3225 -6.3219 -5.0964 -5.0922 -4.3761 -4.3750 -4.2238 -4.2174 -3.8743 -3.8728 -3.8174 -3.8164 -2.4807 -2.4772 -2.0658 -2.0629 -1.9083 -1.9020 -1.6355 -1.6331 -1.2955 -1.2919 -1.2306 -1.2247 -1.1934 -1.1851 -0.5975 -0.5959 -0.5166 -0.5071 -0.4936 -0.4899 -0.2651 -0.2631 0.0260 0.0269 0.2375 0.2477 0.3099 0.3124 0.4853 0.4955 0.5473 0.5499 9.1733 9.1750 9.4634 9.4662 9.7525 9.7545 9.8732 9.8754 10.6121 10.6155 10.7353 10.7415 k = 0.2105 0.6576 0.4942 ( 6590 PWs) bands (ev): -18.0371 -18.0369 -17.5147 -17.5144 -17.4945 -17.4942 -16.9819 -16.9811 -16.4277 -16.4263 -16.4177 -16.4161 -16.4050 -16.4042 -16.3702 -16.3663 -7.2407 -7.2395 -6.4004 -6.3995 -6.3231 -6.3222 -5.0991 -5.0950 -4.3798 -4.3788 -4.2198 -4.2137 -3.8871 -3.8857 -3.8029 -3.8019 -2.4828 -2.4793 -2.0733 -2.0701 -1.8989 -1.8925 -1.6378 -1.6353 -1.3105 -1.3068 -1.2183 -1.2135 -1.1839 -1.1763 -0.6013 -0.5997 -0.5157 -0.5065 -0.4898 -0.4860 -0.2635 -0.2614 0.0237 0.0245 0.2368 0.2469 0.3088 0.3113 0.4819 0.4921 0.5483 0.5512 9.1597 9.1616 9.4647 9.4679 9.7496 9.7520 9.8932 9.8954 10.6145 10.6179 10.7338 10.7398 k = 0.1974 0.6628 0.4801 ( 6592 PWs) bands (ev): -18.0372 -18.0370 -17.5145 -17.5141 -17.4948 -17.4944 -16.9812 -16.9804 -16.4291 -16.4278 -16.4169 -16.4153 -16.4047 -16.4036 -16.3706 -16.3667 -7.2391 -7.2379 -6.3998 -6.3986 -6.3238 -6.3226 -5.1028 -5.0988 -4.3845 -4.3836 -4.2149 -4.2091 -3.8992 -3.8979 -3.7884 -3.7875 -2.4855 -2.4822 -2.0823 -2.0789 -1.8872 -1.8805 -1.6409 -1.6383 -1.3259 -1.3223 -1.2065 -1.2029 -1.1712 -1.1645 -0.6062 -0.6046 -0.5147 -0.5059 -0.4849 -0.4810 -0.2611 -0.2589 0.0206 0.0212 0.2354 0.2454 0.3074 0.3101 0.4774 0.4876 0.5496 0.5527 9.1426 9.1447 9.4641 9.4675 9.7513 9.7537 9.9163 9.9184 10.6174 10.6208 10.7320 10.7379 k = 0.1842 0.6679 0.4659 ( 6604 PWs) bands (ev): -18.0374 -18.0372 -17.5142 -17.5138 -17.4951 -17.4946 -16.9804 -16.9796 -16.4306 -16.4294 -16.4163 -16.4147 -16.4041 -16.4028 -16.3711 -16.3672 -7.2371 -7.2359 -6.3991 -6.3977 -6.3244 -6.3230 -5.1075 -5.1036 -4.3898 -4.3890 -4.2095 -4.2040 -3.9104 -3.9091 -3.7742 -3.7732 -2.4889 -2.4857 -2.0921 -2.0888 -1.8737 -1.8669 -1.6447 -1.6418 -1.3416 -1.3382 -1.1951 -1.1924 -1.1563 -1.1502 -0.6118 -0.6102 -0.5138 -0.5053 -0.4792 -0.4752 -0.2579 -0.2556 0.0167 0.0170 0.2333 0.2430 0.3062 0.3092 0.4721 0.4822 0.5511 0.5542 9.1234 9.1256 9.4607 9.4639 9.7588 9.7610 9.9409 9.9429 10.6205 10.6238 10.7305 10.7361 k = 0.1711 0.6730 0.4518 ( 6596 PWs) bands (ev): -18.0376 -18.0374 -17.5139 -17.5134 -17.4954 -17.4949 -16.9794 -16.9787 -16.4320 -16.4309 -16.4159 -16.4144 -16.4034 -16.4018 -16.3716 -16.3678 -7.2347 -7.2336 -6.3984 -6.3969 -6.3249 -6.3232 -5.1129 -5.1092 -4.3955 -4.3947 -4.2039 -4.1988 -3.9205 -3.9192 -3.7603 -3.7594 -2.4928 -2.4898 -2.1024 -2.0990 -1.8591 -1.8522 -1.6488 -1.6457 -1.3573 -1.3542 -1.1840 -1.1817 -1.1399 -1.1343 -0.6179 -0.6163 -0.5129 -0.5048 -0.4730 -0.4689 -0.2538 -0.2514 0.0121 0.0122 0.2299 0.2394 0.3055 0.3088 0.4660 0.4761 0.5525 0.5557 9.1029 9.1051 9.4540 9.4571 9.7722 9.7741 9.9661 9.9681 10.6236 10.6266 10.7296 10.7349 k = 0.1579 0.6781 0.4377 ( 6600 PWs) bands (ev): -18.0378 -18.0377 -17.5136 -17.5130 -17.4958 -17.4952 -16.9783 -16.9776 -16.4334 -16.4324 -16.4158 -16.4143 -16.4024 -16.4007 -16.3723 -16.3685 -7.2321 -7.2310 -6.3980 -6.3963 -6.3252 -6.3233 -5.1190 -5.1154 -4.4012 -4.4005 -4.1986 -4.1938 -3.9295 -3.9283 -3.7468 -3.7460 -2.4972 -2.4943 -2.1126 -2.1093 -1.8437 -1.8367 -1.6532 -1.6497 -1.3731 -1.3703 -1.1731 -1.1710 -1.1224 -1.1172 -0.6244 -0.6227 -0.5121 -0.5043 -0.4668 -0.4626 -0.2488 -0.2461 0.0065 0.0070 0.2253 0.2343 0.3055 0.3093 0.4594 0.4695 0.5539 0.5570 9.0820 9.0841 9.4447 9.4474 9.7906 9.7923 9.9912 9.9931 10.6260 10.6287 10.7296 10.7345 k = 0.1447 0.6832 0.4236 ( 6598 PWs) bands (ev): -18.0381 -18.0379 -17.5132 -17.5125 -17.4962 -17.4955 -16.9772 -16.9765 -16.4348 -16.4338 -16.4158 -16.4145 -16.4013 -16.3994 -16.3730 -16.3693 -7.2292 -7.2282 -6.3978 -6.3959 -6.3251 -6.3230 -5.1255 -5.1222 -4.4068 -4.4061 -4.1937 -4.1893 -3.9372 -3.9361 -3.7340 -3.7331 -2.5018 -2.4992 -2.1225 -2.1194 -1.8280 -1.8207 -1.6577 -1.6537 -1.3888 -1.3864 -1.1624 -1.1604 -1.1043 -1.0993 -0.6310 -0.6293 -0.5115 -0.5039 -0.4606 -0.4564 -0.2426 -0.2398 0.0004 0.0014 0.2192 0.2278 0.3064 0.3107 0.4523 0.4624 0.5552 0.5581 9.0613 9.0633 9.4335 9.4358 9.8130 9.8144 10.0158 10.0176 10.6275 10.6298 10.7307 10.7352 k = 0.1316 0.6884 0.4095 ( 6598 PWs) bands (ev): -18.0383 -18.0382 -17.5128 -17.5121 -17.4966 -17.4959 -16.9760 -16.9754 -16.4361 -16.4352 -16.4160 -16.4148 -16.4000 -16.3979 -16.3738 -16.3702 -7.2262 -7.2252 -6.3979 -6.3960 -6.3245 -6.3224 -5.1324 -5.1293 -4.4121 -4.4115 -4.1894 -4.1855 -3.9437 -3.9427 -3.7218 -3.7210 -2.5065 -2.5042 -2.1320 -2.1291 -1.8121 -1.8046 -1.6621 -1.6575 -1.4044 -1.4024 -1.1521 -1.1500 -1.0857 -1.0809 -0.6378 -0.6360 -0.5109 -0.5037 -0.4549 -0.4506 -0.2354 -0.2323 -0.0063 -0.0047 0.2117 0.2199 0.3083 0.3132 0.4450 0.4549 0.5563 0.5591 9.0412 9.0432 9.4212 9.4232 9.8382 9.8395 10.0392 10.0411 10.6278 10.6300 10.7328 10.7370 k = 0.1184 0.6935 0.3953 ( 6596 PWs) bands (ev): -18.0386 -18.0385 -17.5124 -17.5117 -17.4970 -17.4962 -16.9748 -16.9742 -16.4373 -16.4365 -16.4163 -16.4152 -16.3986 -16.3964 -16.3747 -16.3711 -7.2231 -7.2222 -6.3984 -6.3965 -6.3235 -6.3214 -5.1394 -5.1366 -4.4170 -4.4164 -4.1859 -4.1824 -3.9489 -3.9480 -3.7104 -3.7097 -2.5113 -2.5092 -2.1409 -2.1382 -1.7964 -1.7887 -1.6662 -1.6609 -1.4199 -1.4182 -1.1423 -1.1402 -1.0669 -1.0624 -0.6446 -0.6428 -0.5104 -0.5036 -0.4496 -0.4454 -0.2271 -0.2238 -0.0132 -0.0110 0.2032 0.2108 0.3111 0.3164 0.4373 0.4472 0.5573 0.5599 9.0222 9.0240 9.4086 9.4103 9.8652 9.8666 10.0611 10.0631 10.6268 10.6292 10.7355 10.7394 k = 0.1053 0.6986 0.3812 ( 6592 PWs) bands (ev): -18.0388 -18.0387 -17.5120 -17.5113 -17.4973 -17.4966 -16.9735 -16.9730 -16.4384 -16.4377 -16.4167 -16.4157 -16.3972 -16.3949 -16.3757 -16.3722 -7.2201 -7.2192 -6.3992 -6.3974 -6.3221 -6.3201 -5.1464 -5.1438 -4.4215 -4.4209 -4.1832 -4.1801 -3.9530 -3.9521 -3.7000 -3.6993 -2.5160 -2.5141 -2.1491 -2.1467 -1.7812 -1.7730 -1.6698 -1.6638 -1.4351 -1.4338 -1.1331 -1.1311 -1.0482 -1.0440 -0.6513 -0.6495 -0.5101 -0.5037 -0.4449 -0.4408 -0.2178 -0.2143 -0.0205 -0.0176 0.1938 0.2009 0.3147 0.3205 0.4296 0.4393 0.5582 0.5605 9.0045 9.0062 9.3962 9.3977 9.8933 9.8949 10.0810 10.0832 10.6249 10.6278 10.7383 10.7419 k = 0.0921 0.7037 0.3671 ( 6588 PWs) bands (ev): -18.0391 -18.0390 -17.5117 -17.5109 -17.4976 -17.4969 -16.9724 -16.9719 -16.4394 -16.4388 -16.4171 -16.4162 -16.3957 -16.3933 -16.3767 -16.3733 -7.2171 -7.2164 -6.4003 -6.3986 -6.3204 -6.3186 -5.1531 -5.1508 -4.4255 -4.4250 -4.1812 -4.1785 -3.9559 -3.9552 -3.6905 -3.6899 -2.5205 -2.5188 -2.1564 -2.1543 -1.7667 -1.7581 -1.6727 -1.6658 -1.4500 -1.4490 -1.1247 -1.1228 -1.0301 -1.0262 -0.6579 -0.6561 -0.5098 -0.5040 -0.4408 -0.4370 -0.2077 -0.2039 -0.0278 -0.0243 0.1839 0.1906 0.3190 0.3251 0.4217 0.4313 0.5589 0.5610 8.9884 8.9899 9.3846 9.3858 9.9218 9.9235 10.0986 10.1010 10.6225 10.6259 10.7406 10.7438 k = 0.0789 0.7089 0.3530 ( 6584 PWs) bands (ev): -18.0393 -18.0392 -17.5113 -17.5106 -17.4979 -17.4972 -16.9713 -16.9709 -16.4403 -16.4398 -16.4175 -16.4168 -16.3942 -16.3918 -16.3778 -16.3744 -7.2143 -7.2137 -6.4015 -6.4000 -6.3185 -6.3168 -5.1594 -5.1574 -4.4289 -4.4284 -4.1798 -4.1776 -3.9580 -3.9574 -3.6821 -3.6816 -2.5246 -2.5231 -2.1629 -2.1611 -1.7534 -1.7445 -1.6745 -1.6668 -1.4645 -1.4637 -1.1172 -1.1154 -1.0129 -1.0093 -0.6642 -0.6625 -0.5097 -0.5044 -0.4374 -0.4339 -0.1970 -0.1930 -0.0352 -0.0310 0.1740 0.1801 0.3239 0.3303 0.4138 0.4232 0.5595 0.5613 8.9742 8.9754 9.3740 9.3750 9.9499 9.9518 10.1134 10.1160 10.6200 10.6240 10.7418 10.7444 k = 0.0658 0.7140 0.3389 ( 6582 PWs) bands (ev): -18.0395 -18.0394 -17.5110 -17.5104 -17.4981 -17.4974 -16.9703 -16.9699 -16.4410 -16.4406 -16.4178 -16.4172 -16.3927 -16.3902 -16.3789 -16.3756 -7.2118 -7.2112 -6.4028 -6.4015 -6.3165 -6.3151 -5.1650 -5.1633 -4.4318 -4.4314 -4.1790 -4.1771 -3.9593 -3.9588 -3.6748 -3.6744 -2.5282 -2.5270 -2.1685 -2.1670 -1.7417 -1.7327 -1.6747 -1.6665 -1.4782 -1.4776 -1.1106 -1.1090 -0.9970 -0.9938 -0.6701 -0.6685 -0.5096 -0.5050 -0.4345 -0.4314 -0.1861 -0.1819 -0.0424 -0.0377 0.1646 0.1700 0.3292 0.3359 0.4061 0.4152 0.5600 0.5616 8.9618 8.9629 9.3646 