Program PWSCF v.5.1.1 starts on 20Jul2015 at 0:39:59 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: ./Al2O3.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 18 10 3 926 402 67 Max 19 11 4 931 421 76 Sum 875 507 155 44575 19717 3439 bravais-lattice index = 14 lattice parameter (alat) = 5.2714 a.u. unit-cell volume = 453.0194 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 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)= 5.271391 celldm(2)= 1.219179 celldm(3)= 2.536727 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.219179 0.000000 ) a(3) = ( 0.000000 0.000000 2.536727 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.820224 -0.000000 ) b(3) = ( 0.000000 0.000000 0.394209 ) 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 Al read from file: /home/autes/Pseudo/Al.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: d18dd1d035d87b93e5ebab176be81bd5 Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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) Al 3.00 26.98150 Al( 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= 397 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0025189 k( 2) = ( 0.4912281 -0.0000000 -0.0000000), wk = 0.0025189 k( 3) = ( 0.4824561 -0.0000000 -0.0000000), wk = 0.0025189 k( 4) = ( 0.4736842 -0.0000000 -0.0000000), wk = 0.0025189 k( 5) = ( 0.4649123 -0.0000000 -0.0000000), wk = 0.0025189 k( 6) = ( 0.4561404 -0.0000000 -0.0000000), wk = 0.0025189 k( 7) = ( 0.4473684 -0.0000000 -0.0000000), wk = 0.0025189 k( 8) = ( 0.4385965 -0.0000000 -0.0000000), wk = 0.0025189 k( 9) = ( 0.4298246 -0.0000000 -0.0000000), wk = 0.0025189 k( 10) = ( 0.4210526 -0.0000000 -0.0000000), wk = 0.0025189 k( 11) = ( 0.4122807 -0.0000000 -0.0000000), wk = 0.0025189 k( 12) = ( 0.4035088 -0.0000000 -0.0000000), wk = 0.0025189 k( 13) = ( 0.3947368 -0.0000000 -0.0000000), wk = 0.0025189 k( 14) = ( 0.3859649 -0.0000000 -0.0000000), wk = 0.0025189 k( 15) = ( 0.3771930 -0.0000000 -0.0000000), wk = 0.0025189 k( 16) = ( 0.3684211 -0.0000000 -0.0000000), wk = 0.0025189 k( 17) = ( 0.3596491 -0.0000000 -0.0000000), wk = 0.0025189 k( 18) = ( 0.3508772 -0.0000000 -0.0000000), wk = 0.0025189 k( 19) = ( 0.3421053 -0.0000000 -0.0000000), wk = 0.0025189 k( 20) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0025189 k( 21) = ( 0.3245614 -0.0000000 -0.0000000), wk = 0.0025189 k( 22) = ( 0.3157895 -0.0000000 -0.0000000), wk = 0.0025189 k( 23) = ( 0.3070175 -0.0000000 -0.0000000), wk = 0.0025189 k( 24) = ( 0.2982456 -0.0000000 -0.0000000), wk = 0.0025189 k( 25) = ( 0.2894737 -0.0000000 -0.0000000), wk = 0.0025189 k( 26) = ( 0.2807018 -0.0000000 -0.0000000), wk = 0.0025189 k( 27) = ( 0.2719298 -0.0000000 -0.0000000), wk = 0.0025189 k( 28) = ( 0.2631579 -0.0000000 -0.0000000), wk = 0.0025189 k( 29) = ( 0.2543860 -0.0000000 -0.0000000), wk = 0.0025189 k( 30) = ( 0.2456140 -0.0000000 -0.0000000), wk = 0.0025189 k( 31) = ( 0.2368421 -0.0000000 -0.0000000), wk = 0.0025189 k( 32) = ( 0.2280702 -0.0000000 -0.0000000), wk = 0.0025189 k( 33) = ( 0.2192983 -0.0000000 -0.0000000), wk = 0.0025189 k( 34) = ( 0.2105263 -0.0000000 -0.0000000), wk = 0.0025189 k( 35) = ( 0.2017544 -0.0000000 -0.0000000), wk = 0.0025189 k( 36) = ( 0.1929825 -0.0000000 -0.0000000), wk = 0.0025189 k( 37) = ( 0.1842105 -0.0000000 -0.0000000), wk = 0.0025189 k( 38) = ( 0.1754386 -0.0000000 -0.0000000), wk = 0.0025189 k( 39) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0025189 k( 40) = ( 0.1578947 -0.0000000 -0.0000000), wk = 0.0025189 k( 41) = ( 0.1491228 -0.0000000 -0.0000000), wk = 0.0025189 k( 42) = ( 0.1403509 -0.0000000 -0.0000000), wk = 0.0025189 k( 43) = ( 0.1315790 -0.0000000 -0.0000000), wk = 0.0025189 k( 44) = ( 0.1228070 -0.0000000 -0.0000000), wk = 0.0025189 k( 45) = ( 0.1140351 -0.0000000 -0.0000000), wk = 0.0025189 k( 46) = ( 0.1052632 -0.0000000 -0.0000000), wk = 0.0025189 k( 47) = ( 0.0964912 -0.0000000 -0.0000000), wk = 0.0025189 k( 48) = ( 0.0877193 -0.0000000 -0.0000000), wk = 0.0025189 k( 49) = ( 0.0789474 -0.0000000 -0.0000000), wk = 0.0025189 k( 50) = ( 0.0701754 -0.0000000 -0.0000000), wk = 0.0025189 k( 51) = ( 0.0614035 -0.0000000 -0.0000000), wk = 0.0025189 k( 52) = ( 0.0526316 -0.0000000 -0.0000000), wk = 0.0025189 k( 53) = ( 0.0438597 -0.0000000 -0.0000000), wk = 0.0025189 k( 54) = ( 0.0350877 -0.0000000 -0.0000000), wk = 0.0025189 k( 55) = ( 0.0263158 -0.0000000 -0.0000000), wk = 0.0025189 k( 56) = ( 0.0175439 -0.0000000 -0.0000000), wk = 0.0025189 k( 57) = ( 0.0087719 -0.0000000 -0.0000000), wk = 0.0025189 k( 58) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 59) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 60) = ( 0.0000000 0.0087258 -0.0000000), wk = 0.0025189 k( 61) = ( 0.0000000 0.0174516 -0.0000000), wk = 0.0025189 k( 62) = ( 0.0000000 0.0261774 -0.0000000), wk = 0.0025189 k( 63) = ( 0.0000000 0.0349032 -0.0000000), wk = 0.0025189 k( 64) = ( 0.0000000 0.0436289 -0.0000000), wk = 0.0025189 k( 65) = ( 0.0000000 0.0523547 -0.0000000), wk = 0.0025189 k( 66) = ( 0.0000000 0.0610805 -0.0000000), wk = 0.0025189 k( 67) = ( 0.0000000 0.0698063 -0.0000000), wk = 0.0025189 k( 68) = ( 0.0000000 0.0785321 -0.0000000), wk = 0.0025189 k( 69) = ( 0.0000000 0.0872579 -0.0000000), wk = 0.0025189 k( 70) = ( 0.0000000 0.0959837 -0.0000000), wk = 0.0025189 k( 71) = ( 0.0000000 0.1047095 -0.0000000), wk = 0.0025189 k( 72) = ( 0.0000000 0.1134352 -0.0000000), wk = 0.0025189 k( 73) = ( 0.0000000 0.1221610 -0.0000000), wk = 0.0025189 k( 74) = ( 0.0000000 0.1308868 -0.0000000), wk = 0.0025189 k( 75) = ( 0.0000000 0.1396126 -0.0000000), wk = 0.0025189 k( 76) = ( 0.0000000 0.1483384 -0.0000000), wk = 0.0025189 k( 77) = ( 0.0000000 0.1570642 -0.0000000), wk = 0.0025189 k( 78) = ( 0.0000000 0.1657900 -0.0000000), wk = 0.0025189 k( 79) = ( 0.0000000 0.1745158 -0.0000000), wk = 0.0025189 k( 80) = ( 0.0000000 0.1832415 -0.0000000), wk = 0.0025189 k( 81) = ( 0.0000000 0.1919673 -0.0000000), wk = 0.0025189 k( 82) = ( 0.0000000 0.2006931 -0.0000000), wk = 0.0025189 k( 83) = ( 0.0000000 0.2094189 -0.0000000), wk = 0.0025189 k( 84) = ( 0.0000000 0.2181447 -0.0000000), wk = 0.0025189 k( 85) = ( 0.0000000 0.2268705 -0.0000000), wk = 0.0025189 k( 86) = ( 0.0000000 0.2355963 -0.0000000), wk = 0.0025189 k( 87) = ( 0.0000000 0.2443221 -0.0000000), wk = 0.0025189 k( 88) = ( 0.0000000 0.2530478 -0.0000000), wk = 0.0025189 k( 89) = ( 0.0000000 0.2617736 -0.0000000), wk = 0.0025189 k( 90) = ( 0.0000000 0.2704994 -0.0000000), wk = 0.0025189 k( 91) = ( 0.0000000 0.2792252 -0.0000000), wk = 0.0025189 k( 92) = ( 0.0000000 0.2879510 -0.0000000), wk = 0.0025189 k( 93) = ( 0.0000000 0.2966768 -0.0000000), wk = 0.0025189 k( 94) = ( 0.0000000 0.3054026 -0.0000000), wk = 0.0025189 k( 95) = ( 0.0000000 0.3141284 -0.0000000), wk = 0.0025189 k( 96) = ( 0.0000000 0.3228541 -0.0000000), wk = 0.0025189 k( 97) = ( 0.0000000 0.3315799 -0.0000000), wk = 0.0025189 k( 98) = ( 0.0000000 0.3403057 -0.0000000), wk = 0.0025189 k( 99) = ( 0.0000000 0.3490315 -0.0000000), wk = 0.0025189 k( 100) = ( 0.0000000 0.3577573 -0.0000000), wk = 0.0025189 k( 101) = ( 0.0000000 0.3664831 -0.0000000), wk = 0.0025189 k( 102) = ( 0.0000000 0.3752089 -0.0000000), wk = 0.0025189 k( 103) = ( 0.0000000 0.3839347 -0.0000000), wk = 0.0025189 k( 104) = ( 0.0000000 0.3926604 -0.0000000), wk = 0.0025189 k( 105) = ( 0.0000000 0.4013862 -0.0000000), wk = 0.0025189 k( 106) = ( 0.0000000 0.4101120 -0.0000000), wk = 0.0025189 k( 107) = ( 0.5000000 0.4101120 -0.0000000), wk = 0.0025189 k( 108) = ( 0.4931507 0.4044941 -0.0000000), wk = 0.0025189 k( 109) = ( 0.4863014 0.3988761 -0.0000000), wk = 0.0025189 k( 110) = ( 0.4794521 0.3932581 -0.0000000), wk = 0.0025189 k( 111) = ( 0.4726027 0.3876401 -0.0000000), wk = 0.0025189 k( 112) = ( 0.4657534 0.3820222 -0.0000000), wk = 0.0025189 k( 113) = ( 0.4589041 0.3764042 -0.0000000), wk = 0.0025189 k( 114) = ( 0.4520548 0.3707862 -0.0000000), wk = 0.0025189 k( 115) = ( 0.4452055 0.3651682 -0.0000000), wk = 0.0025189 k( 116) = ( 0.4383562 0.3595503 -0.0000000), wk = 0.0025189 k( 117) = ( 0.4315068 0.3539323 -0.0000000), wk = 0.0025189 k( 118) = ( 0.4246575 0.3483143 -0.0000000), wk = 0.0025189 k( 119) = ( 0.4178082 0.3426964 -0.0000000), wk = 0.0025189 k( 120) = ( 0.4109589 0.3370784 -0.0000000), wk = 0.0025189 k( 121) = ( 0.4041096 0.3314604 -0.0000000), wk = 0.0025189 k( 122) = ( 0.3972603 0.3258424 -0.0000000), wk = 0.0025189 k( 123) = ( 0.3904110 0.3202245 -0.0000000), wk = 0.0025189 k( 124) = ( 0.3835616 0.3146065 -0.0000000), wk = 0.0025189 k( 125) = ( 0.3767123 0.3089885 -0.0000000), wk = 0.0025189 k( 126) = ( 0.3698630 0.3033705 -0.0000000), wk = 0.0025189 k( 127) = ( 0.3630137 0.2977526 -0.0000000), wk = 0.0025189 k( 128) = ( 0.3561644 0.2921346 -0.0000000), wk = 0.0025189 k( 129) = ( 0.3493151 0.2865166 -0.0000000), wk = 0.0025189 k( 130) = ( 0.3424658 0.2808986 -0.0000000), wk = 0.0025189 k( 131) = ( 0.3356164 0.2752807 -0.0000000), wk = 0.0025189 k( 132) = ( 0.3287671 0.2696627 -0.0000000), wk = 0.0025189 k( 133) = ( 0.3219178 0.2640447 -0.0000000), wk = 0.0025189 k( 134) = ( 0.3150685 0.2584268 -0.0000000), wk = 0.0025189 k( 135) = ( 0.3082192 0.2528088 -0.0000000), wk = 0.0025189 k( 136) = ( 0.3013699 0.2471908 -0.0000000), wk = 0.0025189 k( 137) = ( 0.2945205 0.2415728 -0.0000000), wk = 0.0025189 k( 138) = ( 0.2876712 0.2359549 -0.0000000), wk = 0.0025189 k( 139) = ( 0.2808219 0.2303369 -0.0000000), wk = 0.0025189 k( 140) = ( 0.2739726 0.2247189 -0.0000000), wk = 0.0025189 k( 141) = ( 0.2671233 0.2191009 -0.0000000), wk = 0.0025189 k( 142) = ( 0.2602740 0.2134830 -0.0000000), wk = 0.0025189 k( 143) = ( 0.2534247 0.2078650 -0.0000000), wk = 0.0025189 k( 144) = ( 0.2465753 0.2022470 -0.0000000), wk = 0.0025189 k( 145) = ( 0.2397260 0.1966291 -0.0000000), wk = 0.0025189 k( 146) = ( 0.2328767 0.1910111 -0.0000000), wk = 0.0025189 k( 147) = ( 0.2260274 0.1853931 -0.0000000), wk = 0.0025189 k( 148) = ( 0.2191781 0.1797751 -0.0000000), wk = 0.0025189 k( 149) = ( 0.2123288 0.1741572 -0.0000000), wk = 0.0025189 k( 150) = ( 0.2054795 0.1685392 -0.0000000), wk = 0.0025189 k( 151) = ( 0.1986301 0.1629212 -0.0000000), wk = 0.0025189 k( 152) = ( 0.1917808 0.1573032 -0.0000000), wk = 0.0025189 k( 153) = ( 0.1849315 0.1516853 -0.0000000), wk = 0.0025189 k( 154) = ( 0.1780822 0.1460673 -0.0000000), wk = 0.0025189 k( 155) = ( 0.1712329 0.1404493 -0.0000000), wk = 0.0025189 k( 156) = ( 0.1643836 0.1348314 -0.0000000), wk = 0.0025189 k( 157) = ( 0.1575342 0.1292134 -0.0000000), wk = 0.0025189 k( 158) = ( 0.1506849 0.1235954 -0.0000000), wk = 0.0025189 k( 159) = ( 0.1438356 0.1179774 -0.0000000), wk = 0.0025189 k( 160) = ( 0.1369863 0.1123595 -0.0000000), wk = 0.0025189 k( 161) = ( 0.1301370 0.1067415 -0.0000000), wk = 0.0025189 k( 162) = ( 0.1232877 0.1011235 -0.0000000), wk = 0.0025189 k( 163) = ( 0.1164384 0.0955055 -0.0000000), wk = 0.0025189 k( 164) = ( 0.1095890 0.0898876 -0.0000000), wk = 0.0025189 k( 165) = ( 0.1027397 0.0842696 -0.0000000), wk = 0.0025189 k( 166) = ( 0.0958904 0.0786516 -0.0000000), wk = 0.0025189 k( 167) = ( 0.0890411 0.0730337 -0.0000000), wk = 0.0025189 k( 168) = ( 0.0821918 0.0674157 -0.0000000), wk = 0.0025189 k( 169) = ( 0.0753425 0.0617977 -0.0000000), wk = 0.0025189 k( 170) = ( 0.0684932 0.0561797 -0.0000000), wk = 0.0025189 k( 171) = ( 0.0616438 0.0505618 -0.0000000), wk = 0.0025189 k( 172) = ( 0.0547945 0.0449438 -0.0000000), wk = 0.0025189 k( 173) = ( 0.0479452 0.0393258 -0.0000000), wk = 0.0025189 k( 174) = ( 0.0410959 0.0337078 -0.0000000), wk = 0.0025189 k( 175) = ( 0.0342466 0.0280899 -0.0000000), wk = 0.0025189 k( 176) = ( 0.0273973 0.0224719 -0.0000000), wk = 0.0025189 k( 177) = ( 0.0205479 0.0168539 -0.0000000), wk = 0.0025189 k( 178) = ( 0.0136986 0.0112359 -0.0000000), wk = 0.0025189 k( 179) = ( 0.0068493 0.0056180 -0.0000000), wk = 0.0025189 k( 180) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 181) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 182) = ( 0.0000000 0.0000000 0.0085698), wk = 0.0025189 k( 183) = ( 0.0000000 0.0000000 0.0171395), wk = 0.0025189 k( 184) = ( 0.0000000 0.0000000 0.0257093), wk = 0.0025189 k( 185) = ( 0.0000000 0.0000000 0.0342790), wk = 0.0025189 k( 186) = ( 0.0000000 0.0000000 0.0428488), wk = 0.0025189 k( 187) = ( 0.0000000 0.0000000 0.0514185), wk = 0.0025189 k( 188) = ( 0.0000000 0.0000000 0.0599883), wk = 0.0025189 k( 189) = ( 0.0000000 0.0000000 0.0685580), wk = 0.0025189 k( 190) = ( 0.0000000 0.0000000 0.0771278), wk = 0.0025189 k( 191) = ( 0.0000000 0.0000000 0.0856976), wk = 0.0025189 k( 192) = ( 0.0000000 0.0000000 0.0942673), wk = 0.0025189 k( 193) = ( 0.0000000 0.0000000 0.1028371), wk = 0.0025189 k( 194) = ( 0.0000000 0.0000000 0.1114068), wk = 0.0025189 k( 195) = ( 0.0000000 0.0000000 0.1199766), wk = 0.0025189 k( 196) = ( 0.0000000 0.0000000 0.1285463), wk = 0.0025189 k( 197) = ( 0.0000000 0.0000000 0.1371161), wk = 0.0025189 k( 198) = ( 0.0000000 0.0000000 0.1456858), wk = 0.0025189 k( 199) = ( 0.0000000 0.0000000 0.1542556), wk = 0.0025189 k( 200) = ( 0.0000000 0.0000000 0.1628254), wk = 0.0025189 k( 201) = ( 0.0000000 0.0000000 0.1713951), wk = 0.0025189 k( 202) = ( 0.0000000 0.0000000 0.1799649), wk = 0.0025189 k( 203) = ( 0.0000000 0.0000000 0.1885346), wk = 0.0025189 k( 204) = ( 0.0000000 0.0000000 0.1971044), wk = 0.0025189 k( 205) = ( 0.5000000 -0.0000000 0.1971044), wk = 0.0025189 k( 206) = ( 0.4918033 -0.0000000 0.1938732), wk = 0.0025189 k( 207) = ( 0.4836066 -0.0000000 0.1906419), wk = 0.0025189 k( 208) = ( 0.4754098 -0.0000000 0.1874107), wk = 0.0025189 k( 209) = ( 0.4672131 -0.0000000 0.1841795), wk = 0.0025189 k( 210) = ( 0.4590164 -0.0000000 0.1809483), wk = 0.0025189 k( 211) = ( 0.4508197 -0.0000000 0.1777171), wk = 0.0025189 k( 212) = ( 0.4426230 -0.0000000 0.1744858), wk = 0.0025189 k( 213) = ( 0.4344262 -0.0000000 0.1712546), wk = 0.0025189 k( 214) = ( 0.4262295 -0.0000000 0.1680234), wk = 0.0025189 k( 215) = ( 0.4180328 -0.0000000 0.1647922), wk = 0.0025189 k( 216) = ( 0.4098361 -0.0000000 0.1615610), wk = 0.0025189 k( 217) = ( 0.4016393 -0.0000000 0.1583297), wk = 0.0025189 k( 218) = ( 0.3934426 -0.0000000 0.1550985), wk = 0.0025189 k( 219) = ( 0.3852459 -0.0000000 0.1518673), wk = 0.0025189 k( 220) = ( 0.3770492 -0.0000000 0.1486361), wk = 0.0025189 k( 221) = ( 0.3688525 -0.0000000 0.1454049), wk = 0.0025189 k( 222) = ( 0.3606557 -0.0000000 0.1421737), wk = 0.0025189 k( 223) = ( 0.3524590 -0.0000000 0.1389424), wk = 0.0025189 k( 224) = ( 0.3442623 -0.0000000 0.1357112), wk = 0.0025189 k( 225) = ( 0.3360656 -0.0000000 0.1324800), wk = 0.0025189 k( 226) = ( 0.3278688 -0.0000000 0.1292488), wk = 0.0025189 k( 227) = ( 0.3196721 -0.0000000 0.1260176), wk = 0.0025189 k( 228) = ( 0.3114754 -0.0000000 0.1227863), wk = 0.0025189 k( 229) = ( 0.3032787 -0.0000000 0.1195551), wk = 0.0025189 k( 230) = ( 0.2950820 -0.0000000 0.1163239), wk = 0.0025189 k( 231) = ( 0.2868852 -0.0000000 0.1130927), wk = 0.0025189 k( 232) = ( 0.2786885 -0.0000000 0.1098615), wk = 0.0025189 k( 233) = ( 0.2704918 -0.0000000 0.1066302), wk = 0.0025189 k( 234) = ( 0.2622951 -0.0000000 0.1033990), wk = 0.0025189 k( 235) = ( 0.2540984 -0.0000000 0.1001678), wk = 0.0025189 k( 236) = ( 0.2459016 -0.0000000 0.0969366), wk = 0.0025189 k( 237) = ( 0.2377049 -0.0000000 0.0937054), wk = 0.0025189 k( 238) = ( 0.2295082 -0.0000000 0.0904741), wk = 0.0025189 k( 239) = ( 0.2213115 -0.0000000 0.0872429), wk = 0.0025189 k( 240) = ( 0.2131147 -0.0000000 0.0840117), wk = 0.0025189 k( 241) = ( 0.2049180 -0.0000000 0.0807805), wk = 0.0025189 k( 242) = ( 0.1967213 -0.0000000 0.0775493), wk = 0.0025189 k( 243) = ( 0.1885246 -0.0000000 0.0743180), wk = 0.0025189 k( 244) = ( 0.1803279 -0.0000000 0.0710868), wk = 0.0025189 k( 245) = ( 0.1721312 -0.0000000 0.0678556), wk = 0.0025189 k( 246) = ( 0.1639344 -0.0000000 0.0646244), wk = 0.0025189 k( 247) = ( 0.1557377 -0.0000000 0.0613932), wk = 0.0025189 k( 248) = ( 0.1475410 -0.0000000 0.0581619), wk = 0.0025189 k( 249) = ( 0.1393443 -0.0000000 0.0549307), wk = 0.0025189 k( 250) = ( 0.1311475 -0.0000000 0.0516995), wk = 0.0025189 k( 251) = ( 0.1229508 -0.0000000 0.0484683), wk = 0.0025189 k( 252) = ( 0.1147541 -0.0000000 0.0452371), wk = 0.0025189 k( 253) = ( 0.1065574 -0.0000000 0.0420059), wk = 0.0025189 k( 254) = ( 0.0983607 -0.0000000 0.0387746), wk = 0.0025189 k( 255) = ( 0.0901639 -0.0000000 0.0355434), wk = 0.0025189 k( 256) = ( 0.0819672 -0.0000000 0.0323122), wk = 0.0025189 k( 257) = ( 0.0737705 -0.0000000 0.0290810), wk = 0.0025189 k( 258) = ( 0.0655738 -0.0000000 0.0258498), wk = 0.0025189 k( 259) = ( 0.0573770 -0.0000000 0.0226185), wk = 0.0025189 k( 260) = ( 0.0491803 -0.0000000 0.0193873), wk = 0.0025189 k( 261) = ( 0.0409836 -0.0000000 0.0161561), wk = 0.0025189 k( 262) = ( 0.0327869 -0.0000000 0.0129249), wk = 0.0025189 k( 263) = ( 0.0245902 -0.0000000 0.0096937), wk = 0.0025189 k( 264) = ( 0.0163934 -0.0000000 0.0064624), wk = 0.0025189 k( 265) = ( 0.0081967 -0.0000000 0.0032312), wk = 0.0025189 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 267) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 268) = ( 0.0000000 0.0078868 0.0037905), wk = 0.0025189 k( 269) = ( 0.0000000 0.0157735 0.0075809), wk = 0.0025189 k( 270) = ( 0.0000000 0.0236603 0.0113714), wk = 0.0025189 k( 271) = ( 0.0000000 0.0315471 0.0151619), wk = 0.0025189 k( 272) = ( 0.0000000 0.0394338 0.0189523), wk = 0.0025189 k( 273) = ( 0.0000000 0.0473206 0.0227428), wk = 0.0025189 k( 274) = ( 0.0000000 0.0552074 0.0265333), wk = 0.0025189 k( 275) = ( 0.0000000 0.0630942 0.0303238), wk = 0.0025189 k( 276) = ( 0.0000000 0.0709809 0.0341142), wk = 0.0025189 k( 277) = ( 0.0000000 0.0788677 0.0379047), wk = 0.0025189 k( 278) = ( 0.0000000 0.0867545 0.0416952), wk = 0.0025189 k( 279) = ( 0.0000000 0.0946412 0.0454856), wk = 0.0025189 k( 280) = ( 0.0000000 0.1025280 0.0492761), wk = 0.0025189 k( 281) = ( 0.0000000 0.1104148 0.0530666), wk = 0.0025189 k( 282) = ( 0.0000000 0.1183015 0.0568570), wk = 0.0025189 k( 283) = ( 0.0000000 0.1261883 0.0606475), wk = 0.0025189 k( 284) = ( 0.0000000 0.1340751 0.0644380), wk = 0.0025189 k( 285) = ( 0.0000000 0.1419619 0.0682284), wk = 0.0025189 k( 286) = ( 0.0000000 0.1498486 0.0720189), wk = 0.0025189 k( 287) = ( 0.0000000 0.1577354 0.0758094), wk = 0.0025189 k( 288) = ( 0.0000000 0.1656222 0.0795998), wk = 0.0025189 k( 289) = ( 0.0000000 0.1735089 0.0833903), wk = 0.0025189 k( 290) = ( 0.0000000 0.1813957 0.0871808), wk = 0.0025189 k( 291) = ( 0.0000000 0.1892825 0.0909713), wk = 0.0025189 k( 292) = ( 0.0000000 0.1971692 0.0947617), wk = 0.0025189 k( 293) = ( 0.0000000 0.2050560 0.0985522), wk = 0.0025189 k( 294) = ( 0.0000000 0.2129428 0.1023427), wk = 0.0025189 k( 295) = ( 0.0000000 0.2208296 0.1061331), wk = 0.0025189 k( 296) = ( 0.0000000 0.2287163 0.1099236), wk = 0.0025189 k( 297) = ( 0.0000000 0.2366031 0.1137141), wk = 0.0025189 k( 298) = ( 0.0000000 0.2444899 0.1175045), wk = 0.0025189 k( 299) = ( 0.0000000 0.2523766 0.1212950), wk = 0.0025189 k( 300) = ( 0.0000000 0.2602634 0.1250855), wk = 0.0025189 k( 301) = ( 0.0000000 0.2681502 0.1288759), wk = 0.0025189 k( 302) = ( 0.0000000 0.2760369 0.1326664), wk = 0.0025189 k( 303) = ( 0.0000000 0.2839237 0.1364569), wk = 0.0025189 k( 304) = ( 0.0000000 0.2918105 0.1402473), wk = 0.0025189 k( 305) = ( 0.0000000 0.2996973 0.1440378), wk = 0.0025189 k( 306) = ( 0.0000000 0.3075840 0.1478283), wk = 0.0025189 k( 307) = ( 0.0000000 0.3154708 0.1516188), wk = 0.0025189 k( 308) = ( 0.0000000 0.3233576 0.1554092), wk = 0.0025189 k( 309) = ( 0.0000000 0.3312443 0.1591997), wk = 0.0025189 k( 310) = ( 0.0000000 0.3391311 0.1629902), wk = 0.0025189 k( 311) = ( 0.0000000 0.3470179 0.1667806), wk = 0.0025189 k( 312) = ( 0.0000000 0.3549046 0.1705711), wk = 0.0025189 k( 313) = ( 0.0000000 0.3627914 0.1743616), wk = 0.0025189 k( 314) = ( 0.0000000 0.3706782 0.1781520), wk = 0.0025189 k( 315) = ( 0.0000000 0.3785649 0.1819425), wk = 0.0025189 k( 316) = ( 0.0000000 0.3864517 0.1857330), wk = 0.0025189 k( 317) = ( 0.0000000 0.3943385 0.1895234), wk = 0.0025189 k( 318) = ( 0.0000000 0.4022253 0.1933139), wk = 0.0025189 k( 319) = ( 0.0000000 0.4101120 0.1971044), wk = 0.0025189 k( 320) = ( 0.5000000 0.4101120 0.1971044), wk = 0.0025189 k( 321) = ( 0.4935065 0.4047859 0.1945446), wk = 0.0025189 k( 322) = ( 0.4870130 0.3994598 0.1919848), wk = 0.0025189 k( 323) = ( 0.4805195 0.3941336 0.1894250), wk = 0.0025189 k( 324) = ( 0.4740260 0.3888075 0.1868652), wk = 0.0025189 k( 325) = ( 0.4675325 0.3834814 0.1843054), wk = 0.0025189 k( 326) = ( 0.4610390 0.3781552 0.1817456), wk = 0.0025189 k( 327) = ( 0.4545455 0.3728291 0.1791858), wk = 0.0025189 k( 328) = ( 0.4480519 0.3675030 0.1766260), wk = 0.0025189 k( 329) = ( 0.4415584 0.3621769 0.1740662), wk = 0.0025189 k( 330) = ( 0.4350649 0.3568507 0.1715064), wk = 0.0025189 k( 331) = ( 0.4285714 0.3515246 0.1689466), wk = 0.0025189 k( 332) = ( 0.4220779 0.3461985 0.1663868), wk = 0.0025189 k( 333) = ( 0.4155844 0.3408723 0.1638270), wk = 0.0025189 k( 334) = ( 0.4090909 0.3355462 0.1612672), wk = 0.0025189 k( 335) = ( 0.4025974 0.3302201 0.1587074), wk = 0.0025189 k( 336) = ( 0.3961039 0.3248939 0.1561476), wk = 0.0025189 k( 337) = ( 0.3896104 0.3195678 0.1535878), wk = 0.0025189 k( 338) = ( 0.3831169 0.3142417 0.1510280), wk = 0.0025189 k( 339) = ( 0.3766234 0.3089156 0.1484682), wk = 0.0025189 k( 340) = ( 0.3701299 0.3035894 0.1459084), wk = 0.0025189 k( 341) = ( 0.3636364 0.2982633 0.1433486), wk = 0.0025189 k( 342) = ( 0.3571429 0.2929372 0.1407888), wk = 0.0025189 k( 343) = ( 0.3506494 0.2876110 0.1382290), wk = 0.0025189 k( 344) = ( 0.3441558 0.2822849 0.1356692), wk = 0.0025189 k( 345) = ( 0.3376623 0.2769588 0.1331095), wk = 0.0025189 k( 346) = ( 0.3311688 0.2716326 0.1305497), wk = 0.0025189 k( 347) = ( 0.3246753 0.2663065 0.1279899), wk = 0.0025189 k( 348) = ( 0.3181818 0.2609804 0.1254301), wk = 0.0025189 k( 349) = ( 0.3116883 0.2556543 0.1228703), wk = 0.0025189 k( 350) = ( 0.3051948 0.2503281 0.1203105), wk = 0.0025189 k( 351) = ( 0.2987013 0.2450020 0.1177507), wk = 0.0025189 k( 352) = ( 0.2922078 0.2396759 0.1151909), wk = 0.0025189 k( 353) = ( 0.2857143 0.2343497 0.1126311), wk = 0.0025189 k( 354) = ( 0.2792208 0.2290236 0.1100713), wk = 0.0025189 k( 355) = ( 0.2727273 0.2236975 0.1075115), wk = 0.0025189 k( 356) = ( 0.2662338 0.2183713 0.1049517), wk = 0.0025189 k( 357) = ( 0.2597403 0.2130452 0.1023919), wk = 0.0025189 k( 358) = ( 0.2532468 0.2077191 0.0998321), wk = 0.0025189 k( 359) = ( 0.2467533 0.2023930 0.0972723), wk = 0.0025189 k( 360) = ( 0.2402597 0.1970668 0.0947125), wk = 0.0025189 k( 361) = ( 0.2337662 0.1917407 0.0921527), wk = 0.0025189 k( 362) = ( 0.2272727 0.1864146 0.0895929), wk = 0.0025189 k( 363) = ( 0.2207792 0.1810884 0.0870331), wk = 0.0025189 k( 364) = ( 0.2142857 0.1757623 0.0844733), wk = 0.0025189 k( 365) = ( 0.2077922 0.1704362 0.0819135), wk = 0.0025189 k( 366) = ( 0.2012987 0.1651100 0.0793537), wk = 0.0025189 k( 367) = ( 0.1948052 0.1597839 0.0767939), wk = 0.0025189 k( 368) = ( 0.1883117 0.1544578 0.0742341), wk = 0.0025189 k( 369) = ( 0.1818182 0.1491316 0.0716743), wk = 0.0025189 k( 370) = ( 0.1753247 0.1438055 0.0691145), wk = 0.0025189 k( 371) = ( 0.1688312 0.1384794 0.0665547), wk = 0.0025189 k( 372) = ( 0.1623377 0.1331533 0.0639949), wk = 0.0025189 k( 373) = ( 0.1558442 0.1278271 0.0614351), wk = 0.0025189 k( 374) = ( 0.1493507 0.1225010 0.0588753), wk = 0.0025189 k( 375) = ( 0.1428571 0.1171749 0.0563155), wk = 0.0025189 k( 376) = ( 0.1363636 0.1118487 0.0537557), wk = 0.0025189 k( 377) = ( 0.1298701 0.1065226 0.0511959), wk = 0.0025189 k( 378) = ( 0.1233766 0.1011965 0.0486361), wk = 0.0025189 k( 379) = ( 0.1168831 0.0958703 0.0460763), wk = 0.0025189 k( 380) = ( 0.1103896 0.0905442 0.0435166), wk = 0.0025189 k( 381) = ( 0.1038961 0.0852181 0.0409568), wk = 0.0025189 k( 382) = ( 0.0974026 0.0798920 0.0383970), wk = 0.0025189 k( 383) = ( 0.0909091 0.0745658 0.0358372), wk = 0.0025189 k( 384) = ( 0.0844156 0.0692397 0.0332774), wk = 0.0025189 k( 385) = ( 0.0779221 0.0639136 0.0307176), wk = 0.0025189 k( 386) = ( 0.0714286 0.0585874 0.0281578), wk = 0.0025189 k( 387) = ( 0.0649351 0.0532613 0.0255980), wk = 0.0025189 k( 388) = ( 0.0584416 0.0479352 0.0230382), wk = 0.0025189 