9.3654 9.9769 9.9790 10.1251 10.1279 10.6178 10.6222 10.7413 10.7432 k = 0.0526 0.7191 0.3247 ( 6588 PWs) bands (ev): -18.0397 -18.0396 -17.5108 -17.5102 -17.4982 -17.4976 -16.9694 -16.9692 -16.4417 -16.4413 -16.4182 -16.4177 -16.3912 -16.3886 -16.3801 -16.3769 -7.2096 -7.2091 -6.4040 -6.4030 -6.3147 -6.3135 -5.1698 -5.1685 -4.4341 -4.4338 -4.1786 -4.1771 -3.9601 -3.9597 -3.6688 -3.6684 -2.5313 -2.5303 -2.1731 -2.1719 -1.7322 -1.7238 -1.6728 -1.6647 -1.4909 -1.4904 -1.1051 -1.1038 -0.9829 -0.9802 -0.6755 -0.6740 -0.5095 -0.5057 -0.4322 -0.4296 -0.1753 -0.1711 -0.0492 -0.0443 0.1560 0.1607 0.3349 0.3417 0.3986 0.4073 0.5605 0.5617 8.9516 8.9525 9.3568 9.3574 10.0021 10.0043 10.1335 10.1364 10.6162 10.6206 10.7391 10.7401 k = 0.0395 0.7242 0.3106 ( 6586 PWs) bands (ev): -18.0398 -18.0398 -17.5105 -17.5101 -17.4983 -17.4978 -16.9687 -16.9685 -16.4421 -16.4419 -16.4184 -16.4181 -16.3898 -16.3871 -16.3813 -16.3782 -7.2078 -7.2074 -6.4050 -6.4043 -6.3131 -6.3122 -5.1737 -5.1727 -4.4359 -4.4357 -4.1783 -4.1772 -3.9605 -3.9602 -3.6640 -3.6638 -2.5337 -2.5330 -2.1767 -2.1758 -1.7250 -1.7180 -1.6688 -1.6619 -1.5021 -1.5016 -1.1007 -1.0997 -0.9712 -0.9690 -0.6799 -0.6787 -0.5094 -0.5065 -0.4304 -0.4284 -0.1653 -0.1613 -0.0553 -0.0507 0.1489 0.1526 0.3408 0.3474 0.3915 0.3996 0.5608 0.5617 8.9436 8.9442 9.3506 9.3510 10.0245 10.0267 10.1386 10.1414 10.6154 10.6195 10.7352 10.7357 k = 0.0263 0.7293 0.2965 ( 6582 PWs) bands (ev): -18.0399 -18.0399 -17.5104 -17.5101 -17.4983 -17.4980 -16.9682 -16.9681 -16.4425 -16.4423 -16.4186 -16.4184 -16.3883 -16.3857 -16.3825 -16.3796 -7.2064 -7.2062 -6.4058 -6.4053 -6.3118 -6.3112 -5.1765 -5.1758 -4.4372 -4.4370 -4.1782 -4.1775 -3.9606 -3.9604 -3.6606 -3.6604 -2.5355 -2.5350 -2.1792 -2.1786 -1.7201 -1.7152 -1.6637 -1.6588 -1.5110 -1.5106 -1.0975 -1.0968 -0.9622 -0.9607 -0.6833 -0.6824 -0.5092 -0.5072 -0.4291 -0.4277 -0.1567 -0.1534 -0.0601 -0.0563 0.1436 0.1462 0.3467 0.3527 0.3854 0.3924 0.5611 0.5617 8.9378 8.9383 9.3461 9.3464 10.0428 10.0447 10.1409 10.1433 10.6154 10.6186 10.7307 10.7313 k = 0.0132 0.7345 0.2824 ( 6582 PWs) bands (ev): -18.0400 -18.0399 -17.5102 -17.5101 -17.4983 -17.4981 -16.9679 -16.9678 -16.4427 -16.4426 -16.4187 -16.4186 -16.3869 -16.3848 -16.3832 -16.3809 -7.2056 -7.2055 -6.4062 -6.4060 -6.3109 -6.3106 -5.1782 -5.1778 -4.4380 -4.4379 -4.1781 -4.1778 -3.9607 -3.9606 -3.6585 -3.6584 -2.5365 -2.5363 -2.1807 -2.1804 -1.7169 -1.7145 -1.6592 -1.6567 -1.5168 -1.5166 -1.0955 -1.0951 -0.9565 -0.9557 -0.6854 -0.6849 -0.5089 -0.5079 -0.4281 -0.4274 -0.1504 -0.1485 -0.0630 -0.0608 0.1405 0.1419 0.3521 0.3562 0.3815 0.3861 0.5613 0.5616 8.9344 8.9346 9.3434 9.3436 10.0555 10.0566 10.1416 10.1431 10.6160 10.6178 10.7273 10.7278 k = 0.0000 0.7396 0.2683 ( 6580 PWs) bands (ev): -18.0400 -18.0400 -17.5101 -17.5101 -17.4982 -17.4982 -16.9678 -16.9678 -16.4427 -16.4427 -16.4187 -16.4187 -16.3856 -16.3856 -16.3823 -16.3823 -7.2053 -7.2053 -6.4063 -6.4063 -6.3105 -6.3105 -5.1786 -5.1786 -4.4382 -4.4382 -4.1780 -4.1780 -3.9606 -3.9606 -3.6577 -3.6577 -2.5368 -2.5368 -2.1811 -2.1811 -1.7151 -1.7151 -1.6566 -1.6566 -1.5188 -1.5188 -1.0947 -1.0947 -0.9543 -0.9543 -0.6859 -0.6859 -0.5085 -0.5085 -0.4276 -0.4276 -0.1474 -0.1474 -0.0632 -0.0632 0.1399 0.1399 0.3559 0.3559 0.3818 0.3818 0.5615 0.5615 8.9333 8.9333 9.3426 9.3426 10.0604 10.0604 10.1422 10.1422 10.6169 10.6169 10.7262 10.7262 k = 0.0000 0.7396 0.2683 ( 6580 PWs) bands (ev): -18.0400 -18.0400 -17.5101 -17.5101 -17.4982 -17.4982 -16.9678 -16.9678 -16.4427 -16.4427 -16.4187 -16.4187 -16.3856 -16.3856 -16.3823 -16.3823 -7.2053 -7.2053 -6.4063 -6.4063 -6.3105 -6.3105 -5.1786 -5.1786 -4.4382 -4.4382 -4.1780 -4.1780 -3.9606 -3.9606 -3.6577 -3.6577 -2.5368 -2.5368 -2.1811 -2.1811 -1.7151 -1.7151 -1.6566 -1.6566 -1.5188 -1.5188 -1.0947 -1.0947 -0.9543 -0.9543 -0.6859 -0.6859 -0.5085 -0.5085 -0.4276 -0.4276 -0.1474 -0.1474 -0.0632 -0.0632 0.1399 0.1399 0.3559 0.3559 0.3818 0.3818 0.5615 0.5615 8.9333 8.9333 9.3426 9.3426 10.0604 10.0604 10.1422 10.1422 10.6169 10.6169 10.7262 10.7262 k =-0.0155 0.7350 0.2810 ( 6574 PWs) bands (ev): -18.0395 -18.0395 -17.5108 -17.5107 -17.4994 -17.4994 -16.9664 -16.9663 -16.4428 -16.4426 -16.4187 -16.4185 -16.3859 -16.3854 -16.3825 -16.3821 -7.2073 -7.2072 -6.4049 -6.4048 -6.3088 -6.3087 -5.1802 -5.1801 -4.4384 -4.4384 -4.1775 -4.1774 -3.9618 -3.9616 -3.6571 -3.6570 -2.5377 -2.5376 -2.1800 -2.1800 -1.7164 -1.7154 -1.6571 -1.6563 -1.5199 -1.5193 -1.0939 -1.0934 -0.9528 -0.9524 -0.6860 -0.6856 -0.5084 -0.5080 -0.4278 -0.4274 -0.1486 -0.1480 -0.0641 -0.0635 0.1391 0.1396 0.3539 0.3563 0.3812 0.3836 0.5620 0.5623 8.9348 8.9349 9.3434 9.3435 10.0579 10.0585 10.1416 10.1421 10.6141 10.6148 10.7248 10.7256 k =-0.0310 0.7303 0.2938 ( 6577 PWs) bands (ev): -18.0380 -18.0379 -17.5126 -17.5126 -17.5030 -17.5029 -16.9622 -16.9621 -16.4429 -16.4427 -16.4185 -16.4180 -16.3863 -16.3853 -16.3829 -16.3819 -7.2131 -7.2130 -6.4006 -6.4004 -6.3034 -6.3032 -5.1848 -5.1847 -4.4392 -4.4390 -4.1759 -4.1757 -3.9650 -3.9647 -3.6551 -3.6550 -2.5401 -2.5399 -2.1768 -2.1767 -1.7192 -1.7173 -1.6575 -1.6560 -1.5226 -1.5214 -1.0910 -1.0902 -0.9479 -0.9470 -0.6860 -0.6851 -0.5077 -0.5068 -0.4280 -0.4274 -0.1514 -0.1503 -0.0662 -0.0651 0.1369 0.1380 0.3511 0.3551 0.3817 0.3859 0.5639 0.5643 8.9394 8.9395 9.3460 9.3461 10.0509 10.0520 10.1404 10.1413 10.6070 10.6082 10.7217 10.7230 k =-0.0465 0.7257 0.3066 ( 6572 PWs) bands (ev): -18.0354 -18.0354 -17.5158 -17.5157 -17.5087 -17.5086 -16.9554 -16.9553 -16.4431 -16.4427 -16.4181 -16.4175 -16.3867 -16.3852 -16.3833 -16.3819 -7.2225 -7.2224 -6.3935 -6.3932 -6.2945 -6.2942 -5.1925 -5.1923 -4.4403 -4.4401 -4.1734 -4.1731 -3.9701 -3.9696 -3.6520 -3.6518 -2.5439 -2.5436 -2.1716 -2.1715 -1.7234 -1.7207 -1.6580 -1.6559 -1.5267 -1.5250 -1.0862 -1.0850 -0.9397 -0.9385 -0.6857 -0.6844 -0.5063 -0.5050 -0.4284 -0.4274 -0.1560 -0.1543 -0.0694 -0.0678 0.1332 0.1348 0.3482 0.3531 0.3832 0.3882 0.5668 0.5674 8.9470 8.9472 9.3502 9.3505 10.0396 10.0412 10.1386 10.1398 10.5963 10.5979 10.7175 10.7194 k =-0.0620 0.7211 0.3194 ( 6580 PWs) bands (ev): -18.0319 -18.0319 -17.5202 -17.5201 -17.5164 -17.5163 -16.9462 -16.9461 -16.4433 -16.4428 -16.4175 -16.4167 -16.3871 -16.3852 -16.3837 -16.3819 -7.2354 -7.2352 -6.3835 -6.3831 -6.2825 -6.2821 -5.2032 -5.2029 -4.4419 -4.4417 -4.1700 -4.1696 -3.9768 -3.9762 -3.6480 -3.6477 -2.5489 -2.5486 -2.1647 -2.1645 -1.7288 -1.7254 -1.6585 -1.6561 -1.5322 -1.5300 -1.0794 -1.0779 -0.9286 -0.9271 -0.6853 -0.6836 -0.5044 -0.5027 -0.4287 -0.4275 -0.1623 -0.1602 -0.0735 -0.0715 0.1278 0.1298 0.3457 0.3510 0.3849 0.3904 0.5707 0.5715 8.9576 8.9578 9.3562 9.3565 10.0243 10.0261 10.1362 10.1376 10.5830 10.5848 10.7130 10.7152 k =-0.0776 0.7164 0.3321 ( 6582 PWs) bands (ev): -18.0274 -18.0274 -17.5264 -17.5261 -17.5253 -17.5250 -16.9348 -16.9347 -16.4434 -16.4428 -16.4168 -16.4159 -16.3876 -16.3852 -16.3842 -16.3820 -7.2513 -7.2511 -6.3707 -6.3703 -6.2676 -6.2671 -5.2166 -5.2163 -4.4440 -4.4437 -4.1657 -4.1652 -3.9849 -3.9841 -3.6433 -3.6430 -2.5549 -2.5545 -2.1564 -2.1562 -1.7350 -1.7311 -1.6591 -1.6564 -1.5389 -1.5361 -1.0708 -1.0691 -0.9150 -0.9132 -0.6847 -0.6826 -0.5018 -0.4997 -0.4291 -0.4275 -0.1702 -0.1678 -0.0783 -0.0760 0.1202 0.1227 0.3443 0.3498 0.3866 0.3923 0.5754 0.5763 8.9712 8.9715 9.3639 9.3643 10.0052 10.0072 10.1331 10.1346 10.5677 10.5696 10.7086 10.7112 k =-0.0931 0.7118 0.3449 ( 6578 PWs) bands (ev): -18.0219 -18.0219 -17.5369 -17.5367 -17.5323 -17.5322 -16.9216 -16.9215 -16.4435 -16.4429 -16.4159 -16.4149 -16.3881 -16.3854 -16.3848 -16.3822 -7.2698 -7.2696 -6.3551 -6.3547 -6.2502 -6.2496 -5.2328 -5.2324 -4.4465 -4.4462 -4.1608 -4.1602 -3.9940 -3.9931 -3.6382 -3.6379 -2.5615 -2.5610 -2.1471 -2.1469 -1.7418 -1.7375 -1.6598 -1.6570 -1.5465 -1.5432 -1.0605 -1.0587 -0.8991 -0.8970 -0.6840 -0.6814 -0.4985 -0.4961 -0.4294 -0.4275 -0.1799 -0.1772 -0.0837 -0.0811 0.1105 0.1132 0.3443 0.3498 0.3883 0.3940 0.5806 0.5816 8.9877 8.9880 9.3732 9.3737 9.9829 9.9850 10.1292 10.1308 10.5507 10.5525 10.7050 10.7078 k =-0.1086 0.7071 0.3577 ( 6583 PWs) bands (ev): -18.0154 -18.0154 -17.5489 -17.5488 -17.5403 -17.5401 -16.9069 -16.9067 -16.4436 -16.4429 -16.4150 -16.4139 -16.3886 -16.3856 -16.3853 -16.3824 -7.2906 -7.2904 -6.3369 -6.3363 -6.2307 -6.2300 -5.2516 -5.2511 -4.4495 -4.4491 -4.1554 -4.1547 -4.0038 -4.0028 -3.6330 -3.6327 -2.5685 -2.5680 -2.1372 -2.1369 -1.7490 -1.7444 -1.6605 -1.6578 -1.5548 -1.5511 -1.0488 -1.0469 -0.8813 -0.8790 -0.6831 -0.6801 -0.4947 -0.4919 -0.4296 -0.4273 -0.1912 -0.1883 -0.0895 -0.0868 0.0984 0.1013 0.3457 0.3511 0.3899 0.3956 0.5860 0.5872 9.0071 9.0075 9.3841 9.3846 9.9577 9.9598 10.1243 10.1260 10.5319 10.5335 10.7024 10.7054 k =-0.1241 0.7025 0.3705 ( 6581 PWs) bands (ev): -18.0080 -18.0079 -17.5619 -17.5618 -17.5493 -17.5492 -16.8909 -16.8907 -16.4435 -16.4428 -16.4140 -16.4128 -16.3892 -16.3860 -16.3857 -16.3827 -7.3133 -7.3131 -6.3160 -6.3154 -6.2094 -6.2087 -5.2728 -5.2723 -4.4528 -4.4525 -4.1496 -4.1489 -4.0140 -4.0130 -3.6280 -3.6276 -2.5755 -2.5750 -2.1270 -2.1267 -1.7563 -1.7513 -1.6612 -1.6586 -1.5637 -1.5596 -1.0359 -1.0340 -0.8621 -0.8596 -0.6820 -0.6786 -0.4902 -0.4870 -0.4297 -0.4270 -0.2040 -0.2011 -0.0958 -0.0930 0.0841 0.0872 0.3486 0.3540 0.3914 0.3970 0.5917 0.5929 9.0293 9.0297 9.3966 9.3972 9.9302 9.9323 10.1183 10.1200 10.5110 10.5124 10.7012 10.7045 k =-0.1396 0.6979 0.3832 ( 6578 PWs) bands (ev): -17.9996 -17.9996 -17.5756 -17.5755 -17.5595 -17.5593 -16.8739 -16.8737 -16.4434 -16.4427 -16.4130 -16.4117 -16.3897 -16.3866 -16.3860 -16.3831 -7.3374 -7.3372 -6.2926 -6.2919 -6.1867 -6.1859 -5.2963 -5.2957 -4.4566 -4.4562 -4.1436 -4.1428 -4.0243 -4.0232 -3.6233 -3.6229 -2.5825 -2.5820 -2.1169 -2.1165 -1.7632 -1.7580 -1.6618 -1.6593 -1.5730 -1.5686 -1.0222 -1.0203 -0.8419 -0.8391 -0.6807 -0.6770 -0.4851 -0.4816 -0.4295 -0.4265 -0.2183 -0.2153 -0.1024 -0.0997 0.0678 0.0710 0.3527 0.3581 0.3930 0.3986 0.5973 0.5986 9.0542 9.0547 9.4105 9.4112 9.9010 9.9031 10.1111 10.1128 10.4875 10.4887 10.7016 10.7052 k =-0.1551 0.6932 0.3960 ( 6573 PWs) bands (ev): -17.9903 -17.9903 -17.5897 -17.5896 -17.5707 -17.5705 -16.8562 -16.8560 -16.4431 -16.4424 -16.4120 -16.4106 -16.3902 -16.3872 -16.3863 -16.3835 -7.3626 -7.3624 -6.2667 -6.2660 -6.1628 -6.1621 -5.3219 -5.3213 -4.4608 -4.4605 -4.1377 -4.1368 -4.0346 -4.0335 -3.6191 -3.6187 -2.5891 -2.5886 -2.1074 -2.1068 -1.7696 -1.7641 -1.6622 -1.6599 -1.5826 -1.5779 -1.0079 -1.0062 -0.8209 -0.8179 -0.6792 -0.6751 -0.4794 -0.4757 -0.4290 -0.4256 -0.2338 -0.2308 -0.1095 -0.1068 0.0499 0.0532 0.3579 0.3633 0.3947 0.4002 0.6029 0.6042 9.0817 9.0822 9.4259 9.4266 9.8705 9.8725 10.1024 10.1042 10.4611 10.4621 10.7038 10.7077 k =-0.1706 0.6886 0.4088 ( 6575 PWs) bands (ev): -17.9802 -17.9801 -17.6041 -17.6039 -17.5829 -17.5827 -16.8380 -16.8378 -16.4427 -16.4420 -16.4110 -16.4096 -16.3907 -16.3877 -16.3867 -16.3840 -7.3886 -7.3885 -6.2386 -6.2378 -6.1382 -6.1374 -5.3494 -5.3487 -4.4654 -4.4651 -4.1318 -4.1309 -4.0446 -4.0434 -3.6156 -3.6152 -2.5952 -2.5947 -2.0987 -2.0980 -1.7752 -1.7694 -1.6622 -1.6602 -1.5923 -1.5873 -0.9935 -0.9919 -0.7996 -0.7963 -0.6774 -0.6729 -0.4731 -0.4691 -0.4282 -0.4244 -0.2504 -0.2474 -0.1170 -0.1144 0.0307 0.0340 0.3640 0.3693 0.3966 0.4020 0.6083 0.6096 9.1117 9.1122 9.4425 9.4432 9.8393 9.8412 10.0922 10.0940 10.4313 10.4321 10.7077 10.7120 k =-0.1861 0.6840 0.4216 ( 6576 PWs) bands (ev): -17.9692 -17.9691 -17.6185 -17.6184 -17.5960 -17.5959 -16.8195 -16.8193 -16.4422 -16.4415 -16.4101 -16.4087 -16.3911 -16.3882 -16.3870 -16.3845 -7.4151 -7.4150 -6.2082 -6.2074 -6.1131 -6.1122 -5.3787 -5.3780 -4.4704 -4.4700 -4.1262 -4.1252 -4.0542 -4.0530 -3.6128 -3.6125 -2.6006 -2.6002 -2.0911 -2.0903 -1.7796 -1.7736 -1.6620 -1.6602 -1.6018 -1.5967 -0.9794 -0.9779 -0.7782 -0.7746 -0.6753 -0.6704 -0.4663 -0.4621 -0.4270 -0.4227 -0.2681 -0.2651 -0.1249 -0.1224 0.0105 0.0138 0.3706 0.3760 0.3988 0.4042 0.6134 0.6147 9.1440 9.1445 9.4604 9.4611 9.8077 9.8096 10.0802 10.0821 10.3980 10.3986 10.7132 10.7178 k =-0.2017 0.6793 0.4343 ( 6577 PWs) bands (ev): -17.9573 -17.9573 -17.6329 -17.6327 -17.6101 -17.6099 -16.8010 -16.8008 -16.4415 -16.4409 -16.4092 -16.4079 -16.3914 -16.3888 -16.3873 -16.3851 -7.4418 -7.4417 -6.1759 -6.1750 -6.0876 -6.0867 -5.4096 -5.4089 -4.4756 -4.4753 -4.1211 -4.1200 -4.0632 -4.0620 -3.6110 -3.6107 -2.6052 -2.6048 -2.0850 -2.0840 -1.7827 -1.7766 -1.6612 -1.6597 -1.6111 -1.6059 -0.9659 -0.9645 -0.7570 -0.7531 -0.6727 -0.6675 -0.4590 -0.4546 -0.4253 -0.4205 -0.2865 -0.2835 -0.1333 -0.1309 -0.0103 -0.0071 0.3776 0.3830 0.4013 0.4066 0.6183 0.6196 9.1785 9.1789 9.4792 9.4799 9.7762 9.7780 10.0662 10.0681 10.3614 10.3619 10.7198 10.7248 k =-0.2172 0.6747 0.4471 ( 6579 PWs) bands (ev): -17.9448 -17.9447 -17.6470 -17.6469 -17.6249 -17.6248 -16.7825 -16.7824 -16.4407 -16.4401 -16.4084 -16.4072 -16.3916 -16.3892 -16.3876 -16.3856 -7.4684 -7.4683 -6.1416 -6.1407 -6.0620 -6.0611 -5.4418 -5.4411 -4.4811 -4.4808 -4.1165 -4.1154 -4.0716 -4.0703 -3.6101 -3.6098 -2.6089 -2.6085 -2.0803 -2.0793 -1.7845 -1.7784 -1.6600 -1.6587 -1.6198 -1.6147 -0.9535 -0.9523 -0.7364 -0.7320 -0.6695 -0.6641 -0.4516 -0.4467 -0.4230 -0.4176 -0.3057 -0.3025 -0.1420 -0.1399 -0.0314 -0.0282 0.3848 0.3901 0.4043 0.4095 0.6230 0.6242 9.2149 9.2153 9.4986 9.4994 9.7452 9.7469 10.0498 10.0517 10.3221 10.3226 10.7271 10.7325 k =-0.2327 0.6701 0.4599 ( 6584 PWs) bands (ev): -17.9315 -17.9315 -17.6609 -17.6608 -17.6405 -17.6403 -16.7643 -16.7642 -16.4397 -16.4392 -16.4078 -16.4067 -16.3917 -16.3897 -16.3878 -16.3861 -7.4948 -7.4947 -6.1059 -6.1049 -6.0365 -6.0355 -5.4752 -5.4745 -4.4868 -4.4865 -4.1126 -4.1115 -4.0792 -4.0779 -3.6103 -3.6100 -2.6115 -2.6112 -2.0772 -2.0762 -1.7852 -1.7793 -1.6583 -1.6571 -1.6276 -1.6228 -0.9425 -0.9415 -0.7165 -0.7118 -0.6657 -0.6601 -0.4442 -0.4388 -0.4202 -0.4141 -0.3252 -0.3217 -0.1510 -0.1491 -0.0523 -0.0493 0.3920 0.3970 0.4080 0.4128 0.6274 0.6285 9.2531 9.2534 9.5185 9.5192 9.7149 9.7165 10.0302 10.0322 10.2814 10.2820 10.7344 10.7403 k =-0.2482 0.6654 0.4727 ( 6582 PWs) bands (ev): -17.9177 -17.9176 -17.6743 -17.6742 -17.6566 -17.6564 -16.7466 -16.7464 -16.4386 -16.4382 -16.4073 -16.4063 -16.3916 -16.3900 -16.3878 -16.3865 -7.5206 -7.5205 -6.0688 -6.0678 -6.0112 -6.0103 -5.5095 -5.5088 -4.4925 -4.4923 -4.1095 -4.1084 -4.0861 -4.0848 -3.6115 -3.6112 -2.6130 -2.6128 -2.0756 -2.0746 -1.7850 -1.7796 -1.6559 -1.6549 -1.6339 -1.6297 -0.9333 -0.9325 -0.6978 -0.6928 -0.6613 -0.6555 -0.4375 -0.4311 -0.4167 -0.4099 -0.3448 -0.3408 -0.1603 -0.1587 -0.0728 -0.0701 0.3991 0.4035 0.4123 0.4166 0.6315 0.6325 9.2926 9.2929 9.5380 9.5387 9.6857 9.6872 10.0068 10.0088 10.2413 10.2420 10.7409 10.7472 k =-0.2637 0.6608 0.4854 ( 6578 PWs) bands (ev): -17.9035 -17.9034 -17.6873 -17.6872 -17.6731 -17.6729 -16.7294 -16.7293 -16.4374 -16.4370 -16.4070 -16.4061 -16.3915 -16.3904 -16.3878 -16.3869 -7.5458 -7.5457 -6.0308 -6.0298 -5.9864 -5.9855 -5.5442 -5.5436 -4.4982 -4.4981 -4.1074 -4.1061 -4.0920 -4.0908 -3.6137 -3.6135 -2.6134 -2.6132 -2.0752 -2.0744 -1.7845 -1.7798 -1.6531 -1.6521 -1.6384 -1.6350 -0.9262 -0.9255 -0.6805 -0.6751 -0.6561 -0.6502 -0.4322 -0.4248 -0.4122 -0.4048 -0.3636 -0.3589 -0.1698 -0.1685 -0.0925 -0.0901 0.4060 0.4095 0.4176 0.4209 0.6354 0.6363 9.3332 9.3335 9.5561 9.5569 9.6578 9.6592 9.9788 9.9806 10.2040 10.2048 10.7458 10.7526 k =-0.2792 0.6562 0.4982 ( 6572 PWs) bands (ev): -17.8891 -17.8891 -17.6997 -17.6996 -17.6896 -17.6895 -16.7129 -16.7128 -16.4360 -16.4357 -16.4067 -16.4061 -16.3913 -16.3906 -16.3877 -16.3871 -7.5700 -7.5700 -5.9927 -5.9916 -5.9621 -5.9612 -5.5788 -5.5782 -4.5039 -4.5038 -4.1062 -4.1050 -4.0971 -4.0959 -3.6170 -3.6168 -2.6125 -2.6124 -2.0759 -2.0753 -1.7843 -1.7806 -1.6499 -1.6488 -1.6404 -1.6381 -0.9213 -0.9208 -0.6649 -0.6594 -0.6501 -0.6443 -0.4299 -0.4225 -0.4064 -0.3991 -0.3797 -0.3741 -0.1793 -0.1784 -0.1109 -0.1089 0.4127 0.4149 0.4235 0.4256 0.6391 0.6398 9.3745 9.3746 9.5711 9.5719 9.6314 9.6328 9.9465 9.9481 10.1720 10.1727 10.7483 10.7564 k =-0.2947 0.6515 0.5110 ( 6556 PWs) bands (ev): -17.8751 -17.8750 -17.7114 -17.7114 -17.7058 -17.7057 -16.6972 -16.6972 -16.4345 -16.4343 -16.4066 -16.4062 -16.3910 -16.3906 -16.3874 -16.3872 -7.5932 -7.5932 -5.9555 -5.9545 -5.9386 -5.9377 -5.6121 -5.6116 -4.5093 -4.5093 -4.1061 -4.1051 -4.1012 -4.1002 -3.6214 -3.6213 -2.6104 -2.6104 -2.0774 -2.0769 -1.7850 -1.7825 -1.6463 -1.6450 -1.6395 -1.6385 -0.9187 -0.9183 -0.6514 -0.6468 -0.6427 -0.6380 -0.4332 -0.4278 -0.4000 -0.3934 -0.3888 -0.3833 -0.1888 -0.1883 -0.1274 -0.1260 0.4190 0.4202 0.4296 0.4306 0.6426 0.6430 9.4157 