k( 389) = ( 0.0519481 0.0426090 0.0204784), wk = 0.0025189 k( 390) = ( 0.0454546 0.0372829 0.0179186), wk = 0.0025189 k( 391) = ( 0.0389610 0.0319568 0.0153588), wk = 0.0025189 k( 392) = ( 0.0324675 0.0266306 0.0127990), wk = 0.0025189 k( 393) = ( 0.0259740 0.0213045 0.0102392), wk = 0.0025189 k( 394) = ( 0.0194805 0.0159784 0.0076794), wk = 0.0025189 k( 395) = ( 0.0129870 0.0106523 0.0051196), wk = 0.0025189 k( 396) = ( 0.0064935 0.0053261 0.0025598), wk = 0.0025189 k( 397) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 cryst. coord. k( 1) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0025189 k( 2) = ( 0.4912281 -0.0000000 0.0000000), wk = 0.0025189 k( 3) = ( 0.4824561 0.0000000 0.0000000), wk = 0.0025189 k( 4) = ( 0.4736842 0.0000000 0.0000000), wk = 0.0025189 k( 5) = ( 0.4649123 0.0000000 0.0000000), wk = 0.0025189 k( 6) = ( 0.4561404 -0.0000000 0.0000000), wk = 0.0025189 k( 7) = ( 0.4473684 0.0000000 0.0000000), wk = 0.0025189 k( 8) = ( 0.4385965 -0.0000000 0.0000000), wk = 0.0025189 k( 9) = ( 0.4298246 -0.0000000 0.0000000), wk = 0.0025189 k( 10) = ( 0.4210526 0.0000000 0.0000000), wk = 0.0025189 k( 11) = ( 0.4122807 0.0000000 0.0000000), wk = 0.0025189 k( 12) = ( 0.4035088 0.0000000 0.0000000), wk = 0.0025189 k( 13) = ( 0.3947368 -0.0000000 0.0000000), wk = 0.0025189 k( 14) = ( 0.3859649 -0.0000000 0.0000000), wk = 0.0025189 k( 15) = ( 0.3771930 0.0000000 0.0000000), wk = 0.0025189 k( 16) = ( 0.3684211 0.0000000 0.0000000), wk = 0.0025189 k( 17) = ( 0.3596491 -0.0000000 0.0000000), wk = 0.0025189 k( 18) = ( 0.3508772 0.0000000 0.0000000), wk = 0.0025189 k( 19) = ( 0.3421053 0.0000000 0.0000000), wk = 0.0025189 k( 20) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0025189 k( 21) = ( 0.3245614 -0.0000000 0.0000000), wk = 0.0025189 k( 22) = ( 0.3157895 -0.0000000 0.0000000), wk = 0.0025189 k( 23) = ( 0.3070175 0.0000000 0.0000000), wk = 0.0025189 k( 24) = ( 0.2982456 0.0000000 0.0000000), wk = 0.0025189 k( 25) = ( 0.2894737 -0.0000000 0.0000000), wk = 0.0025189 k( 26) = ( 0.2807018 0.0000000 0.0000000), wk = 0.0025189 k( 27) = ( 0.2719298 0.0000000 0.0000000), wk = 0.0025189 k( 28) = ( 0.2631579 0.0000000 0.0000000), wk = 0.0025189 k( 29) = ( 0.2543860 0.0000000 0.0000000), wk = 0.0025189 k( 30) = ( 0.2456140 0.0000000 0.0000000), wk = 0.0025189 k( 31) = ( 0.2368421 0.0000000 0.0000000), wk = 0.0025189 k( 32) = ( 0.2280702 0.0000000 0.0000000), wk = 0.0025189 k( 33) = ( 0.2192983 -0.0000000 0.0000000), wk = 0.0025189 k( 34) = ( 0.2105263 -0.0000000 0.0000000), wk = 0.0025189 k( 35) = ( 0.2017544 0.0000000 0.0000000), wk = 0.0025189 k( 36) = ( 0.1929825 0.0000000 0.0000000), wk = 0.0025189 k( 37) = ( 0.1842105 -0.0000000 0.0000000), wk = 0.0025189 k( 38) = ( 0.1754386 -0.0000000 0.0000000), wk = 0.0025189 k( 39) = ( 0.1666667 0.0000000 0.0000000), wk = 0.0025189 k( 40) = ( 0.1578947 0.0000000 0.0000000), wk = 0.0025189 k( 41) = ( 0.1491228 -0.0000000 0.0000000), wk = 0.0025189 k( 42) = ( 0.1403509 -0.0000000 0.0000000), wk = 0.0025189 k( 43) = ( 0.1315790 0.0000000 0.0000000), wk = 0.0025189 k( 44) = ( 0.1228070 0.0000000 0.0000000), wk = 0.0025189 k( 45) = ( 0.1140351 0.0000000 0.0000000), wk = 0.0025189 k( 46) = ( 0.1052632 -0.0000000 0.0000000), wk = 0.0025189 k( 47) = ( 0.0964912 0.0000000 0.0000000), wk = 0.0025189 k( 48) = ( 0.0877193 -0.0000000 0.0000000), wk = 0.0025189 k( 49) = ( 0.0789474 0.0000000 0.0000000), wk = 0.0025189 k( 50) = ( 0.0701754 -0.0000000 0.0000000), wk = 0.0025189 k( 51) = ( 0.0614035 0.0000000 0.0000000), wk = 0.0025189 k( 52) = ( 0.0526316 -0.0000000 0.0000000), wk = 0.0025189 k( 53) = ( 0.0438597 -0.0000000 0.0000000), wk = 0.0025189 k( 54) = ( 0.0350877 -0.0000000 0.0000000), wk = 0.0025189 k( 55) = ( 0.0263158 -0.0000000 0.0000000), wk = 0.0025189 k( 56) = ( 0.0175439 -0.0000000 0.0000000), wk = 0.0025189 k( 57) = ( 0.0087719 -0.0000000 0.0000000), wk = 0.0025189 k( 58) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 59) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 60) = ( 0.0000000 0.0106383 -0.0000000), wk = 0.0025189 k( 61) = ( 0.0000000 0.0212766 -0.0000000), wk = 0.0025189 k( 62) = ( 0.0000000 0.0319149 -0.0000000), wk = 0.0025189 k( 63) = ( 0.0000000 0.0425532 0.0000000), wk = 0.0025189 k( 64) = ( 0.0000000 0.0531915 0.0000000), wk = 0.0025189 k( 65) = ( 0.0000000 0.0638298 0.0000000), wk = 0.0025189 k( 66) = ( 0.0000000 0.0744681 0.0000000), wk = 0.0025189 k( 67) = ( 0.0000000 0.0851064 0.0000000), wk = 0.0025189 k( 68) = ( 0.0000000 0.0957447 -0.0000000), wk = 0.0025189 k( 69) = ( 0.0000000 0.1063830 0.0000000), wk = 0.0025189 k( 70) = ( 0.0000000 0.1170213 0.0000000), wk = 0.0025189 k( 71) = ( 0.0000000 0.1276596 0.0000000), wk = 0.0025189 k( 72) = ( 0.0000000 0.1382979 0.0000000), wk = 0.0025189 k( 73) = ( 0.0000000 0.1489362 0.0000000), wk = 0.0025189 k( 74) = ( 0.0000000 0.1595745 0.0000000), wk = 0.0025189 k( 75) = ( 0.0000000 0.1702128 0.0000000), wk = 0.0025189 k( 76) = ( 0.0000000 0.1808511 0.0000000), wk = 0.0025189 k( 77) = ( 0.0000000 0.1914894 -0.0000000), wk = 0.0025189 k( 78) = ( 0.0000000 0.2021277 0.0000000), wk = 0.0025189 k( 79) = ( 0.0000000 0.2127660 0.0000000), wk = 0.0025189 k( 80) = ( 0.0000000 0.2234043 0.0000000), wk = 0.0025189 k( 81) = ( 0.0000000 0.2340425 0.0000000), wk = 0.0025189 k( 82) = ( 0.0000000 0.2446809 0.0000000), wk = 0.0025189 k( 83) = ( 0.0000000 0.2553191 0.0000000), wk = 0.0025189 k( 84) = ( 0.0000000 0.2659574 0.0000000), wk = 0.0025189 k( 85) = ( 0.0000000 0.2765957 0.0000000), wk = 0.0025189 k( 86) = ( 0.0000000 0.2872340 0.0000000), wk = 0.0025189 k( 87) = ( 0.0000000 0.2978723 0.0000000), wk = 0.0025189 k( 88) = ( 0.0000000 0.3085106 0.0000000), wk = 0.0025189 k( 89) = ( 0.0000000 0.3191489 0.0000000), wk = 0.0025189 k( 90) = ( 0.0000000 0.3297872 0.0000000), wk = 0.0025189 k( 91) = ( 0.0000000 0.3404255 0.0000000), wk = 0.0025189 k( 92) = ( 0.0000000 0.3510638 -0.0000000), wk = 0.0025189 k( 93) = ( 0.0000000 0.3617021 0.0000000), wk = 0.0025189 k( 94) = ( 0.0000000 0.3723404 0.0000000), wk = 0.0025189 k( 95) = ( 0.0000000 0.3829787 -0.0000000), wk = 0.0025189 k( 96) = ( 0.0000000 0.3936170 0.0000000), wk = 0.0025189 k( 97) = ( 0.0000000 0.4042553 0.0000000), wk = 0.0025189 k( 98) = ( 0.0000000 0.4148936 0.0000000), wk = 0.0025189 k( 99) = ( 0.0000000 0.4255319 -0.0000000), wk = 0.0025189 k( 100) = ( 0.0000000 0.4361702 0.0000000), wk = 0.0025189 k( 101) = ( 0.0000000 0.4468085 0.0000000), wk = 0.0025189 k( 102) = ( 0.0000000 0.4574468 0.0000000), wk = 0.0025189 k( 103) = ( 0.0000000 0.4680851 0.0000000), wk = 0.0025189 k( 104) = ( 0.0000000 0.4787234 0.0000000), wk = 0.0025189 k( 105) = ( 0.0000000 0.4893617 0.0000000), wk = 0.0025189 k( 106) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025189 k( 107) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0025189 k( 108) = ( 0.4931507 0.4931507 0.0000000), wk = 0.0025189 k( 109) = ( 0.4863014 0.4863014 0.0000000), wk = 0.0025189 k( 110) = ( 0.4794521 0.4794521 0.0000000), wk = 0.0025189 k( 111) = ( 0.4726027 0.4726027 0.0000000), wk = 0.0025189 k( 112) = ( 0.4657534 0.4657534 0.0000000), wk = 0.0025189 k( 113) = ( 0.4589041 0.4589041 0.0000000), wk = 0.0025189 k( 114) = ( 0.4520548 0.4520548 0.0000000), wk = 0.0025189 k( 115) = ( 0.4452055 0.4452055 0.0000000), wk = 0.0025189 k( 116) = ( 0.4383562 0.4383562 0.0000000), wk = 0.0025189 k( 117) = ( 0.4315068 0.4315068 0.0000000), wk = 0.0025189 k( 118) = ( 0.4246575 0.4246575 0.0000000), wk = 0.0025189 k( 119) = ( 0.4178082 0.4178082 0.0000000), wk = 0.0025189 k( 120) = ( 0.4109589 0.4109589 0.0000000), wk = 0.0025189 k( 121) = ( 0.4041096 0.4041096 0.0000000), wk = 0.0025189 k( 122) = ( 0.3972603 0.3972603 -0.0000000), wk = 0.0025189 k( 123) = ( 0.3904110 0.3904110 0.0000000), wk = 0.0025189 k( 124) = ( 0.3835616 0.3835616 -0.0000000), wk = 0.0025189 k( 125) = ( 0.3767123 0.3767123 0.0000000), wk = 0.0025189 k( 126) = ( 0.3698630 0.3698630 0.0000000), wk = 0.0025189 k( 127) = ( 0.3630137 0.3630137 0.0000000), wk = 0.0025189 k( 128) = ( 0.3561644 0.3561644 0.0000000), wk = 0.0025189 k( 129) = ( 0.3493151 0.3493151 0.0000000), wk = 0.0025189 k( 130) = ( 0.3424658 0.3424658 0.0000000), wk = 0.0025189 k( 131) = ( 0.3356164 0.3356164 0.0000000), wk = 0.0025189 k( 132) = ( 0.3287671 0.3287671 0.0000000), wk = 0.0025189 k( 133) = ( 0.3219178 0.3219178 0.0000000), wk = 0.0025189 k( 134) = ( 0.3150685 0.3150685 0.0000000), wk = 0.0025189 k( 135) = ( 0.3082192 0.3082192 0.0000000), wk = 0.0025189 k( 136) = ( 0.3013699 0.3013699 0.0000000), wk = 0.0025189 k( 137) = ( 0.2945205 0.2945205 0.0000000), wk = 0.0025189 k( 138) = ( 0.2876712 0.2876712 0.0000000), wk = 0.0025189 k( 139) = ( 0.2808219 0.2808219 0.0000000), wk = 0.0025189 k( 140) = ( 0.2739726 0.2739726 0.0000000), wk = 0.0025189 k( 141) = ( 0.2671233 0.2671233 0.0000000), wk = 0.0025189 k( 142) = ( 0.2602740 0.2602740 0.0000000), wk = 0.0025189 k( 143) = ( 0.2534247 0.2534247 0.0000000), wk = 0.0025189 k( 144) = ( 0.2465753 0.2465753 0.0000000), wk = 0.0025189 k( 145) = ( 0.2397260 0.2397260 0.0000000), wk = 0.0025189 k( 146) = ( 0.2328767 0.2328767 0.0000000), wk = 0.0025189 k( 147) = ( 0.2260274 0.2260274 0.0000000), wk = 0.0025189 k( 148) = ( 0.2191781 0.2191781 0.0000000), wk = 0.0025189 k( 149) = ( 0.2123288 0.2123288 0.0000000), wk = 0.0025189 k( 150) = ( 0.2054795 0.2054795 0.0000000), wk = 0.0025189 k( 151) = ( 0.1986301 0.1986301 0.0000000), wk = 0.0025189 k( 152) = ( 0.1917808 0.1917808 -0.0000000), wk = 0.0025189 k( 153) = ( 0.1849315 0.1849315 0.0000000), wk = 0.0025189 k( 154) = ( 0.1780822 0.1780822 0.0000000), wk = 0.0025189 k( 155) = ( 0.1712329 0.1712329 0.0000000), wk = 0.0025189 k( 156) = ( 0.1643836 0.1643836 0.0000000), wk = 0.0025189 k( 157) = ( 0.1575342 0.1575342 0.0000000), wk = 0.0025189 k( 158) = ( 0.1506849 0.1506849 0.0000000), wk = 0.0025189 k( 159) = ( 0.1438356 0.1438356 0.0000000), wk = 0.0025189 k( 160) = ( 0.1369863 0.1369863 0.0000000), wk = 0.0025189 k( 161) = ( 0.1301370 0.1301370 0.0000000), wk = 0.0025189 k( 162) = ( 0.1232877 0.1232877 0.0000000), wk = 0.0025189 k( 163) = ( 0.1164384 0.1164384 0.0000000), wk = 0.0025189 k( 164) = ( 0.1095890 0.1095890 0.0000000), wk = 0.0025189 k( 165) = ( 0.1027397 0.1027397 0.0000000), wk = 0.0025189 k( 166) = ( 0.0958904 0.0958904 -0.0000000), wk = 0.0025189 k( 167) = ( 0.0890411 0.0890411 0.0000000), wk = 0.0025189 k( 168) = ( 0.0821918 0.0821918 0.0000000), wk = 0.0025189 k( 169) = ( 0.0753425 0.0753425 0.0000000), wk = 0.0025189 k( 170) = ( 0.0684932 0.0684932 0.0000000), wk = 0.0025189 k( 171) = ( 0.0616438 0.0616438 0.0000000), wk = 0.0025189 k( 172) = ( 0.0547945 0.0547945 0.0000000), wk = 0.0025189 k( 173) = ( 0.0479452 0.0479452 0.0000000), wk = 0.0025189 k( 174) = ( 0.0410959 0.0410959 0.0000000), wk = 0.0025189 k( 175) = ( 0.0342466 0.0342466 0.0000000), wk = 0.0025189 k( 176) = ( 0.0273973 0.0273973 0.0000000), wk = 0.0025189 k( 177) = ( 0.0205479 0.0205479 0.0000000), wk = 0.0025189 k( 178) = ( 0.0136986 0.0136986 0.0000000), wk = 0.0025189 k( 179) = ( 0.0068493 0.0068493 0.0000000), wk = 0.0025189 k( 180) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 181) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 182) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0025189 k( 183) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0025189 k( 184) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0025189 k( 185) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0025189 k( 186) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0025189 k( 187) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0025189 k( 188) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0025189 k( 189) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0025189 k( 190) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0025189 k( 191) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0025189 k( 192) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0025189 k( 193) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0025189 k( 194) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0025189 k( 195) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0025189 k( 196) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0025189 k( 197) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0025189 k( 198) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0025189 k( 199) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0025189 k( 200) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0025189 k( 201) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0025189 k( 202) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0025189 k( 203) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0025189 k( 204) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025189 k( 205) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0025189 k( 206) = ( 0.4918033 0.0000000 0.4918033), wk = 0.0025189 k( 207) = ( 0.4836066 0.0000000 0.4836066), wk = 0.0025189 k( 208) = ( 0.4754098 0.0000000 0.4754098), wk = 0.0025189 k( 209) = ( 0.4672131 0.0000000 0.4672131), wk = 0.0025189 k( 210) = ( 0.4590164 0.0000000 0.4590164), wk = 0.0025189 k( 211) = ( 0.4508197 0.0000000 0.4508197), wk = 0.0025189 k( 212) = ( 0.4426230 0.0000000 0.4426229), wk = 0.0025189 k( 213) = ( 0.4344262 -0.0000000 0.4344262), wk = 0.0025189 k( 214) = ( 0.4262295 -0.0000000 0.4262295), wk = 0.0025189 k( 215) = ( 0.4180328 0.0000000 0.4180328), wk = 0.0025189 k( 216) = ( 0.4098361 0.0000000 0.4098361), wk = 0.0025189 k( 217) = ( 0.4016393 -0.0000000 0.4016393), wk = 0.0025189 k( 218) = ( 0.3934426 0.0000000 0.3934426), wk = 0.0025189 k( 219) = ( 0.3852459 -0.0000000 0.3852459), wk = 0.0025189 k( 220) = ( 0.3770492 0.0000000 0.3770492), wk = 0.0025189 k( 221) = ( 0.3688525 0.0000000 0.3688525), wk = 0.0025189 k( 222) = ( 0.3606557 -0.0000000 0.3606557), wk = 0.0025189 k( 223) = ( 0.3524590 0.0000000 0.3524590), wk = 0.0025189 k( 224) = ( 0.3442623 -0.0000000 0.3442623), wk = 0.0025189 k( 225) = ( 0.3360656 0.0000000 0.3360656), wk = 0.0025189 k( 226) = ( 0.3278688 -0.0000000 0.3278688), wk = 0.0025189 k( 227) = ( 0.3196721 -0.0000000 0.3196721), wk = 0.0025189 k( 228) = ( 0.3114754 0.0000000 0.3114754), wk = 0.0025189 k( 229) = ( 0.3032787 -0.0000000 0.3032787), wk = 0.0025189 k( 230) = ( 0.2950820 0.0000000 0.2950820), wk = 0.0025189 k( 231) = ( 0.2868852 0.0000000 0.2868852), wk = 0.0025189 k( 232) = ( 0.2786885 0.0000000 0.2786885), wk = 0.0025189 k( 233) = ( 0.2704918 -0.0000000 0.2704918), wk = 0.0025189 k( 234) = ( 0.2622951 0.0000000 0.2622951), wk = 0.0025189 k( 235) = ( 0.2540984 0.0000000 0.2540984), wk = 0.0025189 k( 236) = ( 0.2459016 0.0000000 0.2459016), wk = 0.0025189 k( 237) = ( 0.2377049 0.0000000 0.2377049), wk = 0.0025189 k( 238) = ( 0.2295082 0.0000000 0.2295082), wk = 0.0025189 k( 239) = ( 0.2213115 -0.0000000 0.2213115), wk = 0.0025189 k( 240) = ( 0.2131147 0.0000000 0.2131147), wk = 0.0025189 k( 241) = ( 0.2049180 0.0000000 0.2049180), wk = 0.0025189 k( 242) = ( 0.1967213 0.0000000 0.1967213), wk = 0.0025189 k( 243) = ( 0.1885246 0.0000000 0.1885246), wk = 0.0025189 k( 244) = ( 0.1803279 -0.0000000 0.1803279), wk = 0.0025189 k( 245) = ( 0.1721312 -0.0000000 0.1721312), wk = 0.0025189 k( 246) = ( 0.1639344 0.0000000 0.1639344), wk = 0.0025189 k( 247) = ( 0.1557377 -0.0000000 0.1557377), wk = 0.0025189 k( 248) = ( 0.1475410 0.0000000 0.1475410), wk = 0.0025189 k( 249) = ( 0.1393443 0.0000000 0.1393443), wk = 0.0025189 k( 250) = ( 0.1311475 0.0000000 0.1311475), wk = 0.0025189 k( 251) = ( 0.1229508 0.0000000 0.1229508), wk = 0.0025189 k( 252) = ( 0.1147541 0.0000000 0.1147541), wk = 0.0025189 k( 253) = ( 0.1065574 0.0000000 0.1065574), wk = 0.0025189 k( 254) = ( 0.0983607 0.0000000 0.0983607), wk = 0.0025189 k( 255) = ( 0.0901639 0.0000000 0.0901639), wk = 0.0025189 k( 256) = ( 0.0819672 -0.0000000 0.0819672), wk = 0.0025189 k( 257) = ( 0.0737705 0.0000000 0.0737705), wk = 0.0025189 k( 258) = ( 0.0655738 0.0000000 0.0655738), wk = 0.0025189 k( 259) = ( 0.0573770 0.0000000 0.0573770), wk = 0.0025189 k( 260) = ( 0.0491803 0.0000000 0.0491803), wk = 0.0025189 k( 261) = ( 0.0409836 -0.0000000 0.0409836), wk = 0.0025189 k( 262) = ( 0.0327869 0.0000000 0.0327869), wk = 0.0025189 k( 263) = ( 0.0245902 0.0000000 0.0245902), wk = 0.0025189 k( 264) = ( 0.0163934 -0.0000000 0.0163934), wk = 0.0025189 k( 265) = ( 0.0081967 -0.0000000 0.0081967), wk = 0.0025189 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 267) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 k( 268) = ( 0.0000000 0.0096154 0.0096154), wk = 0.0025189 k( 269) = ( 0.0000000 0.0192308 0.0192308), wk = 0.0025189 k( 270) = ( 0.0000000 0.0288462 0.0288462), wk = 0.0025189 k( 271) = ( 0.0000000 0.0384615 0.0384615), wk = 0.0025189 k( 272) = ( 0.0000000 0.0480769 0.0480769), wk = 0.0025189 k( 273) = ( 0.0000000 0.0576923 0.0576923), wk = 0.0025189 k( 274) = ( 0.0000000 0.0673077 0.0673077), wk = 0.0025189 k( 275) = ( 0.0000000 0.0769231 0.0769231), wk = 0.0025189 k( 276) = ( 0.0000000 0.0865385 0.0865385), wk = 0.0025189 k( 277) = ( 0.0000000 0.0961538 0.0961538), wk = 0.0025189 k( 278) = ( 0.0000000 0.1057692 0.1057692), wk = 0.0025189 k( 279) = ( 0.0000000 0.1153846 0.1153846), wk = 0.0025189 k( 280) = ( 0.0000000 0.1250000 0.1250000), wk = 0.0025189 k( 281) = ( 0.0000000 0.1346154 0.1346154), wk = 0.0025189 k( 282) = ( 0.0000000 0.1442308 0.1442308), wk = 0.0025189 k( 283) = ( 0.0000000 0.1538461 0.1538461), wk = 0.0025189 k( 284) = ( 0.0000000 0.1634615 0.1634615), wk = 0.0025189 k( 285) = ( 0.0000000 0.1730769 0.1730769), wk = 0.0025189 k( 286) = ( 0.0000000 0.1826923 0.1826923), wk = 0.0025189 k( 287) = ( 0.0000000 0.1923077 0.1923077), wk = 0.0025189 k( 288) = ( 0.0000000 0.2019231 0.2019231), wk = 0.0025189 k( 289) = ( 0.0000000 0.2115385 0.2115385), wk = 0.0025189 k( 290) = ( 0.0000000 0.2211539 0.2211539), wk = 0.0025189 k( 291) = ( 0.0000000 0.2307692 0.2307692), wk = 0.0025189 k( 292) = ( 0.0000000 0.2403846 0.2403846), wk = 0.0025189 k( 293) = ( 0.0000000 0.2500000 0.2500000), wk = 0.0025189 k( 294) = ( 0.0000000 0.2596154 0.2596154), wk = 0.0025189 k( 295) = ( 0.0000000 0.2692308 0.2692308), wk = 0.0025189 k( 296) = ( 0.0000000 0.2788462 0.2788462), wk = 0.0025189 k( 297) = ( 0.0000000 0.2884615 0.2884615), wk = 0.0025189 k( 298) = ( 0.0000000 0.2980769 0.2980769), wk = 0.0025189 k( 299) = ( 0.0000000 0.3076923 0.3076923), wk = 0.0025189 k( 300) = ( 0.0000000 0.3173077 0.3173077), wk = 0.0025189 k( 301) = ( 0.0000000 0.3269231 0.3269231), wk = 0.0025189 k( 302) = ( 0.0000000 0.3365385 0.3365385), wk = 0.0025189 k( 303) = ( 0.0000000 0.3461538 0.3461538), wk = 0.0025189 k( 304) = ( 0.0000000 0.3557692 0.3557692), wk = 0.0025189 k( 305) = ( 0.0000000 0.3653846 0.3653846), wk = 0.0025189 k( 306) = ( 0.0000000 0.3750000 0.3750000), wk = 0.0025189 k( 307) = ( 0.0000000 0.3846154 0.3846154), wk = 0.0025189 k( 308) = ( 0.0000000 0.3942308 0.3942308), wk = 0.0025189 k( 309) = ( 0.0000000 0.4038462 0.4038462), wk = 0.0025189 k( 310) = ( 0.0000000 0.4134615 0.4134615), wk = 0.0025189 k( 311) = ( 0.0000000 0.4230769 0.4230769), wk = 0.0025189 k( 312) = ( 0.0000000 0.4326923 0.4326923), wk = 0.0025189 k( 313) = ( 0.0000000 0.4423077 0.4423077), wk = 0.0025189 k( 314) = ( 0.0000000 0.4519231 0.4519231), wk = 0.0025189 k( 315) = ( 0.0000000 0.4615385 0.4615385), wk = 0.0025189 k( 316) = ( 0.0000000 0.4711538 0.4711539), wk = 0.0025189 k( 317) = ( 0.0000000 0.4807692 0.4807692), wk = 0.0025189 k( 318) = ( 0.0000000 0.4903846 0.4903846), wk = 0.0025189 k( 319) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0025189 k( 320) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0025189 k( 321) = ( 0.4935065 0.4935065 0.4935065), wk = 0.0025189 k( 322) = ( 0.4870130 0.4870130 0.4870130), wk = 0.0025189 k( 323) = ( 0.4805195 0.4805195 0.4805195), wk = 0.0025189 k( 324) = ( 0.4740260 0.4740260 0.4740260), wk = 0.0025189 k( 325) = ( 0.4675325 0.4675325 0.4675325), wk = 0.0025189 k( 326) = ( 0.4610390 0.4610390 0.4610390), wk = 0.0025189 k( 327) = ( 0.4545455 0.4545455 0.4545455), wk = 0.0025189 k( 328) = ( 0.4480519 0.4480519 0.4480520), wk = 0.0025189 k( 329) = ( 0.4415584 0.4415584 0.4415584), wk = 0.0025189 k( 330) = ( 0.4350649 0.4350649 0.4350649), wk = 0.0025189 k( 331) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0025189 k( 332) = ( 0.4220779 0.4220779 0.4220779), wk = 0.0025189 k( 333) = ( 0.4155844 0.4155844 0.4155844), wk = 0.0025189 k( 334) = ( 0.4090909 0.4090909 0.4090909), wk = 0.0025189 k( 335) = ( 0.4025974 0.4025974 0.4025974), wk = 0.0025189 k( 336) = ( 0.3961039 0.3961039 0.3961039), wk = 0.0025189 k( 337) = ( 0.3896104 0.3896104 0.3896104), wk = 0.0025189 k( 338) = ( 0.3831169 0.3831169 0.3831169), wk = 0.0025189 k( 339) = ( 0.3766234 0.3766234 0.3766234), wk = 0.0025189 k( 340) = ( 0.3701299 0.3701299 0.3701299), wk = 0.0025189 k( 341) = ( 0.3636364 0.3636364 0.3636364), wk = 0.0025189 k( 342) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0025189 k( 343) = ( 0.3506494 0.3506494 0.3506494), wk = 0.0025189 k( 344) = ( 0.3441558 0.3441558 0.3441558), wk = 0.0025189 k( 345) = ( 0.3376623 0.3376623 0.3376623), wk = 0.0025189 k( 346) = ( 0.3311688 0.3311688 0.3311688), wk = 0.0025189 k( 347) = ( 0.3246753 0.3246753 0.3246753), wk = 0.0025189 k( 348) = ( 0.3181818 0.3181818 0.3181818), wk = 0.0025189 k( 349) = ( 0.3116883 0.3116883 0.3116883), wk = 0.0025189 k( 350) = ( 0.3051948 0.3051948 0.3051948), wk = 0.0025189 k( 351) = ( 0.2987013 0.2987013 0.2987013), wk = 0.0025189 k( 352) = ( 0.2922078 0.2922078 0.2922078), wk = 0.0025189 k( 353) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0025189 k( 354) = ( 0.2792208 0.2792208 0.2792208), wk = 0.0025189 k( 355) = ( 0.2727273 0.2727273 0.2727273), wk = 0.0025189 k( 356) = ( 0.2662338 0.2662338 0.2662338), wk = 0.0025189 k( 357) = ( 0.2597403 0.2597403 0.2597403), wk = 0.0025189 k( 358) = ( 0.2532468 0.2532468 0.2532468), wk = 0.0025189 k( 359) = ( 0.2467533 0.2467533 0.2467533), wk = 0.0025189 k( 360) = ( 0.2402597 0.2402597 0.2402597), wk = 0.0025189 k( 361) = ( 0.2337662 0.2337662 0.2337662), wk = 0.0025189 k( 362) = ( 0.2272727 0.2272727 0.2272727), wk = 0.0025189 k( 363) = ( 0.2207792 0.2207792 0.2207792), wk = 0.0025189 k( 364) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0025189 k( 365) = ( 0.2077922 0.2077922 0.2077922), wk = 0.0025189 k( 366) = ( 0.2012987 0.2012987 0.2012987), wk = 0.0025189 k( 367) = ( 0.1948052 0.1948052 0.1948052), wk = 0.0025189 k( 368) = ( 0.1883117 0.1883117 0.1883117), wk = 0.0025189 k( 369) = ( 0.1818182 0.1818182 0.1818182), wk = 0.0025189 k( 370) = ( 0.1753247 0.1753247 0.1753247), wk = 0.0025189 k( 371) = ( 0.1688312 0.1688312 0.1688312), wk = 0.0025189 k( 372) = ( 0.1623377 0.1623377 0.1623377), wk = 0.0025189 k( 373) = ( 0.1558442 0.1558442 0.1558442), wk = 0.0025189 k( 374) = ( 0.1493507 0.1493507 0.1493507), wk = 0.0025189 k( 375) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0025189 k( 376) = ( 0.1363636 0.1363636 0.1363636), wk = 0.0025189 k( 377) = ( 0.1298701 0.1298701 0.1298701), wk = 0.0025189 k( 378) = ( 0.1233766 0.1233766 0.1233766), wk = 0.0025189 k( 379) = ( 0.1168831 0.1168831 0.1168831), wk = 0.0025189 k( 380) = ( 0.1103896 0.1103896 0.1103896), wk = 0.0025189 k( 381) = ( 0.1038961 0.1038961 0.1038961), wk = 0.0025189 k( 382) = ( 0.0974026 0.0974026 0.0974026), wk = 0.0025189 k( 383) = ( 0.0909091 0.0909091 0.0909091), wk = 0.0025189 k( 384) = ( 0.0844156 0.0844156 0.0844156), wk = 0.0025189 k( 385) = ( 0.0779221 0.0779221 0.0779221), wk = 0.0025189 k( 386) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0025189 k( 387) = ( 0.0649351 0.0649351 0.0649351), wk = 0.0025189 k( 388) = ( 0.0584416 0.0584416 0.0584416), wk = 0.0025189 k( 389) = ( 0.0519481 0.0519481 0.0519480), wk = 0.0025189 k( 390) = ( 0.0454546 0.0454546 0.0454546), wk = 0.0025189 k( 391) = ( 0.0389610 0.0389610 0.0389610), wk = 0.0025189 k( 392) = ( 0.0324675 0.0324675 0.0324675), wk = 0.0025189 k( 393) = ( 0.0259740 0.0259740 0.0259740), wk = 0.0025189 k( 394) = ( 0.0194805 0.0194805 0.0194805), wk = 0.0025189 k( 395) = ( 0.0129870 0.0129870 0.0129870), wk = 0.0025189 k( 396) = ( 0.0064935 0.0064935 0.0064935), wk = 