9.4158 9.5800 9.5809 9.6068 9.6081 9.9125 9.9137 10.1465 10.1471 10.7470 10.7538 k =-0.3102 0.6469 0.5238 ( 6562 PWs) bands (ev): -17.8622 -17.8621 -17.7225 -17.7224 -17.7207 -17.7206 -16.6825 -16.6825 -16.4329 -16.4328 -16.4067 -16.4065 -16.3907 -16.3905 -16.3871 -16.3870 -7.6152 -7.6152 -5.9215 -5.9205 -5.9158 -5.9149 -5.6421 -5.6417 -4.5145 -4.5144 -4.1073 -4.1069 -4.1038 -4.1035 -3.6268 -3.6267 -2.6071 -2.6071 -2.0793 -2.0791 -1.7870 -1.7857 -1.6419 -1.6410 -1.6360 -1.6358 -0.9183 -0.9181 -0.6404 -0.6389 -0.6330 -0.6315 -0.4431 -0.4407 -0.3941 -0.3914 -0.3869 -0.3848 -0.1981 -0.1980 -0.1417 -0.1409 0.4251 0.4256 0.4356 0.4360 0.6458 0.6461 9.4559 9.4561 9.5779 9.5791 9.5842 9.5855 9.8825 9.8831 10.1279 10.1282 10.7416 10.7446 k =-0.3258 0.6423 0.5365 ( 6566 PWs) bands (ev): -17.8519 -17.8519 -17.7330 -17.7330 -17.7326 -17.7326 -16.6689 -16.6689 -16.4312 -16.4312 -16.4068 -16.4068 -16.3902 -16.3902 -16.3867 -16.3867 -7.6358 -7.6358 -5.8950 -5.8950 -5.8927 -5.8927 -5.6646 -5.6646 -4.5192 -4.5192 -4.1095 -4.1095 -4.1061 -4.1061 -3.6332 -3.6332 -2.6025 -2.6025 -2.0815 -2.0815 -1.7903 -1.7903 -1.6361 -1.6361 -1.6307 -1.6306 -0.9201 -0.9201 -0.6324 -0.6324 -0.6251 -0.6251 -0.4562 -0.4562 -0.3892 -0.3892 -0.3823 -0.3823 -0.2071 -0.2071 -0.1531 -0.1531 0.4310 0.4310 0.4415 0.4415 0.6489 0.6489 9.4917 9.4917 9.5625 9.5625 9.5650 9.5650 9.8628 9.8628 10.1160 10.1160 10.7294 10.7296 k =-0.3258 0.6423 0.5365 ( 6566 PWs) bands (ev): -17.8519 -17.8519 -17.7330 -17.7330 -17.7326 -17.7326 -16.6689 -16.6689 -16.4312 -16.4312 -16.4068 -16.4068 -16.3902 -16.3902 -16.3867 -16.3867 -7.6358 -7.6358 -5.8950 -5.8950 -5.8927 -5.8927 -5.6646 -5.6646 -4.5192 -4.5192 -4.1095 -4.1095 -4.1061 -4.1061 -3.6332 -3.6332 -2.6025 -2.6025 -2.0815 -2.0815 -1.7903 -1.7903 -1.6361 -1.6361 -1.6307 -1.6306 -0.9201 -0.9201 -0.6324 -0.6324 -0.6251 -0.6251 -0.4562 -0.4562 -0.3892 -0.3892 -0.3823 -0.3823 -0.2071 -0.2071 -0.1531 -0.1531 0.4310 0.4310 0.4415 0.4415 0.6489 0.6489 9.4917 9.4917 9.5625 9.5625 9.5650 9.5650 9.8628 9.8628 10.1160 10.1160 10.7295 10.7377 k =-0.3333 0.6228 0.5365 ( 6562 PWs) bands (ev): -17.8351 -17.8351 -17.7536 -17.7536 -17.7532 -17.7532 -16.6417 -16.6417 -16.4277 -16.4277 -16.4073 -16.4073 -16.3893 -16.3893 -16.3857 -16.3857 -7.6771 -7.6771 -5.8508 -5.8508 -5.8484 -5.8484 -5.6998 -5.6998 -4.5283 -4.5283 -4.1152 -4.1152 -4.1118 -4.1118 -3.6483 -3.6483 -2.5912 -2.5912 -2.0854 -2.0854 -1.7997 -1.7997 -1.6235 -1.6235 -1.6180 -1.6180 -0.9263 -0.9263 -0.6196 -0.6196 -0.6127 -0.6127 -0.4874 -0.4874 -0.3814 -0.3814 -0.3741 -0.3741 -0.2258 -0.2258 -0.1727 -0.1727 0.4424 0.4424 0.4528 0.4528 0.6546 0.6546 9.5208 9.5208 9.5226 9.5226 9.5523 9.5523 9.8356 9.8356 10.0987 10.0987 10.7024 10.7036 k =-0.3409 0.6033 0.5365 ( 6550 PWs) bands (ev): -17.8189 -17.8189 -17.7735 -17.7735 -17.7731 -17.7731 -16.6151 -16.6151 -16.4243 -16.4243 -16.4073 -16.4073 -16.3883 -16.3883 -16.3848 -16.3847 -7.7171 -7.7171 -5.8071 -5.8071 -5.8046 -5.8045 -5.7346 -5.7346 -4.5367 -4.5367 -4.1218 -4.1218 -4.1184 -4.1184 -3.6643 -3.6643 -2.5791 -2.5791 -2.0872 -2.0872 -1.8091 -1.8091 -1.6108 -1.6108 -1.6054 -1.6054 -0.9327 -0.9327 -0.6079 -0.6079 -0.6011 -0.6011 -0.5206 -0.5206 -0.3727 -0.3727 -0.3652 -0.3652 -0.2449 -0.2449 -0.1892 -0.1892 0.4529 0.4530 0.4633 0.4633 0.6601 0.6601 9.4786 9.4786 9.4806 9.4806 9.6039 9.6039 9.8108 9.8108 10.0841 10.0841 10.6744 10.6822 k =-0.3485 0.5839 0.5365 ( 6554 PWs) bands (ev): -17.8034 -17.8034 -17.7928 -17.7928 -17.7924 -17.7924 -16.5891 -16.5891 -16.4214 -16.4214 -16.4067 -16.4067 -16.3874 -16.3874 -16.3838 -16.3838 -7.7560 -7.7560 -5.7703 -5.7703 -5.7626 -5.7626 -5.7611 -5.7611 -4.5445 -4.5445 -4.1292 -4.1292 -4.1258 -4.1258 -3.6812 -3.6812 -2.5662 -2.5662 -2.0870 -2.0870 -1.8185 -1.8185 -1.5983 -1.5983 -1.5929 -1.5929 -0.9397 -0.9397 -0.5973 -0.5973 -0.5905 -0.5905 -0.5552 -0.5552 -0.3632 -0.3632 -0.3556 -0.3556 -0.2635 -0.2635 -0.2034 -0.2034 0.4626 0.4626 0.4729 0.4729 0.6654 0.6654 9.4356 9.4356 9.4377 9.4377 9.6437 9.6437 9.7926 9.7926 10.0731 10.0731 10.6464 10.6476 k =-0.3561 0.5644 0.5365 ( 6562 PWs) bands (ev): -17.8115 -17.8115 -17.8110 -17.8110 -17.7884 -17.7884 -16.5638 -16.5638 -16.4194 -16.4194 -16.4050 -16.4050 -16.3864 -16.3864 -16.3828 -16.3828 -7.7934 -7.7934 -5.8029 -5.8029 -5.7210 -5.7210 -5.7185 -5.7185 -4.5516 -4.5516 -4.1374 -4.1374 -4.1340 -4.1340 -3.6987 -3.6987 -2.5526 -2.5526 -2.0848 -2.0848 -1.8277 -1.8277 -1.5858 -1.5858 -1.5806 -1.5806 -0.9473 -0.9473 -0.5943 -0.5943 -0.5847 -0.5847 -0.5808 -0.5808 -0.3530 -0.3530 -0.3453 -0.3453 -0.2811 -0.2811 -0.2160 -0.2160 0.4715 0.4715 0.4817 0.4817 0.6704 0.6704 9.3923 9.3923 9.3944 9.3944 9.6627 9.6627 9.7883 9.7883 10.0670 10.0670 10.6192 10.6194 k =-0.3636 0.5450 0.5365 ( 6542 PWs) bands (ev): -17.8293 -17.8293 -17.8289 -17.8288 -17.7742 -17.7742 -16.5393 -16.5393 -16.4183 -16.4183 -16.4022 -16.4022 -16.3854 -16.3854 -16.3818 -16.3818 -7.8295 -7.8295 -5.8357 -5.8357 -5.6791 -5.6791 -5.6764 -5.6764 -4.5581 -4.5581 -4.1463 -4.1463 -4.1429 -4.1428 -3.7167 -3.7167 -2.5385 -2.5385 -2.0804 -2.0804 -1.8368 -1.8368 -1.5735 -1.5735 -1.5684 -1.5684 -0.9560 -0.9560 -0.6284 -0.6284 -0.5784 -0.5784 -0.5726 -0.5726 -0.3421 -0.3421 -0.3345 -0.3345 -0.2974 -0.2974 -0.2273 -0.2273 0.4796 0.4796 0.4896 0.4897 0.6752 0.6752 9.3489 9.3490 9.3511 9.3511 9.6582 9.6582 9.7992 9.7992 10.0675 10.0675 10.5931 10.5932 k =-0.3712 0.5255 0.5365 ( 6554 PWs) bands (ev): -17.8464 -17.8464 -17.8459 -17.8459 -17.7607 -17.7607 -16.5157 -16.5157 -16.4179 -16.4179 -16.3985 -16.3985 -16.3844 -16.3844 -16.3808 -16.3808 -7.8641 -7.8641 -5.8677 -5.8677 -5.6380 -5.6380 -5.6352 -5.6352 -4.5638 -4.5638 -4.1558 -4.1558 -4.1524 -4.1524 -3.7351 -3.7351 -2.5241 -2.5241 -2.0741 -2.0741 -1.8457 -1.8457 -1.5614 -1.5614 -1.5564 -1.5564 -0.9663 -0.9663 -0.6643 -0.6643 -0.5713 -0.5713 -0.5653 -0.5653 -0.3309 -0.3309 -0.3241 -0.3241 -0.3112 -0.3112 -0.2376 -0.2376 0.4870 0.4870 0.4968 0.4968 0.6797 0.6797 9.3058 9.3058 9.3081 9.3081 9.6403 9.6403 9.8137 9.8137 10.0763 10.0763 10.5682 10.5712 k =-0.3788 0.5060 0.5365 ( 6558 PWs) bands (ev): -17.8627 -17.8627 -17.8622 -17.8622 -17.7479 -17.7479 -16.4932 -16.4932 -16.4178 -16.4178 -16.3943 -16.3943 -16.3835 -16.3835 -16.3798 -16.3798 -7.8972 -7.8972 -5.8987 -5.8987 -5.5978 -5.5978 -5.5949 -5.5949 -4.5690 -4.5690 -4.1660 -4.1660 -4.1627 -4.1626 -3.7536 -3.7536 -2.5093 -2.5093 -2.0659 -2.0659 -1.8543 -1.8543 -1.5496 -1.5496 -1.5447 -1.5447 -0.9787 -0.9787 -0.6990 -0.6990 -0.5651 -0.5651 -0.5591 -0.5591 -0.3296 -0.3296 -0.3177 -0.3177 -0.3093 -0.3093 -0.2470 -0.2470 0.4936 0.4936 0.5032 0.5032 0.6839 0.6839 9.2632 9.2632 9.2656 9.2656 9.6174 9.6174 9.8230 9.8230 10.0937 10.0937 10.5449 10.5450 k =-0.3864 0.4866 0.5365 ( 6550 PWs) bands (ev): -17.8782 -17.8781 -17.8776 -17.8776 -17.7358 -17.7358 -16.4719 -16.4719 -16.4176 -16.4176 -16.3898 -16.3898 -16.3825 -16.3825 -16.3789 -16.3789 -7.9286 -7.9286 -5.9284 -5.9284 -5.5586 -5.5586 -5.5556 -5.5556 -4.5734 -4.5734 -4.1767 -4.1767 -4.1734 -4.1734 -3.7722 -3.7722 -2.4945 -2.4945 -2.0558 -2.0558 -1.8623 -1.8623 -1.5380 -1.5380 -1.5333 -1.5333 -0.9939 -0.9939 -0.7316 -0.7316 -0.5599 -0.5599 -0.5538 -0.5538 -0.3416 -0.3416 -0.3061 -0.3061 -0.2979 -0.2979 -0.2556 -0.2556 0.4996 0.4997 0.5089 0.5090 0.6880 0.6880 9.2214 9.2214 9.2239 9.2240 9.5931 9.5931 9.8255 9.8255 10.1183 10.1183 10.5231 10.5235 k =-0.3939 0.4671 0.5365 ( 6542 PWs) bands (ev): -17.8927 -17.8927 -17.8922 -17.8922 -17.7246 -17.7246 -16.4524 -16.4524 -16.4168 -16.4168 -16.3852 -16.3852 -16.3816 -16.3816 -16.3780 -16.3780 -7.9584 -7.9584 -5.9570 -5.9570 -5.5206 -5.5206 -5.5175 -5.5175 -4.5773 -4.5773 -4.1879 -4.1879 -4.1846 -4.1846 -3.7907 -3.7907 -2.4797 -2.4797 -2.0441 -2.0441 -1.8696 -1.8696 -1.5268 -1.5268 -1.5222 -1.5222 -1.0129 -1.0129 -0.7609 -0.7609 -0.5556 -0.5556 -0.5495 -0.5495 -0.3535 -0.3535 -0.2942 -0.2942 -0.2861 -0.2861 -0.2631 -0.2631 0.5050 0.5051 0.5140 0.5140 0.6918 0.6918 9.1808 9.1808 9.1835 9.1835 9.5688 9.5688 9.8223 9.8223 10.1474 10.1474 10.5031 10.5032 k =-0.4015 0.4476 0.5365 ( 6570 PWs) bands (ev): -17.9064 -17.9064 -17.9059 -17.9059 -17.7141 -17.7141 -16.4366 -16.4365 -16.4137 -16.4137 -16.3810 -16.3810 -16.3802 -16.3802 -16.3771 -16.3771 -7.9864 -7.9864 -5.9841 -5.9841 -5.4839 -5.4839 -5.4808 -5.4807 -4.5806 -4.5806 -4.1994 -4.1994 -4.1962 -4.1962 -3.8089 -3.8089 -2.4652 -2.4652 -2.0311 -2.0311 -1.8758 -1.8758 -1.5161 -1.5161 -1.5116 -1.5116 -1.0362 -1.0362 -0.7862 -0.7862 -0.5520 -0.5520 -0.5459 -0.5459 -0.3647 -0.3647 -0.2836 -0.2836 -0.2747 -0.2747 -0.2683 -0.2683 0.5099 0.5099 0.5185 0.5185 0.6953 0.6953 9.1417 9.1417 9.1444 9.1444 9.5453 9.5453 9.8153 9.8153 10.1787 10.1787 10.4848 10.4848 k =-0.4091 0.4282 0.5365 ( 6578 PWs) bands (ev): -17.9192 -17.9192 -17.9187 -17.9187 -17.7043 -17.7043 -16.4282 -16.4282 -16.4044 -16.4044 -16.3799 -16.3799 -16.3765 -16.3765 -16.3755 -16.3755 -8.0126 -8.0126 -6.0097 -6.0097 -5.4486 -5.4486 -5.4454 -5.4454 -4.5833 -4.5833 -4.2112 -4.2112 -4.2080 -4.2080 -3.8266 -3.8266 -2.4509 -2.4509 -2.0175 -2.0175 -1.8802 -1.8802 -1.5058 -1.5057 -1.5015 -1.5015 -1.0639 -1.0639 -0.8070 -0.8070 -0.5491 -0.5491 -0.5430 -0.5430 -0.3751 -0.3751 -0.2812 -0.2812 -0.2667 -0.2667 -0.2619 -0.2619 0.5142 0.5142 0.5224 0.5224 0.6987 0.6987 9.1042 9.1042 9.1071 9.1071 9.5229 9.5229 9.8061 9.8061 10.2103 10.2103 10.4683 10.4684 k =-0.4167 0.4087 0.5365 ( 6566 PWs) bands (ev): -17.9311 -17.9310 -17.9305 -17.9305 -17.6954 -17.6954 -16.4258 -16.4258 -16.3907 -16.3907 -16.3788 -16.3788 -16.3756 -16.3756 -16.3708 -16.3708 -8.0370 -8.0370 -6.0337 -6.0337 -5.4150 -5.4149 -5.4118 -5.4118 -4.5854 -4.5854 -4.2230 -4.2230 -4.2199 -4.2199 -3.8436 -3.8436 -2.4372 -2.4372 -2.0043 -2.0043 -1.8819 -1.8819 -1.4959 -1.4959 -1.4919 -1.4919 -1.0958 -1.0958 -0.8235 -0.8235 -0.5468 -0.5468 -0.5407 -0.5406 -0.3848 -0.3848 -0.2856 -0.2856 -0.2565 -0.2565 -0.2511 -0.2511 0.5181 0.5181 0.5258 0.5258 0.7018 0.7018 9.0688 9.0688 9.0717 9.0717 9.5019 9.5019 9.7957 9.7957 10.2412 10.2412 10.4535 10.4535 k =-0.4242 0.3893 0.5365 ( 6562 PWs) bands (ev): -17.9419 -17.9419 -17.9414 -17.9414 -17.6872 -17.6872 -16.4253 -16.4253 -16.3802 -16.3802 -16.3751 -16.3751 -16.3748 -16.3748 -16.3652 -16.3651 -8.0594 -8.0594 -6.0559 -6.0559 -5.3831 -5.3831 -5.3799 -5.3799 -4.5871 -4.5871 -4.2348 -4.2348 -4.2318 -4.2318 -3.8599 -3.8599 -2.4241 -2.4241 -1.9929 -1.9929 -1.8793 -1.8793 -1.4867 -1.4867 -1.4829 -1.4829 -1.1311 -1.1311 -0.8363 -0.8363 -0.5449 -0.5449 -0.5388 -0.5388 -0.3938 -0.3938 -0.2905 -0.2905 -0.2460 -0.2460 -0.2408 -0.2408 0.5215 0.5215 0.5287 0.5287 0.7046 0.7046 9.0356 9.0356 9.0386 9.0386 9.4824 9.4824 9.7850 9.7850 10.2705 10.2705 10.4404 10.4404 k =-0.4318 0.3698 0.5365 ( 6562 PWs) bands (ev): -17.9518 -17.9518 -17.9513 -17.9513 -17.6798 -17.6798 -16.4253 -16.4253 -16.3784 -16.3784 -16.3742 -16.3742 -16.3668 -16.3668 -16.3564 -16.3564 -8.0799 -8.0799 -6.0764 -6.0764 -5.3533 -5.3533 -5.3500 -5.3500 -4.5884 -4.5884 -4.2464 -4.2464 -4.2436 -4.2435 -3.8753 -3.8753 -2.4117 -2.4117 -1.9848 -1.9848 -1.8712 -1.8712 -1.4782 -1.4782 -1.4746 -1.4746 -1.1689 -1.1689 -0.8460 -0.8460 -0.5435 -0.5435 -0.5374 -0.5374 -0.4020 -0.4020 -0.2951 -0.2951 -0.2359 -0.2359 -0.2311 -0.2311 0.5246 0.5246 0.5312 0.5312 0.7072 0.7072 9.0048 9.0048 9.0079 9.0079 9.4644 9.4644 9.7744 9.7744 10.2978 10.2978 10.4288 10.4288 k =-0.4394 0.3503 0.5365 ( 6562 PWs) bands (ev): -17.9607 -17.9607 -17.9602 -17.9602 -17.6732 -17.6732 -16.4255 -16.4255 -16.3776 -16.3776 -16.3735 -16.3735 -16.3617 -16.3617 -16.3450 -16.3450 -8.0984 -8.0984 -6.0949 -6.0949 -5.3257 -5.3257 -5.3224 -5.3224 -4.5893 -4.5893 -4.2575 -4.2575 -4.2549 -4.2549 -3.8895 -3.8895 -2.4001 -2.4001 -1.9806 -1.9806 -1.8568 -1.8568 -1.4703 -1.4703 -1.4669 -1.4669 -1.2084 -1.2084 -0.8533 -0.8533 -0.5423 -0.5423 -0.5363 -0.5363 -0.4094 -0.4094 -0.2991 -0.2991 -0.2267 -0.2266 -0.2222 -0.2222 0.5273 0.5273 0.5333 0.5334 0.7096 0.7096 8.9768 8.9768 8.9799 8.9799 9.4482 9.4482 9.7642 9.7642 10.3226 10.3226 10.4188 10.4189 k =-0.4470 0.3309 0.5365 ( 6546 PWs) bands (ev): -17.9686 -17.9686 -17.9680 -17.9680 -17.6674 -17.6674 -16.4258 -16.4258 -16.3770 -16.3770 -16.3730 -16.3730 -16.3578 -16.3578 -16.3338 -16.3338 -8.1148 -8.1148 -6.1114 -6.1114 -5.3005 -5.3005 -5.2973 -5.2973 -4.5899 -4.5899 -4.2681 -4.2681 -4.2656 -4.2656 -3.9025 -3.9025 -2.3896 -2.3896 -1.9798 -1.9798 -1.8371 -1.8371 -1.4632 -1.4632 -1.4600 -1.4600 -1.2487 -1.2487 -0.8589 -0.8589 -0.5415 -0.5415 -0.5354 -0.5354 -0.4161 -0.4161 -0.3026 -0.3026 -0.2182 -0.2182 -0.2143 -0.2143 0.5296 0.5296 0.5351 0.5351 0.7117 0.7117 8.9516 8.9516 8.9548 8.9548 9.4338 9.4338 9.7549 9.7549 10.3449 10.3449 10.4102 10.4102 k =-0.4545 0.3114 0.5365 ( 6518 PWs) bands (ev): -17.9755 -17.9755 -17.9749 -17.9749 -17.6624 -17.6624 -16.4261 -16.4261 -16.3765 -16.3765 -16.3725 -16.3725 -16.3546 -16.3546 -16.3238 -16.3238 -8.1291 -8.1291 -6.1259 -6.1259 -5.2780 -5.2780 -5.2748 -5.2748 -4.5903 -4.5903 -4.2779 -4.2779 -4.2755 -4.2755 -3.9140 -3.9140 -2.3801 -2.3801 -1.9811 -1.9811 -1.8134 -1.8134 -1.4569 -1.4569 -1.4540 -1.4539 -1.2891 -1.2891 -0.8631 -0.8631 -0.5408 -0.5408 -0.5348 -0.5348 -0.4220 -0.4220 -0.3056 -0.3056 -0.2108 -0.2108 -0.2073 -0.2073 0.5317 0.5317 0.5365 0.5365 0.7135 0.7135 8.9294 8.9294 8.9327 8.9327 9.4212 9.4212 9.7465 9.7465 10.3643 10.3643 10.4029 10.4029 k =-0.4621 0.2919 0.5365 ( 6554 PWs) bands (ev): -17.9813 -17.9813 -17.9807 -17.9807 -17.6581 -17.6581 -16.4263 -16.4263 -16.3761 -16.3761 -16.3721 -16.3721 -16.3519 -16.3519 -16.3151 -16.3151 -8.1412 -8.1412 -6.1383 -6.1383 -5.2585 -5.2585 -5.2553 -5.2553 -4.5904 -4.5904 -4.2866 -4.2866 -4.2845 -4.2845 -3.9241 -3.9241 -2.3719 -2.3719 -1.9834 -1.9834 -1.7872 -1.7872 -1.4515 -1.4515 -1.4488 -1.4488 -1.3288 -1.3288 -0.8662 -0.8662 -0.5404 -0.5404 -0.5344 -0.5344 -0.4270 -0.4270 -0.3081 -0.3081 -0.2043 -0.2043 -0.2014 -0.2014 0.5335 0.5335 0.5376 0.5376 0.7151 0.7151 8.9104 8.9104 8.9137 8.9137 9.4104 9.4104 9.7391 9.7391 10.3805 10.3805 10.3969 10.3969 k =-0.4697 0.2725 0.5365 ( 6554 PWs) bands (ev): -17.9861 -17.9861 -17.9855 -17.9855 -17.6547 -17.6547 -16.4266 -16.4266 -16.3758 -16.3758 -16.3718 -16.3718 -16.3497 -16.3497 -16.3080 -16.3080 -8.1512 -8.1512 -6.1485 -6.1485 -5.2420 -5.2420 -5.2389 -5.2389 -4.5905 -4.5905 -4.2941 -4.2941 -4.2922 -4.2922 -3.9325 -3.9325 -2.3650 -2.3650 -1.9861 -1.9861 -1.7598 -1.7598 -1.4470 -1.4470 -1.4445 -1.4445 -1.3668 -1.3668 -0.8685 -0.8685 -0.5400 -0.5400 -0.5341 -0.5341 -0.4312 -0.4312 -0.3101 -0.3101 -0.1989 -0.1989 -0.1966 -0.1966 0.5350 0.5350 0.5384 0.5385 0.7163 0.7163 8.8947 8.8947 8.8980 8.8980 9.4016 9.4016 9.7329 9.7329 10.3917 10.3917 10.3926 10.3926 k =-0.4773 0.2530 0.5365 ( 6562 PWs) bands (ev): -17.9898 -17.9898 -17.9892 -17.9892 -17.6520 -17.6520 -16.4267 -16.4267 -16.3755 -16.3755 -16.3715 -16.3715 -16.3479 -16.3479 -16.3023 -16.3023 -8.1590 -8.1590 -6.1565 -6.1565 -5.2290 -5.2290 -5.2259 -5.2259 -4.5905 -4.5905 -4.3002 -4.3002 -4.2984 -4.2984 -3.9391 -3.9391 -2.3595 -2.3595 -1.9886 -1.9886 -1.7328 -1.7328 -1.4434 -1.4434 -1.4412 -1.4412 -1.4018 -1.4018 -0.8702 -0.8702 -0.5398 -0.5398 -0.5339 -0.5339 -0.4344 -0.4344 -0.3116 -0.3116 -0.1947 -0.1947 -0.1929 -0.1929 0.5362 0.5362 0.5390 0.5390 0.7173 0.7173 8.8823 8.8823 8.8857 8.8857 9.3947 9.3947 9.7281 9.7281 10.3884 10.3884 10.3941 10.3941 k =-0.4848 0.2335 0.5365 ( 6574 PWs) bands (ev): -17.9925 -17.9925 -17.9919 -17.9919 -17.6501 -17.6501 -16.4269 -16.4269 -16.3753 -16.3753 -16.3713 -16.3713 -16.3467 -16.3467 -16.2983 -16.2983 -8.1646 -8.1646 -6.1622 -6.1622 -5.2196 -5.2196 -5.2164 -5.2164 -4.5904 -4.5904 -4.3046 -4.3046 -4.3031 -4.3030 -3.9439 -3.9439 -2.3555 -2.3555 -1.9906 -1.9906 -1.7087 -1.7087 -1.4411 -1.4410 -1.4395 -1.4395 -1.4307 -1.4307 -0.8713 -0.8713 -0.5397 -0.5397 -0.5338 -0.5338 -0.4368 -0.4368 -0.3127 -0.3127 -0.1915 -0.1915 -0.1903 -0.1903 0.5371 0.5371 0.5393 0.5393 0.7180 0.7180 8.8735 8.8735 8.8769 8.8769 9.3898 9.3898 9.7246 9.7246 10.3859 10.3859 10.3924 10.3924 k =-0.4924 0.2141 0.5365 ( 6550 PWs) bands (ev): -17.9941 -17.9941 -17.9935 -17.9935 -17.6489 -17.6489 -16.4270 -16.4270 -16.3752 -16.3752 -16.3712 -16.3712 -16.3459 -16.3459 -16.2959 -16.2959 -8.1679 -8.1679 -6.1657 -6.1657 -5.2138 -5.2138 -5.2107 -5.2107 -4.5904 -4.5904 -4.3074 -4.3074 -4.3059 -4.3059 -3.9468 -3.9468 -2.3530 -2.3530 -1.9918 -1.9918 -1.6910 -1.6910 -1.4536 -1.4536 -1.4392 -1.4392 -1.4365 -1.4365 -0.8719 -0.8719 -0.5396 -0.5396 -0.5337 -0.5337 -0.4382 -0.4382 -0.3134 -0.3134 -0.1895 -0.1895 -0.1889 -0.1889 0.5377 0.5377 0.5395 0.5395 0.7185 0.7185 8.8681 8.8681 8.8715 