0.0025189 k( 397) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025189 Dense grid: 44575 G-vectors FFT dimensions: ( 32, 40, 80) Smooth grid: 19717 G-vectors FFT dimensions: ( 24, 30, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.11 Mb ( 122, 58) NL pseudopotentials 0.13 Mb ( 61, 140) Each V/rho on FFT grid 0.04 Mb ( 2560) Each G-vector array 0.01 Mb ( 928) G-vector shells 0.00 Mb ( 473) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.43 Mb ( 122, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.25 Mb ( 140, 2, 58) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Al2O3.save/charge-density.dat negative rho (up, down): 1.026E-01 0.000E+00 Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 40.0 secs Computing kpt #: 2 total cpu time spent up to now is 42.6 secs Computing kpt #: 3 total cpu time spent up to now is 45.1 secs Computing kpt #: 4 total cpu time spent up to now is 47.6 secs Computing kpt #: 5 total cpu time spent up to now is 50.2 secs Computing kpt #: 6 total cpu time spent up to now is 52.7 secs Computing kpt #: 7 total cpu time spent up to now is 55.2 secs Computing kpt #: 8 total cpu time spent up to now is 57.7 secs Computing kpt #: 9 total cpu time spent up to now is 60.4 secs Computing kpt #: 10 total cpu time spent up to now is 62.9 secs Computing kpt #: 11 total cpu time spent up to now is 65.6 secs Computing kpt #: 12 total cpu time spent up to now is 68.0 secs Computing kpt #: 13 total cpu time spent up to now is 70.4 secs Computing kpt #: 14 total cpu time spent up to now is 72.8 secs Computing kpt #: 15 total cpu time spent up to now is 75.3 secs Computing kpt #: 16 total cpu time spent up to now is 77.9 secs Computing kpt #: 17 total cpu time spent up to now is 80.3 secs Computing kpt #: 18 total cpu time spent up to now is 82.8 secs Computing kpt #: 19 total cpu time spent up to now is 85.2 secs Computing kpt #: 20 total cpu time spent up to now is 87.7 secs Computing kpt #: 21 total cpu time spent up to now is 90.2 secs Computing kpt #: 22 total cpu time spent up to now is 92.8 secs Computing kpt #: 23 total cpu time spent up to now is 95.5 secs Computing kpt #: 24 total cpu time spent up to now is 98.0 secs Computing kpt #: 25 total cpu time spent up to now is 100.6 secs Computing kpt #: 26 total cpu time spent up to now is 103.1 secs Computing kpt #: 27 total cpu time spent up to now is 105.7 secs Computing kpt #: 28 total cpu time spent up to now is 108.3 secs Computing kpt #: 29 total cpu time spent up to now is 110.8 secs Computing kpt #: 30 total cpu time spent up to now is 113.3 secs Computing kpt #: 31 total cpu time spent up to now is 115.8 secs Computing kpt #: 32 total cpu time spent up to now is 118.2 secs Computing kpt #: 33 total cpu time spent up to now is 120.6 secs Computing kpt #: 34 total cpu time spent up to now is 123.1 secs Computing kpt #: 35 total cpu time spent up to now is 125.5 secs Computing kpt #: 36 total cpu 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secs Computing kpt #: 98 total cpu time spent up to now is 277.8 secs Computing kpt #: 99 total cpu time spent up to now is 279.9 secs Computing kpt #: 100 total cpu time spent up to now is 282.2 secs Computing kpt #: 101 total cpu time spent up to now is 284.3 secs Computing kpt #: 102 total cpu time spent up to now is 286.7 secs Computing kpt #: 103 total cpu time spent up to now is 289.2 secs Computing kpt #: 104 total cpu time spent up to now is 291.8 secs Computing kpt #: 105 total cpu time spent up to now is 294.2 secs Computing kpt #: 106 total cpu time spent up to now is 296.7 secs Computing kpt #: 107 total cpu time spent up to now is 299.3 secs Computing kpt #: 108 total cpu time spent up to now is 301.6 secs Computing kpt #: 109 total cpu time spent up to now is 303.9 secs Computing kpt #: 110 total cpu time spent up to now is 306.2 secs Computing kpt #: 111 total cpu time spent up to now is 308.4 secs Computing kpt #: 112 total cpu time spent up to now is 310.8 secs 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kpt #: 128 total cpu time spent up to now is 347.2 secs Computing kpt #: 129 total cpu time spent up to now is 349.5 secs Computing kpt #: 130 total cpu time spent up to now is 351.8 secs Computing kpt #: 131 total cpu time spent up to now is 354.3 secs Computing kpt #: 132 total cpu time spent up to now is 356.7 secs Computing kpt #: 133 total cpu time spent up to now is 359.1 secs Computing kpt #: 134 total cpu time spent up to now is 361.6 secs Computing kpt #: 135 total cpu time spent up to now is 364.0 secs Computing kpt #: 136 total cpu time spent up to now is 366.4 secs Computing kpt #: 137 total cpu time spent up to now is 368.8 secs Computing kpt #: 138 total cpu time spent up to now is 371.3 secs Computing kpt #: 139 total cpu time spent up to now is 373.8 secs Computing kpt #: 140 total cpu time spent up to now is 376.4 secs Computing kpt #: 141 total cpu time spent up to now is 378.9 secs Computing kpt #: 142 total cpu time spent up to now is 381.4 secs Computing kpt #: 143 total cpu time spent up to now is 384.0 secs Computing kpt #: 144 total cpu time spent up to now is 386.5 secs Computing kpt #: 145 total cpu time spent up to now is 389.1 secs Computing kpt #: 146 total cpu time spent up to now is 391.6 secs Computing kpt #: 147 total cpu time spent up to now is 394.1 secs Computing kpt #: 148 total cpu time spent up to now is 396.6 secs Computing kpt #: 149 total cpu time spent up to now is 399.1 secs Computing kpt #: 150 total cpu time spent up to now is 401.6 secs Computing kpt #: 151 total cpu time spent up to now is 404.1 secs Computing kpt #: 152 total cpu time spent up to now is 406.5 secs Computing kpt #: 153 total cpu time spent up to now is 408.9 secs Computing kpt #: 154 total cpu time spent up to now is 411.4 secs Computing kpt #: 155 total cpu time spent up to now is 413.6 secs Computing kpt #: 156 total cpu time spent up to now is 416.0 secs Computing kpt #: 157 total cpu time spent up to now is 418.2 secs Computing kpt #: 158 total cpu 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is 494.8 secs Computing kpt #: 189 total cpu time spent up to now is 497.6 secs Computing kpt #: 190 total cpu time spent up to now is 500.5 secs Computing kpt #: 191 total cpu time spent up to now is 503.0 secs Computing kpt #: 192 total cpu time spent up to now is 505.7 secs Computing kpt #: 193 total cpu time spent up to now is 508.3 secs Computing kpt #: 194 total cpu time spent up to now is 510.9 secs Computing kpt #: 195 total cpu time spent up to now is 513.6 secs Computing kpt #: 196 total cpu time spent up to now is 516.4 secs Computing kpt #: 197 total cpu time spent up to now is 519.0 secs Computing kpt #: 198 total cpu time spent up to now is 521.7 secs Computing kpt #: 199 total cpu time spent up to now is 524.4 secs Computing kpt #: 200 total cpu time spent up to now is 527.2 secs Computing kpt #: 201 total cpu time spent up to now is 529.9 secs Computing kpt #: 202 total cpu time spent up to now is 532.7 secs Computing kpt #: 203 total cpu time spent up to now is 535.4 secs Computing kpt #: 204 total cpu time spent up to now is 538.0 secs Computing kpt #: 205 total cpu time spent up to now is 540.3 secs Computing kpt #: 206 total cpu time spent up to now is 542.8 secs Computing kpt #: 207 total cpu time spent up to now is 545.3 secs Computing kpt #: 208 total cpu time spent up to now is 547.7 secs Computing kpt #: 209 total cpu time spent up to now is 550.2 secs Computing kpt #: 210 total cpu time spent up to now is 552.6 secs Computing kpt #: 211 total cpu time spent up to now is 555.1 secs Computing kpt #: 212 total cpu time spent up to now is 557.5 secs Computing kpt #: 213 total cpu time spent up to now is 560.0 secs Computing kpt #: 214 total cpu time spent up to now is 562.5 secs Computing kpt #: 215 total cpu time spent up to now is 564.9 secs Computing kpt #: 216 total cpu time spent up to now is 567.3 secs Computing kpt #: 217 total cpu time spent up to now is 569.8 secs Computing kpt #: 218 total cpu time spent up to now is 572.2 secs Computing kpt #: 219 total cpu time spent up to now is 574.6 secs Computing kpt #: 220 total cpu time spent up to now is 577.1 secs Computing kpt #: 221 total cpu time spent up to now is 579.5 secs Computing kpt #: 222 total cpu time spent up to now is 581.9 secs Computing kpt #: 223 total cpu time spent up to now is 584.2 secs Computing kpt #: 224 total cpu time spent up to now is 586.5 secs Computing kpt #: 225 total cpu time spent up to now is 588.9 secs Computing kpt #: 226 total cpu time spent up to now is 591.2 secs Computing kpt #: 227 total cpu time spent up to now is 593.7 secs Computing kpt #: 228 total cpu time spent up to now is 596.1 secs Computing kpt #: 229 total cpu time spent up to now is 598.6 secs Computing kpt #: 230 total cpu time spent up to now is 601.0 secs Computing kpt #: 231 total cpu time spent up to now is 603.5 secs Computing kpt #: 232 total cpu time spent up to now is 606.0 secs Computing kpt #: 233 total cpu time spent up to now is 608.4 secs Computing kpt #: 234 total cpu time spent up to now is 610.9 secs Computing kpt #: 235 total cpu time spent up to now is 613.4 secs Computing kpt #: 236 total cpu time spent up to now is 615.9 secs Computing kpt #: 237 total cpu time spent up to now is 618.3 secs Computing kpt #: 238 total cpu time spent up to now is 620.8 secs Computing kpt #: 239 total cpu time spent up to now is 623.2 secs Computing kpt #: 240 total cpu time spent up to now is 625.6 secs Computing kpt #: 241 total cpu time spent up to now is 627.9 secs Computing kpt #: 242 total cpu time spent up to now is 630.4 secs Computing kpt #: 243 total cpu time spent up to now is 632.8 secs Computing kpt #: 244 total cpu time spent up to now is 635.2 secs Computing kpt #: 245 total cpu time spent up to now is 637.6 secs Computing kpt #: 246 total cpu time spent up to now is 640.0 secs Computing kpt #: 247 total cpu time spent up to now is 642.4 secs Computing kpt #: 248 total cpu time spent up to now is 644.8 secs Computing kpt #: 249 total cpu time spent up to now is 647.2 secs Computing kpt #: 250 total cpu time spent up to now is 649.6 secs Computing kpt #: 251 total cpu time spent up to now is 652.0 secs Computing kpt #: 252 total cpu time spent up to now is 654.5 secs Computing kpt #: 253 total cpu time spent up to now is 656.9 secs Computing kpt #: 254 total cpu time spent up to now is 659.4 secs Computing kpt #: 255 total cpu time spent up to now is 661.9 secs Computing kpt #: 256 total cpu time spent up to now is 664.4 secs Computing kpt #: 257 total cpu time spent up to now is 667.0 secs Computing kpt #: 258 total cpu time spent up to now is 669.7 secs Computing kpt #: 259 total cpu time spent up to now is 672.3 secs Computing kpt #: 260 total cpu time spent up to now is 674.9 secs Computing kpt #: 261 total cpu time spent up to now is 677.6 secs Computing kpt #: 262 total cpu time spent up to now is 680.2 secs Computing kpt #: 263 total cpu time spent up to now is 682.7 secs Computing kpt #: 264 total cpu time spent up to now is 685.2 secs Computing kpt #: 265 total cpu time spent up to now is 687.9 secs Computing kpt #: 266 total cpu time spent up to now is 690.5 secs Computing kpt #: 267 total cpu time spent up to now is 693.0 secs Computing kpt #: 268 total cpu time spent up to now is 695.8 secs Computing kpt #: 269 total cpu time spent up to now is 698.3 secs Computing kpt #: 270 total cpu time spent up to now is 701.1 secs Computing kpt #: 271 total cpu time spent up to now is 703.6 secs Computing kpt #: 272 total cpu time spent up to now is 706.1 secs Computing kpt #: 273 total cpu time spent up to now is 708.6 secs Computing kpt #: 274 total cpu time spent up to now is 711.2 secs Computing kpt #: 275 total cpu time spent up to now is 713.8 secs Computing kpt #: 276 total cpu time spent up to now is 716.3 secs Computing kpt #: 277 total cpu time spent up to now is 718.8 secs Computing kpt #: 278 total cpu time spent up to now is 721.4 secs Computing kpt #: 279 total cpu time spent up to now is 724.0 secs Computing kpt #: 280 total cpu time spent up to now is 726.8 secs Computing kpt #: 281 total cpu time spent up to now is 729.7 secs Computing kpt #: 282 total cpu time spent up to now is 732.5 secs Computing kpt #: 283 total cpu time spent up to now is 735.3 secs Computing kpt #: 284 total cpu time spent up to now is 738.0 secs Computing kpt #: 285 total cpu time spent up to now is 741.6 secs Computing kpt #: 286 total cpu time spent up to now is 744.6 secs Computing kpt #: 287 total cpu time spent up to now is 747.2 secs Computing kpt #: 288 total cpu time spent up to now is 750.0 secs Computing kpt #: 289 total cpu time spent up to now is 752.7 secs Computing kpt #: 290 total cpu time spent up to now is 755.2 secs Computing kpt #: 291 total cpu time spent up to now is 757.8 secs Computing kpt #: 292 total cpu time spent up to now is 760.4 secs Computing kpt #: 293 total cpu time spent up to now is 763.0 secs Computing kpt #: 294 total cpu time spent up to now is 765.6 secs Computing kpt #: 295 total cpu time spent up to now is 768.2 secs Computing kpt #: 296 total cpu time spent up to now is 770.7 secs Computing kpt #: 297 total cpu time spent up to now is 773.2 secs Computing kpt #: 298 total cpu time spent up to now is 775.7 secs Computing kpt #: 299 total cpu time spent up to now is 778.1 secs Computing kpt #: 300 total cpu time spent up to now is 780.6 secs Computing kpt #: 301 total cpu time spent up to now is 782.9 secs Computing kpt #: 302 total cpu time spent up to now is 785.3 secs Computing kpt #: 303 total cpu time spent up to now is 787.4 secs Computing kpt #: 304 total cpu time spent up to now is 789.7 secs Computing kpt #: 305 total cpu time spent up to now is 792.1 secs Computing kpt #: 306 total cpu time spent up to now is 794.4 secs Computing kpt #: 307 total cpu time spent up to now is 796.6 secs Computing kpt #: 308 total cpu time spent up to now is 799.0 secs Computing kpt #: 309 total cpu time spent up to now is 801.3 secs Computing kpt #: 310 total cpu time spent up to now is 803.6 secs Computing kpt #: 311 total cpu time spent up to now is 806.0 secs Computing kpt #: 312 total cpu time spent up to now is 808.3 secs Computing kpt #: 313 total cpu time spent up to now is 810.7 secs Computing kpt #: 314 total cpu time spent up to now is 813.3 secs Computing kpt #: 315 total cpu time spent up to now is 815.7 secs Computing kpt #: 316 total cpu time spent up to now is 818.3 secs Computing kpt #: 317 total cpu time spent up to now is 821.1 secs Computing kpt #: 318 total cpu time spent up to now is 823.7 secs Computing kpt #: 319 total cpu time spent up to now is 826.3 secs Computing kpt #: 320 total cpu time spent up to now is 828.5 secs Computing kpt #: 321 total cpu time spent up to now is 830.7 secs Computing kpt #: 322 total cpu time spent up to now is 833.0 secs Computing kpt #: 323 total cpu time spent up to now is 835.4 secs Computing kpt #: 324 total cpu time spent up to now is 837.8 secs Computing kpt #: 325 total cpu time spent up to now is 840.0 secs Computing kpt #: 326 total cpu time spent up to now is 842.2 secs Computing kpt #: 327 total cpu time spent up to now is 844.5 secs Computing kpt #: 328 total cpu time spent up to now is 846.8 secs Computing kpt #: 329 total cpu time spent up to now is 849.1 secs Computing kpt #: 330 total cpu time spent up to now is 851.5 secs Computing kpt #: 331 total cpu time spent up to now is 853.7 secs Computing kpt #: 332 total cpu time spent up to now is 855.9 secs Computing kpt #: 333 total cpu time spent up to now is 858.2 secs Computing kpt #: 334 total cpu time spent up to now is 860.5 secs Computing kpt #: 335 total cpu time spent up to now is 862.8 secs Computing kpt #: 336 total cpu time spent up to now is 865.3 secs Computing kpt #: 337 total cpu time spent up to now is 867.7 secs Computing kpt #: 338 total cpu time spent up to now is 870.1 secs Computing kpt #: 339 total cpu time spent up to now is 872.4 secs Computing kpt #: 340 total cpu time spent up to now is 874.7 secs Computing kpt #: 341 total cpu time spent up to now is 877.2 secs Computing kpt #: 342 total cpu time spent up to now is 879.5 secs Computing kpt #: 343 total cpu time spent up to now is 881.9 secs Computing kpt #: 344 total cpu time spent up to now is 884.2 secs Computing kpt #: 345 total cpu time spent up to now is 886.6 secs Computing kpt #: 346 total cpu time spent up to now is 888.9 secs Computing kpt #: 347 total cpu time spent up to now is 891.3 secs Computing kpt #: 348 total cpu time spent up to now is 893.8 secs Computing kpt #: 349 total cpu time spent up to now is 896.2 secs Computing kpt #: 350 total cpu time spent up to now is 898.8 secs Computing kpt #: 351 total cpu time spent up to now is 901.2 secs Computing kpt #: 352 total cpu time spent up to now is 903.7 secs Computing kpt #: 353 total cpu time spent up to now is 906.1 secs Computing kpt #: 354 total cpu time spent up to now is 908.6 secs Computing kpt #: 355 total cpu time spent up to now is 911.0 secs Computing kpt #: 356 total cpu time spent up to now is 913.5 secs Computing kpt #: 357 total cpu time spent up to now is 916.0 secs Computing kpt #: 358 total cpu time spent up to now is 918.4 secs Computing kpt #: 359 total cpu time spent up to now is 920.7 secs Computing kpt #: 360 total cpu time spent up to now is 923.0 secs Computing kpt #: 361 total cpu time spent up to now is 925.4 secs Computing kpt #: 362 total cpu time spent up to now is 927.8 secs Computing kpt #: 363 total cpu time spent up to now is 930.2 secs Computing kpt #: 364 total cpu time spent up to now is 932.6 secs Computing kpt #: 365 total cpu time spent up to now is 935.0 secs Computing kpt #: 366 total cpu time spent up to now is 937.2 secs Computing kpt #: 367 total cpu time spent up to now is 939.5 secs Computing kpt #: 368 total cpu time spent up to now is 941.8 secs Computing kpt #: 369 total cpu time spent up to now is 944.1 secs Computing kpt #: 370 total cpu time spent up to now is 946.3 secs Computing kpt #: 371 total cpu time spent up to now is 948.6 secs Computing kpt #: 372 total cpu time spent up to now is 950.9 secs Computing kpt #: 373 total cpu time spent up to now is 953.1 secs Computing kpt #: 374 total cpu time spent up to now is 955.4 secs Computing kpt #: 375 total cpu time spent up to now is 957.6 secs Computing kpt #: 376 total cpu time spent up to now is 959.9 secs Computing kpt #: 377 total cpu time spent up to now is 962.2 secs Computing kpt #: 378 total cpu time spent up to now is 964.4 secs Computing kpt #: 379 total cpu time spent up to now is 966.8 secs Computing kpt #: 380 total cpu time spent up to now is 969.2 secs Computing kpt #: 381 total cpu time spent up to now is 971.6 secs Computing kpt #: 382 total cpu time spent up to now is 974.0 secs Computing kpt #: 383 total cpu time spent up to now is 976.3 secs Computing kpt #: 384 total cpu time spent up to now is 978.7 secs Computing kpt #: 385 total cpu time spent up to now is 981.1 secs Computing kpt #: 386 total cpu time spent up to now is 983.6 secs Computing kpt #: 387 total cpu time spent up to now is 986.3 secs Computing kpt #: 388 total cpu time spent up to now is 988.7 secs Computing kpt #: 389 total cpu time spent up to now is 991.4 secs Computing kpt #: 390 total cpu time spent up to now is 993.9 secs Computing kpt #: 391 total cpu time spent up to now is 996.6 secs Computing kpt #: 392 total cpu time spent up to now is 999.2 secs Computing kpt #: 393 total cpu time spent up to now is 1001.7 secs Computing kpt #: 394 total cpu time spent up to now is 1004.2 secs Computing kpt #: 395 total cpu time spent up to now is 1006.7 secs Computing kpt #: 396 total cpu time spent up to now is 1009.2 secs Computing kpt #: 397 total cpu time spent up to now is 1011.6 secs ethr = 2.08E-11, avg # of iterations = 44.8 total cpu time spent up to now is 1011.8 secs End of band structure calculation k = 0.5000-0.0000-0.0000 ( 2468 PWs) bands (ev): -11.4791 -11.4791 -10.4686 -10.4686 -9.7944 -9.7944 -5.2937 -5.2937 -3.3517 -3.3517 -2.8382 -2.8382 -0.3155 -0.3155 0.8215 0.8215 1.3308 1.3308 2.5324 2.5324 3.5198 3.5198 4.5324 4.5324 5.9612 5.9612 6.3515 6.3515 6.3984 6.3984 7.9730 7.9730 8.1680 8.1680 9.1589 9.1589 9.9484 9.9484 11.5717 11.5717 11.7418 11.7418 12.3305 12.3305 12.6667 12.6667 13.2216 13.2216 15.3380 15.3380 16.1219 16.1219 18.0713 18.0713 19.3660 19.3660 20.9975 20.9975 k = 0.4912-0.0000-0.0000 ( 2472 PWs) bands (ev): -11.4816 -11.4815 -10.4683 -10.4682 -9.7936 -9.7935 -5.2945 -5.2945 -3.3535 -3.3534 -2.8367 -2.8366 -0.3137 -0.3137 0.8217 0.8222 1.3323 1.3328 2.5313 2.5315 3.5196 3.5202 4.5325 4.5329 5.9613 5.9614 6.3412 6.3453 6.4042 6.4082 7.9739 7.9741 8.1683 8.1686 9.1608 9.1611 9.9482 9.9485 11.5711 11.5715 11.7418 11.7422 12.3258 12.3264 12.6715 12.6723 13.2215 13.2216 15.3377 15.3379 16.1229 16.1230 18.0721 18.0723 19.3652 19.3655 20.9977 20.9979 k = 0.4825-0.0000-0.0000 ( 2462 PWs) bands (ev): -11.4887 -11.4885 -10.4674 -10.4671 -9.7911 -9.7908 -5.2968 -5.2967 -3.3586 -3.3584 -2.8324 -2.8321 -0.3084 -0.3084 0.8226 0.8237 1.3373 1.3382 2.5283 2.5289 3.5197 3.5210 4.5330 4.5339 5.9616 5.9620 6.3233 6.3287 6.4197 6.4248 7.9768 7.9773 8.1697 8.1703 9.1668 9.1675 9.9478 9.9484 11.5699 11.5708 11.7422 11.7430 12.3131 12.3142 12.6859 12.6873 13.2213 13.2215 15.3373 15.3377 16.1259 16.1262 18.0749 18.0753 19.3635 19.3640 20.9985 20.9990 k = 0.4737-0.0000-0.0000 ( 2454 PWs) bands (ev): -11.5004 -11.5000 -10.4659 -10.4655 -9.7868 -9.7865 -5.3007 -5.3005 -3.3669 -3.3665 -2.8253 -2.8249 -0.2996 -0.2995 0.8245 0.8261 1.3455 1.3468 2.5235 2.5244 3.5201 3.5220 4.5341 4.5354 5.9623 5.9629 6.3028 6.3088 6.4376 6.4430 7.9818 7.9826 8.1722 8.1730 9.1769 9.1779 9.9473 9.9481 11.5681 11.5693 11.7430 11.7442 12.2942 12.2957 12.7081 12.7100 13.2210 13.2214 15.3367 15.3371 16.1309 16.1313 18.0795 18.0801 19.3606 19.3614 20.9999 21.0006 k = 0.4649-0.0000-0.0000 ( 2454 PWs) bands (ev): -11.5165 -11.5160 -10.4642 -10.4636 -9.7808 -9.7804 -5.3060 -5.3058 -3.3780 -3.3776 -2.8158 -2.8153 -0.2872 -0.2871 0.8275 0.8295 1.3568 1.3584 2.5171 2.5182 3.5207 3.5233 4.5357 4.5374 5.9632 5.9640 6.2814 6.2877 6.4560 6.4616 7.9887 7.9897 8.1758 8.1769 9.1909 9.1923 9.9467 9.9478 11.5657 11.5673 11.7441 11.7456 12.2711 12.2729 12.7359 12.7382 13.2206 13.2212 15.3357 15.3363 16.1379 16.1385 18.0860 18.0867 19.3564 19.3575 21.0018 21.0027 k = 0.4561-0.0000-0.0000 ( 2454 PWs) bands (ev): -11.5365 -11.5359 -10.4623 -10.4617 -9.7732 -9.7726 -5.3128 -5.3125 -3.3917 -3.3912 -2.8042 -2.8036 -0.2714 -0.2712 0.8316 0.8341 1.3708 1.3728 2.5092 2.5106 3.5216 3.5248 4.5378 4.5399 5.9643 5.9652 6.2594 6.2659 6.4744 6.4799 7.9975 7.9987 8.1808 8.1822 9.2086 9.2104 9.9461 9.9474 11.5628 11.5648 11.7455 11.7473 12.2457 12.2476 12.7677 12.7703 13.2203 13.2211 15.3344 15.3352 16.1469 16.1476 18.0941 18.0951 19.3511 19.3525 21.0043 21.0055 k = 0.4474-0.0000-0.0000 ( 2466 PWs) bands (ev): -11.5603 -11.5596 -10.4606 -10.4599 -9.7639 -9.7633 -5.3210 -5.3207 -3.4075 -3.4070 -2.7909 -2.7902 -0.2522 -0.2520 0.8371 0.8400 1.3873 1.3896 2.5000 2.5017 3.5227 3.5264 4.5403 4.5428 5.9654 5.9666 6.2371 6.2439 6.4924 6.4980 8.0079 8.0092 8.1874 8.1889 9.2298 9.2319 9.9455 9.9471 11.5595 11.5617 11.7470 11.7491 12.2189 12.2210 12.8022 12.8051 13.2201 13.2210 15.3327 15.3336 16.1577 16.1585 18.1038 18.1050 19.3445 19.3461 21.0074 21.0088 k = 0.4386-0.0000-0.0000 ( 2466 PWs) bands (ev): -11.5874 -11.5866 -10.4594 -10.4586 -9.7530 -9.7522 -5.3306 -5.3303 -3.4252 -3.4246 -2.7761 -2.7753 -0.2296 -0.2293 0.8442 0.8474 1.4058 1.4084 2.4899 2.4918 3.5239 3.5282 4.5434 4.5463 5.9665 5.9679 6.2146 6.2218 6.5101 6.5156 8.0197 8.0213 8.1957 8.1974 9.2542 9.2566 9.9451 9.9470 11.5559 11.5584 11.7486 11.7509 12.1918 12.1940 12.8384 12.8415 13.2202 13.2213 15.3307 15.3317 16.1703 16.1713 18.1151 18.1164 19.3366 19.3385 21.0113 21.0129 k = 0.4298-0.0000-0.0000 ( 2462 PWs) bands (ev): -11.6175 -11.6166 -10.4589 -10.4581 -9.7406 -9.7397 -5.3416 -5.3412 -3.4444 -3.4437 -2.7603 -2.7594 -0.2037 -0.2034 0.8530 0.8565 1.4259 1.4288 