8.8715 9.3868 9.3868 9.7225 9.7225 10.3844 10.3844 10.3911 10.3911 k =-0.5000 0.1946 0.5365 ( 6542 PWs) bands (ev): -17.9946 -17.9946 -17.9940 -17.9940 -17.6485 -17.6485 -16.4270 -16.4270 -16.3751 -16.3751 -16.3712 -16.3712 -16.3457 -16.3457 -16.2951 -16.2951 -8.1691 -8.1691 -6.1668 -6.1668 -5.2119 -5.2119 -5.2088 -5.2088 -4.5904 -4.5904 -4.3083 -4.3083 -4.3068 -4.3068 -3.9478 -3.9478 -2.3522 -2.3522 -1.9923 -1.9923 -1.6843 -1.6843 -1.4613 -1.4613 -1.4387 -1.4387 -1.4362 -1.4362 -0.8721 -0.8721 -0.5395 -0.5395 -0.5337 -0.5337 -0.4387 -0.4387 -0.3136 -0.3136 -0.1886 -0.1886 -0.1886 -0.1886 0.5380 0.5380 0.5395 0.5395 0.7186 0.7186 8.8664 8.8664 8.8698 8.8698 9.3858 9.3858 9.7218 9.7218 10.3839 10.3839 10.3906 10.3906 k = 0.0000 0.0000 0.5365 ( 6542 PWs) bands (ev): -18.2292 -18.2292 -17.9991 -17.9991 -17.0087 -17.0087 -16.8098 -16.8098 -16.4060 -16.4060 -16.3841 -16.3841 -16.3213 -16.3213 -16.3205 -16.3205 -7.5412 -7.5412 -7.2002 -7.2002 -5.4411 -5.4411 -4.6041 -4.6041 -4.4344 -4.4344 -4.2923 -4.2923 -4.2815 -4.2815 -4.1517 -4.1517 -2.4185 -2.4185 -1.6667 -1.6667 -1.4366 -1.4366 -1.3525 -1.3525 -1.2737 -1.2737 -1.2193 -1.2193 -1.1879 -1.1879 -1.0011 -1.0011 -0.7330 -0.7330 -0.3825 -0.3825 -0.2669 -0.2669 -0.2131 -0.2131 -0.1860 -0.1860 0.5468 0.5468 0.5605 0.5605 0.6899 0.6899 7.9216 7.9216 8.3346 8.3346 9.7795 9.7795 10.1760 10.1760 10.4525 10.4525 10.6455 10.6455 k = 0.0076 0.0195 0.5365 ( 6554 PWs) bands (ev): -18.2289 -18.2289 -17.9986 -17.9986 -17.0092 -17.0092 -16.8100 -16.8100 -16.4060 -16.4060 -16.3841 -16.3841 -16.3216 -16.3214 -16.3208 -16.3207 -7.5406 -7.5406 -7.1992 -7.1991 -5.4425 -5.4424 -4.6069 -4.6066 -4.4340 -4.4335 -4.2919 -4.2915 -4.2795 -4.2794 -4.1513 -4.1513 -2.4187 -2.4185 -1.6676 -1.6676 -1.4395 -1.4394 -1.3539 -1.3526 -1.2735 -1.2732 -1.2201 -1.2198 -1.1884 -1.1875 -0.9989 -0.9975 -0.7329 -0.7321 -0.3827 -0.3823 -0.2668 -0.2664 -0.2127 -0.2123 -0.1862 -0.1861 0.5463 0.5468 0.5601 0.5608 0.6896 0.6898 7.9235 7.9235 8.3363 8.3363 9.7806 9.7806 10.1750 10.1759 10.4537 10.4545 10.6440 10.6454 k = 0.0152 0.0389 0.5365 ( 6550 PWs) bands (ev): -18.2278 -18.2278 -17.9970 -17.9970 -17.0107 -17.0106 -16.8108 -16.8108 -16.4060 -16.4060 -16.3842 -16.3842 -16.3222 -16.3220 -16.3217 -16.3215 -7.5387 -7.5387 -7.1962 -7.1961 -5.4466 -5.4464 -4.6146 -4.6141 -4.4325 -4.4317 -4.2903 -4.2895 -4.2736 -4.2732 -4.1501 -4.1500 -2.4192 -2.4189 -1.6703 -1.6702 -1.4478 -1.4475 -1.3568 -1.3543 -1.2724 -1.2718 -1.2221 -1.2216 -1.1888 -1.1871 -0.9909 -0.9884 -0.7318 -0.7302 -0.3828 -0.3820 -0.2661 -0.2653 -0.2113 -0.2105 -0.1864 -0.1863 0.5454 0.5463 0.5597 0.5611 0.6890 0.6892 7.9292 7.9293 8.3413 8.3414 9.7839 9.7840 10.1730 10.1746 10.4580 10.4597 10.6411 10.6438 k = 0.0227 0.0584 0.5365 ( 6558 PWs) bands (ev): -18.2259 -18.2259 -17.9943 -17.9943 -17.0132 -17.0131 -16.8121 -16.8121 -16.4061 -16.4061 -16.3844 -16.3843 -16.3234 -16.3231 -16.3230 -16.3227 -7.5355 -7.5355 -7.1913 -7.1912 -5.4533 -5.4530 -4.6266 -4.6260 -4.4303 -4.4292 -4.2877 -4.2866 -4.2639 -4.2633 -4.1479 -4.1478 -2.4201 -2.4195 -1.6746 -1.6745 -1.4610 -1.4605 -1.3611 -1.3574 -1.2706 -1.2699 -1.2248 -1.2241 -1.1893 -1.1871 -0.9781 -0.9747 -0.7297 -0.7274 -0.3827 -0.3815 -0.2648 -0.2637 -0.2087 -0.2075 -0.1867 -0.1865 0.5439 0.5454 0.5592 0.5613 0.6879 0.6883 7.9388 7.9388 8.3495 8.3497 9.7895 9.7896 10.1700 10.1724 10.4655 10.4679 10.6369 10.6407 k = 0.0303 0.0779 0.5365 ( 6562 PWs) bands (ev): -18.2234 -18.2234 -17.9906 -17.9905 -17.0167 -17.0165 -16.8139 -16.8139 -16.4062 -16.4062 -16.3847 -16.3846 -16.3253 -16.3249 -16.3245 -16.3241 -7.5310 -7.5310 -7.1844 -7.1842 -5.4626 -5.4622 -4.6418 -4.6412 -4.4278 -4.4265 -4.2843 -4.2827 -4.2511 -4.2503 -4.1448 -4.1447 -2.4212 -2.4205 -1.6806 -1.6804 -1.4784 -1.4778 -1.3666 -1.3621 -1.2682 -1.2675 -1.2279 -1.2271 -1.1899 -1.1873 -0.9614 -0.9573 -0.7267 -0.7237 -0.3826 -0.3811 -0.2631 -0.2617 -0.2050 -0.2036 -0.1868 -0.1866 0.5420 0.5439 0.5586 0.5615 0.6864 0.6869 7.9520 7.9521 8.3611 8.3613 9.7972 9.7973 10.1664 10.1694 10.4757 10.4788 10.6317 10.6366 k = 0.0379 0.0973 0.5365 ( 6560 PWs) bands (ev): -18.2202 -18.2202 -17.9858 -17.9857 -17.0211 -17.0209 -16.8163 -16.8162 -16.4063 -16.4063 -16.3851 -16.3849 -16.3278 -16.3273 -16.3263 -16.3257 -7.5254 -7.5254 -7.1756 -7.1754 -5.4744 -5.4738 -4.6595 -4.6589 -4.4252 -4.4238 -4.2801 -4.2782 -4.2358 -4.2347 -4.1407 -4.1405 -2.4225 -2.4217 -1.6880 -1.6877 -1.4992 -1.4984 -1.3732 -1.3680 -1.2653 -1.2648 -1.2311 -1.2302 -1.1907 -1.1878 -0.9419 -0.9372 -0.7229 -0.7191 -0.3825 -0.3805 -0.2612 -0.2594 -0.2003 -0.1989 -0.1865 -0.1864 0.5395 0.5420 0.5580 0.5616 0.6846 0.6851 7.9690 7.9692 8.3759 8.3761 9.8071 9.8072 10.1622 10.1658 10.4884 10.4921 10.6259 10.6315 k = 0.0455 0.1168 0.5365 ( 6570 PWs) bands (ev): -18.2163 -18.2163 -17.9800 -17.9799 -17.0266 -17.0264 -16.8191 -16.8190 -16.4064 -16.4064 -16.3855 -16.3854 -16.3307 -16.3301 -16.3283 -16.3276 -7.5186 -7.5186 -7.1649 -7.1646 -5.4885 -5.4879 -4.6789 -4.6784 -4.4226 -4.4212 -4.2755 -4.2732 -4.2185 -4.2171 -4.1354 -4.1352 -2.4242 -2.4232 -1.6966 -1.6962 -1.5227 -1.5218 -1.3809 -1.3753 -1.2622 -1.2619 -1.2342 -1.2333 -1.1917 -1.1885 -0.9204 -0.9154 -0.7182 -0.7138 -0.3822 -0.3799 -0.2592 -0.2572 -0.1946 -0.1939 -0.1857 -0.1848 0.5366 0.5396 0.5574 0.5615 0.6823 0.6829 7.9897 7.9898 8.3938 8.3941 9.8190 9.8192 10.1576 10.1617 10.5032 10.5075 10.6197 10.6259 k = 0.0530 0.1362 0.5365 ( 6566 PWs) bands (ev): -18.2117 -18.2117 -17.9731 -17.9730 -17.0331 -17.0328 -16.8225 -16.8224 -16.4066 -16.4066 -16.3860 -16.3859 -16.3341 -16.3334 -16.3306 -16.3298 -7.5107 -7.5107 -7.1523 -7.1519 -5.5049 -5.5042 -4.6995 -4.6992 -4.4202 -4.4187 -4.2706 -4.2680 -4.1997 -4.1982 -4.1289 -4.1287 -2.4261 -2.4249 -1.7062 -1.7057 -1.5482 -1.5471 -1.3896 -1.3836 -1.2590 -1.2589 -1.2372 -1.2364 -1.1928 -1.1895 -0.8977 -0.8925 -0.7127 -0.7077 -0.3820 -0.3793 -0.2574 -0.2553 -0.1897 -0.1886 -0.1833 -0.1804 0.5333 0.5367 0.5566 0.5613 0.6796 0.6803 8.0139 8.0141 8.4148 8.4152 9.8328 9.8331 10.1529 10.1573 10.5199 10.5247 10.6135 10.6201 k = 0.0606 0.1557 0.5365 ( 6582 PWs) bands (ev): -18.2065 -18.2065 -17.9652 -17.9651 -17.0405 -17.0403 -16.8265 -16.8263 -16.4068 -16.4068 -16.3867 -16.3866 -16.3379 -16.3371 -16.3331 -16.3321 -7.5018 -7.5017 -7.1379 -7.1375 -5.5234 -5.5226 -4.7209 -4.7208 -4.4178 -4.4164 -4.2657 -4.2627 -4.1800 -4.1782 -4.1210 -4.1208 -2.4282 -2.4269 -1.7168 -1.7160 -1.5752 -1.5739 -1.3992 -1.3928 -1.2562 -1.2557 -1.2401 -1.2393 -1.1940 -1.1906 -0.8743 -0.8690 -0.7066 -0.7011 -0.3818 -0.3787 -0.2562 -0.2541 -0.1862 -0.1842 -0.1773 -0.1732 0.5294 0.5334 0.5557 0.5610 0.6764 0.6772 8.0416 8.0418 8.4389 8.4392 9.8485 9.8489 10.1481 10.1528 10.5381 10.5433 10.6074 10.6142 k = 0.0682 0.1752 0.5365 ( 6582 PWs) bands (ev): -18.2007 -18.2007 -17.9562 -17.9561 -17.0490 -17.0488 -16.8309 -16.8308 -16.4070 -16.4070 -16.3874 -16.3873 -16.3420 -16.3411 -16.3358 -16.3346 -7.4918 -7.4918 -7.1216 -7.1212 -5.5440 -5.5431 -4.7429 -4.7429 -4.4155 -4.4141 -4.2610 -4.2576 -4.1596 -4.1577 -4.1118 -4.1116 -2.4305 -2.4291 -1.7280 -1.7271 -1.6031 -1.6017 -1.4095 -1.4030 -1.2537 -1.2527 -1.2427 -1.2421 -1.1953 -1.1917 -0.8508 -0.8454 -0.6998 -0.6939 -0.3816 -0.3782 -0.2556 -0.2536 -0.1821 -0.1802 -0.1685 -0.1641 0.5251 0.5295 0.5547 0.5605 0.6729 0.6737 8.0726 8.0729 8.4658 8.4662 9.8660 9.8665 10.1432 10.1481 10.5574 10.5632 10.6019 10.6085 k = 0.0758 0.1946 0.5365 ( 6580 PWs) bands (ev): -18.1943 -18.1943 -17.9463 -17.9462 -17.0586 -17.0582 -16.8359 -16.8357 -16.4073 -16.4073 -16.3882 -16.3882 -16.3463 -16.3454 -16.3386 -16.3373 -7.4810 -7.4810 -7.1037 -7.1032 -5.5663 -5.5654 -4.7653 -4.7651 -4.4133 -4.4119 -4.2566 -4.2529 -4.1389 -4.1368 -4.1013 -4.1011 -2.4331 -2.4314 -1.7397 -1.7386 -1.6316 -1.6302 -1.4204 -1.4139 -1.2515 -1.2500 -1.2451 -1.2447 -1.1967 -1.1929 -0.8275 -0.8221 -0.6926 -0.6862 -0.3816 -0.3778 -0.2557 -0.2541 -0.1768 -0.1752 -0.1582 -0.1537 0.5204 0.5253 0.5534 0.5597 0.6690 0.6698 8.1069 8.1072 8.4956 8.4961 9.8851 9.8857 10.1382 10.1432 10.5772 10.5839 10.5974 10.6032 k = 0.0833 0.2141 0.5365 ( 6588 PWs) bands (ev): -18.1874 -18.1874 -17.9354 -17.9353 -17.0691 -17.0688 -16.8414 -16.8412 -16.4076 -16.4075 -16.3893 -16.3892 -16.3509 -16.3499 -16.3414 -16.3399 -7.4695 -7.4693 -7.0840 -7.0835 -5.5904 -5.5894 -4.7878 -4.7874 -4.4110 -4.4096 -4.2526 -4.2486 -4.1181 -4.1158 -4.0896 -4.0893 -2.4357 -2.4340 -1.7518 -1.7504 -1.6605 -1.6589 -1.4320 -1.4254 -1.2505 -1.2490 -1.2466 -1.2458 -1.1981 -1.1942 -0.8046 -0.7993 -0.6849 -0.6783 -0.3819 -0.3777 -0.2565 -0.2553 -0.1702 -0.1689 -0.1467 -0.1422 0.5153 0.5206 0.5520 0.5587 0.6646 0.6654 8.1444 8.1447 8.5281 8.5286 9.9055 9.9064 10.1330 10.1381 10.5887 10.5978 10.6024 10.6059 k = 0.0909 0.2336 0.5365 ( 6602 PWs) bands (ev): -18.1800 -18.1800 -17.9235 -17.9234 -17.0806 -17.0803 -16.8474 -16.8472 -16.4079 -16.4078 -16.3904 -16.3903 -16.3555 -16.3545 -16.3442 -16.3425 -7.4572 -7.4570 -7.0627 -7.0622 -5.6161 -5.6151 -4.8102 -4.8095 -4.4087 -4.4074 -4.2490 -4.2447 -4.0974 -4.0949 -4.0768 -4.0764 -2.4386 -2.4367 -1.7641 -1.7624 -1.6893 -1.6877 -1.4440 -1.4375 -1.2517 -1.2508 -1.2461 -1.2443 -1.1995 -1.1954 -0.7826 -0.7773 -0.6770 -0.6700 -0.3825 -0.3780 -0.2579 -0.2573 -0.1623 -0.1613 -0.1341 -0.1297 0.5097 0.5155 0.5503 0.5575 0.6598 0.6606 8.1848 8.1851 8.5631 8.5636 9.9272 9.9283 10.1276 10.1327 10.5861 10.5933 10.6227 10.6278 k = 0.0985 0.2530 0.5365 ( 6604 PWs) bands (ev): -18.1722 -18.1722 -17.9107 -17.9105 -17.0932 -17.0929 -16.8539 -16.8537 -16.4083 -16.4082 -16.3918 -16.3915 -16.3603 -16.3591 -16.3470 -16.3451 -7.4443 -7.4441 -7.0399 -7.0394 -5.6432 -5.6422 -4.8324 -4.8315 -4.4065 -4.4051 -4.2459 -4.2413 -4.0770 -4.0743 -4.0630 -4.0625 -2.4415 -2.4394 -1.7764 -1.7745 -1.7180 -1.7164 -1.4563 -1.4499 -1.2538 -1.2532 -1.2450 -1.2426 -1.2009 -1.1965 -0.7614 -0.7563 -0.6687 -0.6615 -0.3835 -0.3787 -0.2597 -0.2596 -0.1533 -0.1526 -0.1205 -0.1161 0.5038 0.5100 0.5484 0.5559 0.6547 0.6553 8.2280 8.2284 8.6005 8.6011 9.9498 9.9511 10.1217 10.1269 10.5826 10.5888 10.6446 10.6502 k = 0.1061 0.2725 0.5365 ( 6600 PWs) bands (ev): -18.1640 -18.1639 -17.8969 -17.8968 -17.1068 -17.1064 -16.8609 -16.8606 -16.4087 -16.4086 -16.3932 -16.3929 -16.3650 -16.3638 -16.3496 -16.3476 -7.4309 -7.4306 -7.0156 -7.0150 -5.6718 -5.6707 -4.8543 -4.8531 -4.4042 -4.4028 -4.2431 -4.2384 -4.0570 -4.0541 -4.0484 -4.0479 -2.4445 -2.4423 -1.7887 -1.7864 -1.7462 -1.7446 -1.4689 -1.4627 -1.2559 -1.2554 -1.2441 -1.2411 -1.2021 -1.1975 -0.7414 -0.7364 -0.6602 -0.6528 -0.3850 -0.3799 -0.2621 -0.2616 -0.1434 -0.1430 -0.1057 -0.1015 0.4975 0.5041 0.5462 0.5540 0.6491 0.6497 8.2738 8.2743 8.6402 8.6408 9.9730 9.9748 10.1153 10.1203 10.5791 10.5840 10.6670 10.6728 k = 0.1136 0.2919 0.5365 ( 6592 PWs) bands (ev): -18.1554 -18.1554 -17.8823 -17.8821 -17.1213 -17.1210 -16.8683 -16.8680 -16.4091 -16.4090 -16.3948 -16.3943 -16.3697 -16.3685 -16.3521 -16.3499 -7.4171 -7.4168 -6.9898 -6.9893 -5.7015 -5.7005 -4.8757 -4.8743 -4.4019 -4.4006 -4.2408 -4.2358 -4.0375 -4.0345 -4.0332 -4.0326 -2.4475 -2.4452 -1.8010 -1.7982 -1.7738 -1.7723 -1.4817 -1.4756 -1.2580 -1.2576 -1.2434 -1.2400 -1.2032 -1.1984 -0.7226 -0.7178 -0.6517 -0.6441 -0.3871 -0.3818 -0.2645 -0.2636 -0.1327 -0.1325 -0.0900 -0.0860 0.4908 0.4979 0.5437 0.5519 0.6432 0.6437 8.3221 8.3226 8.6820 8.6826 9.9965 9.9987 10.1080 10.1129 10.5751 10.5784 10.6893 10.6953 k = 0.1212 0.3114 0.5365 ( 6606 PWs) bands (ev): -18.1466 -18.1466 -17.8668 -17.8666 -17.1368 -17.1365 -16.8761 -16.8757 -16.4096 -16.4094 -16.3966 -16.3959 -16.3742 -16.3730 -16.3545 -16.3521 -7.4031 -7.4027 -6.9626 -6.9621 -5.7325 -5.7314 -4.8965 -4.8949 -4.3995 -4.3982 -4.2387 -4.2336 -4.0188 -4.0175 -4.0171 -4.0153 -2.4506 -2.4481 -1.8134 -1.8098 -1.8002 -1.7992 -1.4945 -1.4886 -1.2600 -1.2597 -1.2430 -1.2391 -1.2042 -1.1991 -0.7051 -0.7006 -0.6430 -0.6353 -0.3899 -0.3845 -0.2667 -0.2653 -0.1214 -0.1214 -0.0732 -0.0696 0.4837 0.4912 0.5409 0.5494 0.6370 0.6373 8.3726 8.3732 8.7257 8.7264 10.0198 10.0225 10.0996 10.1043 10.5700 10.5709 10.7044 10.7082 k = 0.1288 0.3309 0.5365 ( 6590 PWs) bands (ev): -18.1376 -18.1375 -17.8504 -17.8502 -17.1532 -17.1529 -16.8841 -16.8838 -16.4102 -16.4099 -16.3984 -16.3976 -16.3786 -16.3774 -16.3567 -16.3540 -7.3889 -7.3885 -6.9342 -6.9337 -5.7644 -5.7634 -4.9167 -4.9149 -4.3972 -4.3959 -4.2370 -4.2317 -4.0022 -4.0013 -4.0002 -3.9970 -2.4536 -2.4510 -1.8302 -1.8263 -1.8211 -1.8201 -1.5073 -1.5016 -1.2618 -1.2616 -1.2428 -1.2386 -1.2050 -1.1996 -0.6891 -0.6848 -0.6343 -0.6266 -0.3934 -0.3880 -0.2685 -0.2668 -0.1098 -0.1096 -0.0556 -0.0523 0.4763 0.4841 0.5379 0.5466 0.6305 0.6306 8.4252 8.4258 8.7712 8.7719 10.0422 10.0455 10.0899 10.0943 10.5605 10.5628 10.6892 10.6934 k = 0.1364 0.3503 0.5365 ( 6598 PWs) bands (ev): -18.1285 -18.1284 -17.8332 -17.8330 -17.1706 -17.1703 -16.8925 -16.8921 -16.4108 -16.4105 -16.4003 -16.3994 -16.3827 -16.3815 -16.3586 -16.3558 -7.3748 -7.3743 -6.9046 -6.9041 -5.7974 -5.7964 -4.9362 -4.9341 -4.3949 -4.3936 -4.2354 -4.2300 -3.9865 -3.9855 -3.9829 -3.9796 -2.4565 -2.4539 -1.8541 -1.8513 -1.8335 -1.8310 -1.5200 -1.5145 -1.2635 -1.2634 -1.2429 -1.2383 -1.2056 -1.1999 -0.6745 -0.6704 -0.6257 -0.6179 -0.3976 -0.3923 -0.2699 -0.2679 -0.0979 -0.0976 -0.0371 -0.0343 0.4685 0.4767 0.5346 0.5435 0.6236 0.6237 8.4795 8.4802 8.8182 8.8189 10.0628 10.0667 10.0789 10.0829 10.5467 10.5525 10.6792 10.6805 k = 0.1439 0.3698 0.5365 ( 6600 PWs) bands (ev): -18.1193 -18.1192 -17.8152 -17.8151 -17.1888 -17.1885 -16.9010 -16.9005 -16.4116 -16.4112 -16.4023 -16.4013 -16.3866 -16.3854 -16.3604 -16.3573 -7.3607 -7.3602 -6.8738 -6.8733 -5.8312 -5.8302 -4.9549 -4.9526 -4.3926 -4.3913 -4.2341 -4.2285 -3.9710 -3.9699 -3.9664 -3.9630 -2.4594 -2.4566 -1.8781 -1.8755 -1.8442 -1.8411 -1.5324 -1.5272 -1.2650 -1.2650 -1.2432 -1.2382 -1.2060 -1.2000 -0.6614 -0.6576 -0.6172 -0.6094 -0.4025 -0.3973 -0.2709 -0.2687 -0.0858 -0.0853 -0.0178 -0.0155 0.4603 0.4687 0.5311 0.5401 0.6164 0.6167 8.5353 8.5361 8.8665 8.8673 10.0651 10.0684 10.0820 10.0862 10.5305 10.5394 10.6731 10.6742 k = 0.1515 0.3893 0.5365 ( 6588 PWs) bands (ev): -18.1102 -18.1101 -17.7965 -17.7964 -17.2078 -17.2076 -16.9096 -16.9091 -16.4124 -16.4119 -16.4043 -16.4031 -16.3900 -16.3889 -16.3619 -16.3587 -7.3469 -7.3463 -6.8420 -6.8415 -5.8658 -5.8648 -4.9727 -4.9702 -4.3903 -4.3891 -4.2330 -4.2272 -3.9558 -3.9546 -3.9508 -3.9473 -2.4621 -2.4592 -1.9011 -1.8986 -1.8541 -1.8506 -1.5445 -1.5396 -1.2665 -1.2664 -1.2436 -1.2383 -1.2062 -1.2000 -0.6497 -0.6462 -0.6087 -0.6009 -0.4080 -0.4031 -0.2715 -0.2691 -0.0736 -0.0730 0.0022 0.0039 0.4517 0.4604 0.5273 0.5365 0.6090 0.6096 8.5923 8.5932 8.9160 8.9168 10.0500 10.0532 10.0958 10.1009 10.5139 10.5250 10.6707 10.6736 k = 0.1591 0.4087 0.5365 ( 6612 PWs) bands (ev): -18.1012 -18.1011 -17.7771 -17.7769 -17.2276 -17.2274 -16.9182 -16.9177 -16.4134 -16.4128 -16.4063 -16.4050 -16.3931 -16.3921 -16.3633 -16.3600 -7.3335 -7.3328 -6.8092 -6.8087 -5.9011 -5.9002 -4.9896 -4.9868 -4.3881 -4.3869 -4.2320 -4.2261 -3.9411 -3.9398 -3.9363 -3.9327 -2.4647 -2.4617 -1.9230 -1.9205 -1.8633 -1.8595 -1.5562 -1.5515 -1.2678 -1.2677 -1.2441 -1.2384 -1.2062 -1.1997 -0.6394 -0.6362 -0.6004 -0.5926 -0.4141 -0.4095 -0.2717 -0.2692 -0.0615 -0.0608 0.0227 0.0238 0.4427 0.4515 0.5233 0.5327 0.6016 0.6025 8.6503 8.6512 8.9663 8.9672 10.0325 10.0353 10.1044 10.1100 10.4996 10.5120 10.6723 10.6762 k = 0.1667 0.4282 0.5365 ( 6600 PWs) bands (ev): -18.0924 -18.0923 -17.7570 -17.7569 -17.2481 -17.2479 -16.9267 -16.9262 -16.4145 -16.4138 -16.4082 -16.4068 -16.3957 -16.3948 -16.3645 -16.3610 -7.3206 -7.3198 -6.7755 -6.7751 -5.9371 -5.9362 -5.0054 -5.0024 -4.3860 -4.3847 -4.2312 -4.2252 -3.9271 -3.9257 -3.9228 -3.9191 -2.4670 -2.4640 -1.9435 -1.9411 -1.8718 -1.8677 -1.5673 -1.5630 -1.2689 -1.2687 -1.2447 -1.2387 -1.2060 -1.1992 -0.6305 -0.6275 -0.5922 -0.5845 -0.4206 -0.4164 -0.2715 -0.2691 -0.0496 -0.0488 0.0438 0.0442 0.4332 0.4421 0.5193 0.5288 0.5943 0.5954 8.7088 8.7098 9.0173 9.0183 10.0127 10.0151 10.1060 10.1118 10.4901 10.5028 10.6769 10.6812 k = 0.1742 0.4476 0.5365 ( 6588 PWs) bands (ev): -18.0840 -18.0838 -17.7363 -17.7361 -17.2693 -17.2691 -16.9350 -16.9344 -16.4158 -16.4148 -16.4100 -16.4086 -16.3979 -16.3972 -16.3655 -16.3619 -7.3083 -7.3075 -6.7409 -6.7406 -5.9736 -5.9728 -5.0201 -5.0169 -4.3840 -4.3827 -4.2304 -4.2243 -3.9138 -3.9123 -3.9103 -3.9065 -2.4692 -2.4661 -1.9627 -1.9602 -1.8796 -1.8752 -1.5779 -1.5738 -1.2700 -1.2697 -1.2453 -1.2390 -1.2057 -1.1986 -0.6228 -0.6200 -0.5841 -0.5765 -0.4275 -0.4238 -0.2712 -0.2688 -0.0380 -0.0372 0.0648 0.0651 0.4231 0.4320 0.5152 0.5248 0.5871 0.5885 8.7675 8.7685 9.0687 9.0698 9.9906 9.9925 10.0995 10.1051 10.4870 10.4993 10.6834 10.6877 k = 0.1818 0.4671 0.5365 ( 6590 PWs) bands (ev): -18.0759 -18.0758 -17.7150 -17.7149 -17.2911 -17.2909 -16.9430 -16.9424 -16.4171 -16.4160 -16.4117 -16.4103 -16.3997 -16.3991 -16.3664 -16.3627 -7.2968 -7.2959 -6.7057 -6.7054 -6.0106 -6.0099 -5.0337 -5.0303 -4.3820 -4.3808 -4.2298 -4.2235 -3.9014 -3.8999 -3.8990 -3.8952 -2.4712 -2.4680 -1.9803 -1.9778 -1.8866 -1.8819 -1.5877 -1.5839 -1.2708 -1.2705 -1.2460 -1.2394 -1.2052 -1.1979 -0.6163 -0.6137 -0.5762 -0.5687 -0.4347 -0.4314 -0.2707 -0.2683 -0.0270 -0.0261 0.0857 0.0867 0.4125 0.4213 0.5111 0.5208 0.5802 0.5818 8.8259 8.8270 9.1202 9.1213 9.9662 9.9677 10.0849 10.0899 10.4909 10.5021 10.6912 10.6952 k = 0.1894 0.4866 0.5365 ( 6598 PWs) bands (ev): -18.0684 -18.0683 -17.6932 -17.6930 -17.3134 -17.3133 -16.9506 -16.9499 -16.4184 -16.4173 -16.4133 -16.4119 -16.4011 -16.4007 -16.3672 -16.3634 -7.2861 -7.2851 -6.6698 -6.6695 -6.0481 -6.0473 -5.0460 -5.0425 -4.3803 -4.3790 -4.2292 -4.2229 -3.8901 -3.8889 -3.8884 -3.8849 -2.4729 -2.4696 -1.9963 -1.9938 -1.8929 -1.8880 -1.5968 -1.5933 -1.2716 -1.2711 -1.2466 -1.2397 -1.2047 -1.1970 -0.6108 -0.6085 -0.5684 -0.5611 -0.4420 -0.4393 -0.2700 -0.2677 -0.0165 -0.0157 0.1065 0.1084 0.4013 0.4099 0.5070 0.5168 0.5737 0.5755 8.8834 8.8846 9.1713 9.1725 9.9398 9.9409 10.0630 10.0673 10.5009 10.5105 10.6997 10.7031 k = 0.1970 0.5060 0.5365 ( 6598 PWs) bands (ev): -18.0615 -18.0613 -17.6709 -17.6707 -17.3362 -17.3361 -16.9575 -16.9568 -16.4198 -16.4185 -16.4148 -16.4133 -16.4022 -16.4019 -16.3678 -16.3640 -7.2764 -7.2754 -6.6333 -6.6331 -6.0858 -6.0852 -5.0571 -5.0533 -4.3786 -4.3774 -4.2287 -4.2223 -3.8800 -3.8796 -3.8781 -3.8758 -2.4744 -2.4711 -2.0106 -2.0081 -1.8985 -1.8933 -1.6051 -1.6018 -1.2722 -1.2717 -1.2471 -1.2401 -1.2040 -1.1962 -0.6063 -0.6042 -0.5608 -0.5536 -0.4495 -0.4472 -0.2694 -0.2671 -0.0069 -0.0060 0.1273 0.1300 0.3895 0.3978 0.5032 0.5131 0.5677 0.5696 8.9394 8.9407 9.2217 9.2230 9.9117 9.9124 10.0354 10.0389 10.5155 10.5234 10.7084 10.7110 k = 0.2045 0.5255 0.5365 ( 6594 PWs) bands (ev): -18.0553 -18.0551 -17.6481 -17.6480 -17.3594 -17.3594 -16.9639 -16.9631 -16.4210 -16.4197 -16.4160 -16.4146 -16.4031 -16.4029 -16.3683 -16.3645 -7.2678 -7.2667 -6.5964 -6.5963 -6.1238 -6.1232 -5.0667 -5.0629 -4.3772 -4.3759 -4.2283 -4.2219 -3.8721 -3.8706 -3.8691 -3.8678 -2.4757 -2.4723 -2.0232 -2.0207 -1.9033 -1.8979 -1.6124 -1.6093 -1.2727 -1.2722 -1.2477 -1.2404 -1.2034 -1.1953 -0.6027 -0.6008 -0.5532 -0.5462 -0.4570 -0.4552 -0.2687 -0.2665 0.0018 0.0028 0.1479 0.1514 0.3770 0.3850 0.4996 0.5095 0.5623 0.5644 8.9932 8.9944 9.2708 9.2722 9.8827 9.8830 10.0039 10.0068 10.5331 10.5390 10.7168 10.7183 k = 0.2121 0.5450 0.5365 ( 6594 PWs) bands (ev): -18.0498 -18.0497 -17.6250 -17.6248 -17.3830 -17.3829 -16.9694 -16.9686 -16.4222 -16.4208 -16.4171 -16.4157 -16.4037 -16.4036 -16.3688 -16.3649 -7.2604 -7.2592 -6.5593 -6.5592 -6.1618 -6.1613 -5.0750 -5.0710 -4.3759 -4.3747 -4.2280 -4.2215 -3.8655 -3.8628 -3.8617 -3.8606 -2.4768 -2.4733 -2.0340 -2.0315 -1.9074 -1.9017 -1.6187 -1.6158 -1.2732 -1.2725 -1.2481 -1.2407 -1.2028 -1.1945 -0.5998 -0.5980 -0.5458 -0.5389 -0.4646 -0.4632 -0.2681 -0.2659 0.0094 0.0104 0.1679 0.1724 0.3641 0.3715 0.4963 0.5064 0.5576 0.5597 9.0436 9.0448 9.3178 9.3194 9.8534 9.8534 9.9704 9.9728 10.5519 10.5559 10.7245 10.7247 k = 0.2197 0.5644 0.5365 ( 6570 PWs) bands (ev): -18.0453 -18.0451 -17.6015 -17.6014 -17.4068 -17.4067 -16.9741 -16.9733 -16.4232 -16.4217 -16.4180 -16.4166 -16.4042 -16.4042 -16.3691 -16.3652 -7.2541 -7.2529 -6.5220 -6.5220 -6.1998 -6.1994 -5.0819 -5.0778 -4.3749 -4.3736 -4.2277 -4.2212 -3.8600 -3.8563 -3.8561 -3.8542 -2.4776 -2.4741 -2.0429 -2.0404 -1.9107 -1.9049 -1.6240 -1.6213 -1.2735 -1.2728 -1.2485 -1.2409 -1.2022 -1.1937 -0.5976 -0.5959 -0.5386 -0.5318 -0.4720 -0.4709 -0.2675 -0.2654 0.0159 0.0169 0.1872 0.1927 0.3508 0.3574 0.4936 0.5036 0.5536 0.5559 9.0892 9.0905 9.3616 9.3634 9.8250 9.8253 9.9367 9.9388 10.5706 10.5726 10.7298 10.7311 k = 0.2273 0.5839 0.5365 ( 6572 PWs) bands (ev): -18.0417 -18.0415 -17.5779 -17.5778 -17.4307 -17.4307 -16.9778 -16.9770 -16.4239 -16.4224 -16.4188 -16.4173 -16.4046 -16.4046 -16.3694 -16.3654 -7.2492 -7.2480 -6.4851 -6.4849 -6.2373 -6.2370 -5.0872 -5.0831 -4.3740 -4.3728 -4.2275 -4.2209 -3.8558 -3.8518 -3.8512 -3.8491 -2.4783 -2.4747 -2.0499 -2.0473 -1.9133 -1.9073 -1.6281 -1.6256 -1.2737 -1.2730 -1.2488 -1.2411 -1.2017 -1.1931 -0.5960 -0.5944 -0.5316 -0.5247 -0.4794 -0.4784 -0.2670 -0.2650 0.0210 0.0221 0.2053 0.2119 0.3375 0.3432 0.4913 0.5014 0.5505 0.5528 9.1284 9.1297 9.4006 9.4025 9.7992 9.7998 9.9050 9.9070 10.5875 10.5876 10.7333 10.7363 k = 0.2348 0.6034 0.5365 ( 6576 PWs) bands (ev): -18.0390 -18.0388 -17.5542 -17.5541 -17.4546 -17.4546 -16.9805 -16.9797 -16.4245 -16.4230 -16.4193 -16.4178 -16.4049 -16.4048 -16.3696 -16.3656 -7.2457 -7.2444 -6.4492 -6.4490 -6.2736 -6.2734 -5.0911 -5.0869 -4.3734 -4.3722 -4.2273 -4.2207 -3.8528 -3.8488 -3.8475 -3.8454 -2.4787 -2.4752 -2.0549 -2.0524 -1.9151 -1.9090 -1.6311 -1.6287 -1.2739 -1.2731 -1.2490 -1.2412 -1.2013 -1.1926 -0.5949 -0.5934 -0.5251 -0.5178 -0.4865 -0.4853 -0.2667 -0.2647 0.0248 0.0258 0.2212 0.2292 0.3250 0.3295 0.4896 0.4998 0.5482 0.5505 9.1589 9.1602 9.4323 9.4344 9.7783 9.7791 9.8783 9.8802 10.5996 10.6013 10.7355 10.7401 k = 0.2424 0.6228 0.5365 ( 6568 PWs) bands (ev): -18.0374 -18.0372 -17.5310 -17.5309 -17.4780 -17.4779 -16.9822 -16.9814 -16.4249 -16.4233 -16.4196 -16.4181 -16.4050 -16.4050 -16.3697 -16.3657 -7.2436 -7.2423 -6.4174 -6.4170 -6.3057 -6.3056 -5.0934 -5.0891 -4.3730 -4.3718 -4.2272 -4.2206 -3.8510 -3.8469 -3.8453 -3.8432 -2.4790 -2.4754 -2.0580 -2.0554 -1.9162 -1.9100 -1.6329 -1.6305 -1.2740 -1.2732 -1.2491 -1.2413 -1.2011 -1.1923 -0.5943 -0.5928 -0.5199 -0.5114 -0.4931 -0.4908 -0.2665 -0.2645 0.0271 0.0281 0.2332 0.2426 0.3151 0.3182 0.4886 0.4987 0.5468 0.5492 9.1786 9.1799 9.4534 9.4557 9.7645 9.7654 9.8600 9.8619 10.6075 10.6103 10.7365 10.7423 k = 0.2500 0.6423 0.5365 ( 6568 PWs) bands (ev): -18.0369 -18.0367 -17.5150 -17.5148 -17.4940 -17.4940 -16.9827 -16.9819 -16.4250 -16.4234 -16.4197 -16.4182 -16.4051 -16.4050 -16.3698 -16.3657 -7.2428 -7.2416 -6.4013 -6.4008 -6.3219 -6.3218 -5.0942 -5.0899 -4.3729 -4.3717 -4.2272 -4.2206 -3.8504 -3.8463 -3.8445 -3.8424 -2.4791 -2.4755 -2.0590 -2.0564 -1.9165 -1.9104 -1.6335 -1.6312 -1.2741 -1.2733 -1.2492 -1.2413 -1.2010 -1.1922 -0.5941 -0.5926 -0.5176 -0.5078 -0.4967 -0.4931 -0.2664 -0.2644 0.0278 0.0289 0.2380 0.2482 0.3110 0.3134 0.4882 0.4984 0.5464 0.5487 9.1854 9.1867 9.4610 9.4633 9.7597 9.7605 9.8534 9.8553 10.6102 10.6135 10.7367 10.7430 Writing output data file SiO2.save init_run : 2.23s CPU 9.58s WALL ( 1 calls) electrons : 2752.60s CPU 2774.64s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.45s CPU 1.57s WALL ( 1 calls) Called by electrons: c_bands : 2752.56s CPU 2774.25s WALL ( 1 calls) v_of_rho : 0.05s CPU 0.93s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.05s CPU 0.64s WALL ( 1 calls) newd : 0.35s CPU 0.47s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.10s WALL ( 265 calls) cegterg : 2685.26s CPU 2703.87s WALL ( 1456 calls) Called by sum_band: Called by *egterg: h_psi : 1005.21s CPU 1021.40s WALL ( 29804 calls) s_psi : 57.31s CPU 59.22s WALL ( 29804 calls) g_psi : 2.11s CPU 2.08s WALL ( 28083 calls) cdiaghg : 1266.80s CPU 1261.51s WALL ( 28348 calls) cegterg:over : 179.94s CPU 171.54s WALL ( 28083 calls) cegterg:upda : 64.98s CPU 72.36s WALL ( 28083 calls) cegterg:last : 37.87s CPU 38.80s WALL ( 2722 calls) Called by h_psi: h_psi:vloc : 848.56s CPU 863.69s WALL ( 29804 calls) h_psi:vnl : 155.39s CPU 155.46s WALL ( 29804 calls) add_vuspsi : 45.89s CPU 54.35s WALL ( 29804 calls) General routines calbec : 109.41s CPU 100.87s WALL ( 29804 calls) fft : 0.69s CPU 1.46s WALL ( 19 calls) ffts : 0.04s CPU 0.04s WALL ( 4 calls) fftw : 796.08s CPU 805.78s WALL ( 2384728 calls) interpolate : 0.15s CPU 0.15s WALL ( 4 calls) davcio : 0.03s CPU 2.08s WALL ( 530 calls) Parallel routines fft_scatter : 390.31s CPU 393.15s WALL ( 2384751 calls) PWSCF : 47m 2.56s CPU 49m24.50s WALL This run was terminated on: 8: 6:10 20Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=