2.4792 2.4814 3.5253 3.5301 4.5470 4.5503 5.9674 5.9691 6.1923 6.1998 6.5273 6.5327 8.0328 8.0345 8.2060 8.2078 9.2815 9.2842 9.9450 9.9473 11.5520 11.5547 11.7500 11.7525 12.1651 12.1672 12.8755 12.8789 13.2207 13.2221 15.3281 15.3293 16.1846 16.1858 18.1277 18.1292 19.3274 19.3296 21.0158 21.0176 k = 0.4211-0.0000-0.0000 ( 2458 PWs) bands (ev): -11.6502 -11.6493 -10.4592 -10.4584 -9.7268 -9.7258 -5.3538 -5.3534 -3.4649 -3.4641 -2.7437 -2.7427 -0.1746 -0.1743 0.8636 0.8674 1.4472 1.4503 2.4682 2.4706 3.5269 3.5322 4.5511 4.5547 5.9677 5.9698 6.1704 6.1783 6.5439 6.5494 8.0470 8.0487 8.2186 8.2205 9.3113 9.3143 9.9456 9.9482 11.5480 11.5508 11.7513 11.7539 12.1392 12.1414 12.9128 12.9165 13.2219 13.2236 15.3250 15.3263 16.2006 16.2018 18.1414 18.1431 19.3169 19.3194 21.0210 21.0230 k = 0.4123-0.0000-0.0000 ( 2458 PWs) bands (ev): -11.6851 -11.6842 -10.4607 -10.4598 -9.7117 -9.7106 -5.3673 -5.3669 -3.4863 -3.4855 -2.7265 -2.7255 -0.1423 -0.1420 0.8763 0.8804 1.4690 1.4723 2.4574 2.4600 3.5286 3.5343 4.5557 4.5597 5.9673 5.9697 6.1492 6.1575 6.5601 6.5655 8.0618 8.0636 8.2337 8.2356 9.3431 9.3465 9.9468 9.9498 11.5440 11.5469 11.7521 11.7548 12.1146 12.1168 12.9495 12.9535 13.2242 13.2263 15.3213 15.3226 16.2179 16.2193 18.1559 18.1578 19.3051 19.3079 21.0269 21.0291 k = 0.4035-0.0000-0.0000 ( 2466 PWs) bands (ev): -11.7221 -11.7211 -10.4633 -10.4624 -9.6955 -9.6942 -5.3819 -5.3815 -3.5085 -3.5077 -2.7090 -2.7080 -0.1071 -0.1067 0.8911 0.8954 1.4910 1.4944 2.4472 2.4500 3.5304 3.5365 4.5608 4.5652 5.9655 5.9684 6.1293 6.1381 6.5756 6.5810 8.0772 8.0789 8.2515 8.2533 9.3765 9.3803 9.9491 9.9525 11.5399 11.5429 11.7522 11.7549 12.0918 12.0940 12.9848 12.9892 13.2283 13.2309 15.3167 15.3182 16.2365 16.2381 18.1710 18.1730 19.2921 19.2951 21.0335 21.0359 k = 0.3947-0.0000-0.0000 ( 2468 PWs) bands (ev): -11.7606 -11.7597 -10.4671 -10.4663 -9.6782 -9.6769 -5.3977 -5.3972 -3.5313 -3.5304 -2.6914 -2.6903 -0.0689 -0.0685 0.9081 0.9126 1.5125 1.5161 2.4380 2.4410 3.5324 3.5389 4.5665 4.5712 5.9618 5.9651 6.1112 6.1205 6.5906 6.5960 8.0929 8.0945 8.2722 8.2738 9.4110 9.4151 9.9527 9.9566 11.5360 11.5389 11.7513 11.7542 12.0712 12.0734 13.0175 13.0224 13.2352 13.2383 15.3113 15.3129 16.2563 16.2579 18.1863 18.1885 19.2780 19.2814 21.0407 21.0433 k = 0.3860-0.0000-0.0000 ( 2470 PWs) bands (ev): -11.8006 -11.7996 -10.4722 -10.4714 -9.6602 -9.6587 -5.4144 -5.4139 -3.5545 -3.5537 -2.6737 -2.6726 -0.0279 -0.0274 0.9274 0.9320 1.5329 1.5366 2.4303 2.4335 3.5346 3.5414 4.5728 4.5779 5.9556 5.9592 6.0957 6.1054 6.6049 6.6103 8.1087 8.1102 8.2958 8.2972 9.4459 9.4504 9.9580 9.9625 11.5323 11.5352 11.7493 11.7522 12.0533 12.0555 13.0464 13.0517 13.2460 13.2496 15.3049 15.3066 16.2769 16.2787 18.2014 18.2038 19.2633 19.2670 21.0486 21.0513 k = 0.3772-0.0000-0.0000 ( 2472 PWs) bands (ev): -11.8417 -11.8407 -10.4786 -10.4778 -9.6415 -9.6399 -5.4321 -5.4316 -3.5781 -3.5772 -2.6562 -2.6551 0.0158 0.0163 0.9490 0.9537 1.5519 1.5557 2.4246 2.4280 3.5370 3.5441 4.5797 4.5852 5.9463 5.9500 6.0836 6.0934 6.6186 6.6239 8.1246 8.1260 8.3222 8.3235 9.4806 9.4855 9.9656 9.9706 11.5288 11.5316 11.7458 11.7488 12.0385 12.0408 13.0701 13.0756 13.2621 13.2661 15.2975 15.2992 16.2982 16.3001 18.2158 18.2183 19.2482 19.2522 21.0570 21.0598 k = 0.3684-0.0000-0.0000 ( 2466 PWs) bands (ev): -11.8836 -11.8827 -10.4862 -10.4854 -9.6223 -9.6207 -5.4507 -5.4502 -3.6019 -3.6010 -2.6390 -2.6378 0.0621 0.0627 0.9728 0.9776 1.5688 1.5727 2.4214 2.4250 3.5397 3.5471 4.5874 4.5932 5.9336 5.9372 6.0750 6.0848 6.6316 6.6369 8.1404 8.1417 8.3513 8.3526 9.5144 9.5198 9.9758 9.9814 11.5256 11.5284 11.7405 11.7436 12.0271 12.0296 13.0880 13.0934 13.2841 13.2882 15.2888 15.2906 16.3199 16.3220 18.2290 18.2316 19.2334 19.2376 21.0657 21.0686 k = 0.3596-0.0000-0.0000 ( 2462 PWs) bands (ev): -11.9263 -11.9253 -10.4950 -10.4942 -9.6029 -9.6012 -5.4701 -5.4695 -3.6258 -3.6248 -2.6220 -2.6208 0.1109 0.1115 0.9989 1.0036 1.5834 1.5873 2.4210 2.4247 3.5428 3.5503 4.5959 4.6020 5.9179 5.9213 6.0697 6.0791 6.6439 6.6491 8.1562 8.1575 8.3831 8.3843 9.5467 9.5525 9.9892 9.9953 11.5229 11.5256 11.7333 11.7366 12.0196 12.0223 13.1002 13.1055 13.3116 13.3157 15.2787 15.2806 16.3418 16.3440 18.2401 18.2429 19.2194 19.2240 21.0744 21.0774 k = 0.3509-0.0000-0.0000 ( 2462 PWs) bands (ev): -11.9695 -11.9685 -10.5049 -10.5041 -9.5833 -9.5815 -5.4902 -5.4896 -3.6497 -3.6487 -2.6055 -2.6043 0.1619 0.1626 1.0270 1.0318 1.5953 1.5992 2.4237 2.4274 3.5462 3.5539 4.6052 4.6116 5.8997 5.9028 6.0669 6.0760 6.6553 6.6606 8.1719 8.1731 8.4173 8.4186 9.5767 9.5829 10.0062 10.0128 11.5205 11.5232 11.7243 11.7278 12.0160 12.0190 13.1079 13.1128 13.3435 13.3474 15.2671 15.2690 16.3635 16.3658 18.2487 18.2516 19.2071 19.2119 21.0828 21.0859 k = 0.3421-0.0000-0.0000 ( 2458 PWs) bands (ev): -12.0130 -12.0121 -10.5158 -10.5150 -9.5637 -9.5619 -5.5109 -5.5103 -3.6735 -3.6726 -2.5895 -2.5883 0.2151 0.2158 1.0571 1.0618 1.6044 1.6082 2.4296 2.4334 3.5500 3.5579 4.6154 4.6222 5.8797 5.8825 6.0659 6.0746 6.6660 6.6712 8.1875 8.1887 8.4538 8.4552 9.6040 9.6105 10.0271 10.0342 11.5187 11.5212 11.7134 11.7173 12.0165 12.0198 13.1122 13.1168 13.3783 13.3820 15.2537 15.2558 16.3847 16.3871 18.2538 18.2568 19.1973 19.2025 21.0903 21.0934 k = 0.3333-0.0000-0.0000 ( 2464 PWs) bands (ev): -12.0567 -12.0558 -10.5276 -10.5268 -9.5443 -9.5424 -5.5321 -5.5315 -3.6973 -3.6964 -2.5741 -2.5728 0.2702 0.2710 1.0889 1.0935 1.6108 1.6146 2.4387 2.4425 3.5543 3.5623 4.6267 4.6337 5.8585 5.8611 6.0662 6.0745 6.6758 6.6809 8.2030 8.2042 8.4923 8.4939 9.6283 9.6351 10.0520 10.0595 11.5173 11.5199 11.7011 11.7054 12.0210 12.0246 13.1141 13.1184 13.4149 13.4184 15.2385 15.2406 16.4050 16.4076 18.2546 18.2578 19.1911 19.1965 21.0963 21.0994 k = 0.3246-0.0000-0.0000 ( 2464 PWs) bands (ev): -12.1004 -12.0996 -10.5403 -10.5395 -9.5252 -9.5233 -5.5539 -5.5532 -3.7209 -3.7200 -2.5592 -2.5579 0.3271 0.3280 1.1222 1.1267 1.6149 1.6185 2.4510 2.4548 3.5591 3.5672 4.6391 4.6465 5.8365 5.8391 6.0672 6.0753 6.6846 6.6898 8.2183 8.2194 8.5328 8.5345 9.6496 9.6565 10.0807 10.0885 11.5164 11.5191 11.6877 11.6924 12.0294 12.0333 13.1144 13.1184 13.4524 13.4558 15.2212 15.2235 16.4242 16.4269 18.2508 18.2541 19.1893 19.1949 21.0999 21.1029 k = 0.3158-0.0000-0.0000 ( 2460 PWs) bands (ev): -12.1441 -12.1432 -10.5537 -10.5530 -9.5064 -9.5045 -5.5760 -5.5753 -3.7443 -3.7434 -2.5450 -2.5436 0.3855 0.3866 1.1566 1.1609 1.6171 1.6205 2.4662 2.4699 3.5645 3.5726 4.6528 4.6604 5.8142 5.8168 6.0686 6.0765 6.6926 6.6977 8.2332 8.2344 8.5751 8.5770 9.6680 9.6750 10.1128 10.1208 11.5160 11.5189 11.6736 11.6788 12.0416 12.0458 13.1135 13.1173 13.4905 13.4938 15.2017 15.2041 16.4418 16.4446 18.2418 18.2452 19.1927 19.1985 21.1000 21.1028 k = 0.3070-0.0000-0.0000 ( 2454 PWs) bands (ev): -12.1875 -12.1867 -10.5678 -10.5671 -9.4881 -9.4861 -5.5984 -5.5977 -3.7675 -3.7665 -2.5314 -2.5300 0.4452 0.4464 1.1917 1.1956 1.6181 1.6213 2.4840 2.4876 3.5704 3.5784 4.6678 4.6757 5.7919 5.7945 6.0702 6.0780 6.6995 6.7046 8.2478 8.2490 8.6190 8.6210 9.6839 9.6909 10.1476 10.1557 11.5159 11.5192 11.6592 11.6650 12.0574 12.0619 13.1118 13.1154 13.5285 13.5318 15.1798 15.1823 16.4574 16.4604 18.2273 18.2309 19.2018 19.2079 21.0954 21.0979 k = 0.2982-0.0000-0.0000 ( 2452 PWs) bands (ev): -12.2306 -12.2298 -10.5825 -10.5818 -9.4704 -9.4684 -5.6210 -5.6204 -3.7904 -3.7894 -2.5184 -2.5171 0.5059 0.5072 1.2267 1.2302 1.6190 1.6219 2.5040 2.5075 3.5767 3.5847 4.6842 4.6924 5.7699 5.7725 6.0718 6.0795 6.7054 6.7104 8.2619 8.2630 8.6643 8.6665 9.6978 9.7047 10.1845 10.1926 11.5160 11.5199 11.6449 11.6515 12.0768 12.0815 13.1094 13.1129 13.5663 13.5695 15.1554 15.1581 16.4707 16.4738 18.2077 18.2113 19.2170 19.2233 21.0847 21.0869 k = 0.2895-0.0000-0.0000 ( 2452 PWs) bands (ev): -12.2733 -12.2725 -10.5976 -10.5969 -9.4533 -9.4512 -5.6438 -5.6432 -3.8129 -3.8119 -2.5062 -2.5049 0.5671 0.5686 1.2609 1.2639 1.6209 1.6234 2.5260 2.5293 3.5836 3.5915 4.7021 4.7106 5.7483 5.7511 6.0733 6.0810 6.7102 6.7152 8.2753 8.2764 8.7108 8.7132 9.7100 9.7169 10.2227 10.2307 11.5160 11.5207 11.6313 11.6387 12.0997 12.1046 13.1066 13.1099 13.6036 13.6068 15.1283 15.1311 16.4813 16.4845 18.1831 18.1869 19.2383 19.2447 21.0667 21.0686 k = 0.2807-0.0000-0.0000 ( 2452 PWs) bands (ev): -12.3155 -12.3147 -10.6131 -10.6125 -9.4368 -9.4348 -5.6667 -5.6661 -3.8351 -3.8341 -2.4946 -2.4933 0.6285 0.6302 1.2935 1.2960 1.6252 1.6272 2.5495 2.5528 3.5908 3.5986 4.7214 4.7301 5.7275 5.7304 6.0747 6.0823 6.7138 6.7188 8.2879 8.2891 8.7585 8.7611 9.7211 9.7279 10.2616 10.2695 11.5157 11.5213 11.6189 11.6272 12.1260 12.1311 13.1033 13.1066 13.6402 13.6434 15.0984 15.1013 16.4888 16.4921 18.1543 18.1582 19.2655 19.2720 21.0405 21.0422 k = 0.2719-0.0000-0.0000 ( 2450 PWs) bands (ev): -12.3571 -12.3563 -10.6290 -10.6284 -9.4211 -9.4190 -5.6895 -5.6889 -3.8569 -3.8559 -2.4838 -2.4825 0.6892 0.6912 1.3234 1.3257 1.6330 1.6349 2.5745 2.5778 3.5982 3.6059 4.7421 4.7511 5.7076 5.7107 6.0758 6.0834 6.7164 6.7212 8.2997 8.3008 8.8071 8.8098 9.7314 9.7381 10.3006 10.3084 11.5144 11.5210 11.6086 11.6179 12.1558 12.1610 13.0998 13.1030 13.6760 13.6792 15.0656 15.0687 16.4929 16.4963 18.1221 18.1260 19.2982 19.3048 21.0058 21.0077 k = 0.2632-0.0000-0.0000 ( 2452 PWs) bands (ev): -12.3979 -12.3973 -10.6451 -10.6445 -9.4061 -9.4040 -5.7124 -5.7117 -3.8782 -3.8773 -2.4736 -2.4723 0.7486 0.7508 1.3500 1.3527 1.6456 1.6476 2.6008 2.6040 3.6059 3.6134 4.7641 4.7734 5.6890 5.6922 6.0766 6.0842 6.7177 6.7225 8.3105 8.3116 8.8564 8.8592 9.7410 9.7477 10.3392 10.3469 11.5115 11.5189 11.6015 11.6114 12.1890 12.1943 13.0960 13.0992 13.7108 13.7140 15.0299 15.0332 16.4935 16.4969 18.0872 18.0912 19.3361 19.3427 20.9631 20.9654 k = 0.2544-0.0000-0.0000 ( 2446 PWs) bands (ev): -12.4381 -12.4374 -10.6613 -10.6607 -9.3918 -9.3898 -5.7350 -5.7344 -3.8992 -3.8982 -2.4641 -2.4628 0.8055 0.8081 1.3737 1.3772 1.6635 1.6660 2.6282 2.6315 3.6137 3.6209 4.7872 4.7968 5.6718 5.6752 6.0771 6.0848 6.7178 6.7226 8.3202 8.3213 8.9062 8.9092 9.7504 9.7570 10.3770 10.3846 11.5066 11.5141 11.5985 11.6084 12.2256 12.2309 13.0920 13.0951 13.7445 13.7477 14.9913 14.9948 16.4901 16.4936 18.0505 18.0545 19.3785 19.3851 20.9134 20.9163 k = 0.2456-0.0000-0.0000 ( 2445 PWs) bands (ev): -12.4774 -12.4767 -10.6777 -10.6771 -9.3783 -9.3763 -5.7575 -5.7569 -3.9196 -3.9187 -2.4553 -2.4540 0.8587 0.8615 1.3958 1.4003 1.6867 1.6898 2.6569 2.6604 3.6214 3.6284 4.8112 4.8210 5.6566 5.6601 6.0773 6.0850 6.7168 6.7215 8.3288 8.3298 8.9563 8.9594 9.7595 9.7661 10.4138 10.4211 11.4994 11.5066 11.5998 11.6092 12.2654 12.2706 13.0878 13.0909 13.7768 13.7801 14.9498 14.9535 16.4828 16.4863 18.0127 18.0166 19.4249 19.4315 20.8583 20.8617 k = 0.2368-0.0000-0.0000 ( 2447 PWs) bands (ev): -12.5158 -12.5152 -10.6940 -10.6934 -9.3657 -9.3637 -5.7797 -5.7791 -3.9396 -3.9387 -2.4472 -2.4459 0.9063 0.9095 1.4188 1.4241 1.7144 1.7180 2.6869 2.6906 3.6290 3.6357 4.8356 4.8456 5.6435 5.6472 6.0771 6.0849 6.7145 6.7192 8.3361 8.3370 9.0064 9.0096 9.7686 9.7751 10.4492 10.4564 11.4905 11.4969 11.6049 11.6135 12.3082 12.3134 13.0834 13.0865 13.8078 13.8111 14.9056 14.9095 16.4714 16.4750 17.9743 17.9782 19.4746 19.4810 20.7993 20.8033 k = 0.2281-0.0000-0.0000 ( 2451 PWs) bands (ev): -12.5532 -12.5527 -10.7103 -10.7097 -9.3537 -9.3518 -5.8016 -5.8010 -3.9591 -3.9582 -2.4397 -2.4384 0.9469 0.9502 1.4452 1.4513 1.7453 1.7493 2.7184 2.7223 3.6363 3.6428 4.8600 4.8702 5.6330 5.6370 6.0766 6.0845 6.7110 6.7156 8.3421 8.3430 9.0563 9.0597 9.7777 9.7843 10.4830 10.4900 11.4802 11.4858 11.6133 11.6209 12.3539 12.3591 13.0789 13.0820 13.8371 13.8406 14.8589 14.8631 16.4560 16.4596 17.9360 17.9398 19.5267 19.5329 20.7383 20.7428 k = 0.2193-0.0000-0.0000 ( 2449 PWs) bands (ev): -12.5897 -12.5891 -10.7265 -10.7259 -9.3426 -9.3406 -5.8231 -5.8225 -3.9780 -3.9771 -2.4328 -2.4316 0.9790 0.9824 1.4775 1.4841 1.7780 1.7823 2.7515 2.7557 3.6434 3.6496 4.8838 4.8941 5.6256 5.6298 6.0758 6.0839 6.7063 6.7109 8.3468 8.3477 9.1057 9.1092 9.7869 9.7935 10.5153 10.5221 11.4691 11.4739 11.6242 11.6310 12.4023 12.4073 13.0742 13.0774 13.8646 13.8682 14.8100 14.8145 16.4367 16.4402 17.8982 17.9019 19.5803 19.5861 20.6770 20.6822 k = 0.2105-0.0000-0.0000 ( 2449 PWs) bands (ev): -12.6251 -12.6245 -10.7425 -10.7419 -9.3322 -9.3303 -5.8441 -5.8436 -3.9963 -3.9955 -2.4265 -2.4253 1.0020 1.0053 1.5171 1.5239 1.8114 1.8159 2.7864 2.7910 3.6501 3.6561 4.9063 4.9166 5.6219 5.6263 6.0748 6.0830 6.7005 6.7051 8.3501 8.3511 9.1543 9.1579 9.7964 9.8030 10.5458 10.5524 11.4576 11.4617 11.6374 11.6434 12.4530 12.4579 13.0694 13.0726 13.8901 13.8939 14.7593 14.7641 16.4137 16.4172 17.8611 17.8647 19.6338 19.6392 20.6178 20.6235 k = 0.2018-0.0000-0.0000 ( 2449 PWs) bands (ev): -12.6593 -12.6588 -10.7582 -10.7577 -9.3225 -9.3206 -5.8647 -5.8642 -4.0141 -4.0133 -2.4207 -2.4196 1.0164 1.0195 1.5638 1.5708 1.8445 1.8491 2.8233 2.8283 3.6564 3.6621 4.9268 4.9371 5.6221 5.6268 6.0736 6.0819 6.6936 6.6982 8.3522 8.3531 9.2017 9.2055 9.8061 9.8128 10.5745 10.5809 11.4459 11.4495 11.6526 11.6580 12.5058 12.5104 13.0644 13.0678 13.9131 13.9173 14.7074 14.7126 16.3872 16.3906 17.8250 17.8284 19.6855 19.6902 20.5630 20.5694 k = 0.1930-0.0000-0.0000 ( 2447 PWs) bands (ev): -12.6924 -12.6920 -10.7737 -10.7732 -9.3135 -9.3117 -5.8848 -5.8843 -4.0313 -4.0305 -2.4155 -2.4144 1.0234 1.0261 1.6168 1.6239 1.8767 1.8815 2.8623 2.8676 3.6624 3.6679 4.9445 4.9547 5.6267 5.6317 6.0722 6.0807 6.6857 6.6903 8.3530 8.3539 9.2476 9.2515 9.8162 9.8230 10.6015 10.6077 11.4342 11.4373 11.6697 11.6745 12.5603 12.5646 13.0594 13.0629 13.9335 13.9380 14.6550 14.6606 16.3575 16.3609 17.7899 17.7933 19.7325 19.7364 20.5159 20.5232 k = 0.1842-0.0000-0.0000 ( 2439 PWs) bands (ev): -12.7243 -12.7239 -10.7888 -10.7884 -9.3052 -9.3035 -5.9042 -5.9037 -4.0478 -4.0470 -2.4109 -2.4098 1.0245 1.0269 1.6745 1.6818 1.9075 1.9125 2.9034 2.9091 3.6681 3.6733 4.9590 4.9690 5.6359 5.6412 6.0707 6.0794 6.6770 6.6815 8.3525 8.3535 9.2916 9.2956 9.8269 9.8337 10.6268 10.6327 11.4227 11.4254 11.6886 11.6929 12.6160 12.6199 13.0544 13.0581 13.9505 13.9555 14.6029 14.6090 16.3250 16.3284 17.7561 17.7593 19.7710 19.7740 20.4806 20.4889 k = 0.1754-0.0000-0.0000 ( 2447 PWs) bands (ev): -12.7550 -12.7546 -10.8036 -10.8031 -9.2976 -9.2959 -5.9230 -5.9226 -4.0638 -4.0630 -2.4066 -2.4056 1.0211 1.0232 1.7352 1.7428 1.9367 1.9422 2.9465 2.9524 3.6735 3.6786 4.9698 4.9795 5.6497 5.6552 6.0693 6.0782 6.6674 6.6719 8.3508 8.3519 9.3333 9.3374 9.8381 9.8449 10.6505 10.6561 11.4114 11.4138 11.7091 11.7130 12.6725 12.6758 13.0494 13.0535 13.9635 13.9691 14.5522 14.5588 16.2902 16.2936 17.7234 17.7265 19.7967 19.7987 20.4618 20.4710 k = 0.1667-0.0000-0.0000 ( 2447 PWs) bands (ev): -12.7844 -12.7840 -10.8179 -10.8175 -9.2906 -9.2890 -5.9412 -5.9407 -4.0790 -4.0783 -2.4029 -2.4019 1.0145 1.0163 1.7969 1.8052 1.9649 1.9710 2.9914 2.9976 3.6789 3.6838 4.9766 4.9861 5.6675 5.6735 6.0681 6.0773 6.6572 6.6617 8.3480 8.3491 9.3724 9.3766 9.8501 9.8569 10.6725 10.6780 11.4004 11.4025 11.7311 11.7346 12.7291 12.7316 13.0446 13.0493 13.9717 13.9779 14.5043 14.5115 16.2535 16.2568 17.6919 17.6949 19.8057 19.8072 20.4632 20.4734 k = 0.1579-0.0000-0.0000 ( 2443 PWs) bands (ev): -12.8125 -12.8121 -10.8317 -10.8313 -9.2842 -9.2827 -5.9586 -5.9582 -4.0936 -4.0929 -2.3995 -2.3986 1.0057 1.0073 1.8574 1.8665 1.9931 2.0002 3.0378 3.0441 3.6843 3.6891 4.9797 4.9887 5.6889 5.6952 6.0674 6.0768 6.6466 6.6511 8.3442 8.3453 9.4085 9.4127 9.8629 9.8696 10.6932 10.6984 11.3897 11.3916 11.7544 11.7577 12.7852 12.7867 13.0404 13.0459 13.9739 13.9809 14.4608 14.4686 16.2153 16.2185 17.6617 17.6645 19.7972 19.7987 20.4859 20.4967 k = 0.1491-0.0000-0.0000 ( 2443 PWs) bands (ev): -12.8392 -12.8389 -10.8451 -10.8447 -9.2784 -9.2769 -5.9753 -5.9749 -4.1075 -4.1068 -2.3966 -2.3957 0.9954 0.9968 1.9129 1.9228 2.0245 2.0325 3.0852 3.0916 3.6901 3.6948 4.9791 4.9877 5.7129 5.7195 6.0673 6.0769 6.6357 6.6403 8.3394 8.3405 9.4412 9.4455 9.8766 9.8832 10.7125 10.7175 11.3794 11.3811 11.7789 11.7819 12.8391 12.8397 13.0375 13.0444 13.9692 13.9768 14.4232 14.4315 16.1760 16.1791 17.6326 17.6352 19.7738 19.7754 20.5275 20.5385 k = 0.1404-0.0000-0.0000 ( 2439 PWs) bands (ev): -12.8646 -12.8643 -10.8578 -10.8574 -9.2731 -9.2717 -5.9913 -5.9909 -4.1207 -4.1201 -2.3940 -2.3931 0.9843 0.9855 1.9584 1.9679 2.0647 2.0722 3.1330 3.1395 3.6964 3.7011 4.9752 4.9835 5.7383 5.7452 6.0682 6.0780 6.6249 6.6295 8.3337 8.3349 9.4705 9.4747 9.8912 9.8976 10.7307 10.7354 11.3695 11.3710 11.8044 11.8071 12.8871 12.8897 13.0379 13.0470 13.9569 13.9650 14.3929 14.4015 16.1362 16.1392 17.6046 17.6072 19.7396 19.7414 20.5839 20.5948 k = 0.1316-0.0000-0.0000 ( 2443 PWs) bands (ev): -12.8885 -12.8882 -10.8699 -10.8696 -9.2683 -9.2670 -6.0064 -6.0060 -4.1332 -4.1326 -2.3917 -2.3909 0.9726 0.9737 1.9915 1.9990 2.1159 2.1215 3.1806 3.1871 3.7036 3.7084 4.9685 4.9764 5.7639 5.7710 6.0705 6.0805 6.6144 6.6191 8.3273 8.3284 9.4962 9.5002 9.9066 9.9128 10.7477 10.7522 11.3601 11.3614 11.8306 11.8331 12.9254 12.9308 13.0460 13.0578 13.9368 13.9454 14.3704 14.3791 16.0962 16.0991 17.5779 17.5804 19.6987 19.7005 20.6507 20.6615 k = 0.1228-0.0000-0.0000 ( 2431 PWs) bands (ev): -12.9111 -12.9108 -10.8815 -10.8811 -9.2640 -9.2628 -6.0206 -6.0203 -4.1449 -4.1443 -2.3897 -2.3890 0.9608 0.9618 2.0146 2.0202 2.1737 2.1775 3.2272 3.2336 3.7123 3.7171 4.9594 4.9670 5.7883 5.7955 6.0747 6.0846 6.6045 6.6093 8.3202 8.3214 9.5183 9.5221 9.9226 9.9285 10.7639 10.7681 11.3511 11.3523 11.8573 11.8595 12.9488 12.9557 13.0688 13.0818 13.9101 13.9188 14.3556 14.3641 16.0565 16.0593 17.5524 17.5548 19.6544 19.6560 20.7247 20.7352 k = 0.1140-0.0000-0.0000 ( 2439 PWs) bands (ev): -12.9321 -12.9319 -10.8923 -10.8920 -9.2602 -9.2590 -6.0340 -6.0337 -4.1559 -4.1554 -2.3880 -2.3873 0.9492 0.9500 2.0314 2.0356 2.2335 2.2359 3.2718 3.2780 3.7226 3.7276 4.9483 4.9555 5.8105 5.8174 6.0809 6.0907 6.5956 6.6004 8.3126 8.3138 9.5369 9.5406 9.9389 9.9445 10.7791 10.7831 11.3426 11.3437 11.8841 11.8862 12.9581 12.9642 13.1056 13.1178 13.8782 13.8869 14.3470 14.3550 16.0176 16.0202 17.5281 17.5303 19.6086 19.6102 20.8033 20.8134 k = 0.1053-0.0000-0.0000 ( 2443 PWs) bands (ev): -12.9517 -12.9515 -10.9025 -10.9022 -9.2567 -9.2556 -6.0465 -6.0462 -4.1661 -4.1656 -2.3866 -2.3859 0.9378 0.9385 2.0443 2.0476 2.2928 2.2944 3.3135 3.3195 3.7353 3.7405 4.9356 4.9425 5.8293 5.8358 6.0894 6.0990 6.5880 6.5929 8.3046 8.3058 9.5524 9.5558 9.9553 9.9605 10.7936 10.7972 11.3346 11.3356 11.9108 11.9127 12.9591 12.9640 13.1487 13.1596 13.8433 13.8519 14.3431 14.3507 15.9797 15.9822 17.5051 17.5072 19.5631 19.5645 20.8844 20.8942 k = 0.0965-0.0000-0.0000 ( 2443 PWs) bands (ev): -12.9698 -12.9696 -10.9119 -10.9117 -9.2537 -9.2527 -6.0581 -6.0579 -4.1756 -4.1751 -2.3853 -2.3847 0.9270 0.9276 2.0546 2.0572 2.3502 2.3513 3.3515 3.3571 3.7509 3.7563 4.9216 4.9282 5.8443 5.8500 6.1000 6.1092 6.5820 6.5870 8.2963 8.2975 9.5651 9.5682 9.9714 9.9762 10.8072 10.8107 11.3271 11.3281 11.9370 11.9387 12.9561 12.9600 13.1927 13.2026 13.8071 13.8156 14.3427 14.3496 15.9434 15.9457 17.4834 17.4854 19.5189 19.5203 20.9666 20.9760 k = 0.0877-0.0000-0.0000 ( 2447 PWs) bands (ev): -12.9864 -12.9862 -10.9207 -10.9204 -9.2510 -9.2500 -6.0688 -6.0685 -4.1843 -4.1838 -2.3843 -2.3837 0.9168 0.9173 2.0628 2.0650 2.4049 2.4057 3.3848 3.3900 3.7695 3.7751 4.9068 4.9131 5.8553 5.8602 6.1120 6.1207 6.5781 6.5830 8.2880 8.2891 9.5752 9.5780 9.9868 9.9911 10.8202 10.8233 11.3202 11.3211 11.9625 11.9640 12.9511 12.9543 13.2351 13.2443 13.7713 13.7798 14.3444 14.3507 15.9089 15.9110 17.4632 17.4650 19.4769 19.4781 21.0484 21.0574 k = 0.0789-0.0000-0.0000 ( 2443 PWs) bands (ev): -13.0015 -13.0013 -10.9286 -10.9284 -9.2486 -9.2478 -6.0785 -6.0782 -4.1921 -4.1917 -2.3834 -2.3829 0.9073 0.9078 2.0694 2.0712 2.4563 2.4569 3.4131 3.4179 3.7912 3.7968 4.8914 4.8974 5.8627 5.8667 6.1245 6.1327 6.5762 6.5811 8.2797 8.2808 9.5833 9.5858 10.0013 10.0051 10.8323 10.8352 11.3140 11.3148 11.9869 11.9882 12.9451 12.9478 13.2745 13.2833 13.7372 13.7459 14.3474 14.3531 15.8766 15.8785 17.4445 17.4462 19.4377 19.4387 21.1286 21.1371 k = 0.0702-0.0000-0.0000 ( 2443 PWs) bands (ev): -13.0150 -13.0148 -10.9358 -10.9356 -9.2465 -9.2458 -6.0872 -6.0870 -4.1992 -4.1988 -2.3826 -2.3822 0.8986 0.8990 2.0748 2.0763 2.5039 2.5044 3.4363 3.4405 3.8154 3.8211 4.8759 4.8814 5.8670 5.8703 6.1367 6.1443 6.5765 6.5813 8.2717 8.2727 9.5895 9.5918 10.0145 10.0179 10.8436 10.8461 11.3083 11.3091 12.0098 12.0110 12.9387 12.9409 13.3101 13.3186 13.7061 13.7149 14.3511 14.3562 15.8468 15.8485 17.4275 17.4290 19.4016 19.4026 21.2059 21.2140 k = 0.0614-0.0000-0.0000 ( 2447 PWs) bands (ev): -13.0269 -13.0268 -10.9421 -10.9419 -9.2448 -9.2441 -6.0949 -6.0947 -4.2054 -4.2051 -2.3820 -2.3816 0.8908 0.8912 2.0791 2.0804 2.5471 2.5475 3.4547 3.4584 3.8413 3.8468 4.8605 4.8656 5.8691 5.8716 6.1478 6.1546 6.5788 6.5832 8.2641 8.2650 9.5943 9.5963 10.0264 10.0293 10.8539 10.8562 11.3032 11.3039 12.0310 12.0320 12.9322 12.9341 13.3412 13.3495 13.6789 13.6877 14.3550 14.3595 15.8198 15.8213 17.4121 17.4134 19.3691 19.3700 21.2791 21.2866 k = 0.0526-0.0000-0.0000 ( 2443 PWs) bands (ev): -13.0373 -13.0372 -10.9477 -10.9475 -9.2433 -9.2427 -6.1016 -6.1014 -4.2109 -4.2106 -2.3815 -2.3812 0.8840 0.8842 2.0826 2.0836 2.5855 2.5860 3.4689 3.4720 3.8677 3.8728 4.8457 4.8504 5.8695 5.8714 6.1573 6.1634 6.5827 6.5867 8.2570 8.2578 9.5980 9.5996 10.0367 10.0392 10.8632 10.8652 11.2989 11.2995 12.0502 12.0510 12.9260 12.9276 13.3672 13.3753 13.6563 13.6650 14.3588 14.3627 15.7958 15.7971 17.3986 17.3997 19.3405 19.3412 21.3468 21.3537 k = 0.0439-0.0000-0.0000 ( 2433 PWs) bands (ev): -13.0461 -13.0460 -10.9524 -10.9522 -9.2420 -9.2415 -6.1073 -6.1072 -4.2155 -4.2153 -2.3811 -2.3808 0.8781 0.8783 2.0853 2.0862 2.6188 2.6192 3.4796 3.4822 3.8932 3.8978 4.8320 4.8361 5.8688 5.8703 6.1651 6.1703 6.5877 6.5911 8.2507 8.2514 9.6006 9.6020 10.0455 10.0476 10.8713 10.8730 11.2952 11.2957 12.0669 12.0677 12.9203 12.9216 13.3878 13.3954 13.6390 13.6473 14.3624 14.3657 15.7752 15.7762 17.3870 17.3879 19.3160 19.3166 21.4077 21.4138 k = 0.0351-0.0000-0.0000 ( 2433 PWs) bands (ev): -13.0533 -13.0532 -10.9562 -10.9561 -9.2410 -9.2406 -6.1120 -6.1119 -4.2192 -4.2191 -2.3808 -2.3806 0.8732 0.8734 2.0875 2.0881 2.6466 2.6470 3.4874 3.4895 3.9164 3.9203 4.8199 4.8234 5.8676 5.8687 6.1711 6.1754 6.5930 6.5958 8.2453 8.2459 9.6026 9.6037 10.0527 10.0543 10.8782 10.8795 11.2922 11.2926 12.0811 12.0817 12.9153 12.9164 13.4029 13.4097 13.6270 13.6345 14.3655 14.3682 15.7580 15.7588 17.3774 17.3781 19.2956 19.2961 21.4603 21.4656 k = 0.0263-0.0000-0.0000 ( 2439 PWs) bands (ev): -13.0589 -13.0588 -10.9592 -10.9592 -9.2402 -9.2399 -6.1156 -6.1155 -4.2222 -4.2220 -2.3806 -2.3804 0.8695 0.8696 2.0890 2.0895 2.6686 2.6688 3.4929 3.4945 3.9361 3.9392 4.8098 4.8126 5.8663 5.8671 6.1756 6.1789 6.5980 6.6002 8.2409 8.2414 9.6039 9.6048 10.0583 10.0595 10.8837 10.8847 11.2898 11.2902 12.0924 12.0928 12.9112 12.9120 13.4132 13.4187 13.6199 13.6260 14.3681 14.3701 15.7444 15.7451 17.3698 17.3704 19.2797 19.2801 21.5033 21.5075 k = 0.0175-0.0000-0.0000 ( 2429 PWs) bands (ev): -13.0629 -13.0629 -10.9614 -10.9613 -9.2396 -9.2394 -6.1182 -6.1182 -4.2243 -4.2242 -2.3804 -2.3803 0.8667 0.8668 2.0901 2.0904 2.6845 2.6847 3.4967 3.4977 3.9512 3.9533 4.8024 4.8043 5.8652 5.8657 6.1788 6.1810 6.6023 6.6037 8.2378 8.2381 9.6049 9.6054 10.0624 10.0632 10.8878 10.8884 11.2882 11.2884 12.1006 12.1009 12.9083 12.9088 13.4197 13.4235 13.6166 13.6209 14.3701 14.3714 15.7347 15.7351 17.3644 17.3648 19.2683 19.2685 21.5354 21.5383 k = 0.0088-0.0000-0.0000 ( 2433 PWs) bands (ev): -13.0653 -13.0653 -10.9627 -10.9627 -9.2393 -9.2392 -6.1198 -6.1197 -4.2255 -4.2255 -2.3803 -2.3802 0.8651 0.8652 2.0908 2.0909 2.6941 2.6942 3.4989 3.4994 3.9608 3.9619 4.7979 4.7989 5.8644 5.8647 6.1809 6.1820 6.6051 6.6058 8.2358 8.2360 9.6055 9.6057 10.0649 10.0653 10.8903 10.8906 11.2872 11.2873 12.1057 12.1058 12.9065 12.9067 13.4234 13.4253 13.6157 13.6179 14.3714 14.3721 15.7289 15.7291 17.3612 17.3614 19.2614 19.2615 21.5554 21.5570 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0087-0.0000 ( 2435 PWs) bands (ev): -13.0653 -13.0653 -10.9628 -10.9628 -9.2399 -9.2398 -6.1205 -6.1204 -4.2262 -4.2261 -2.3814 -2.3813 0.8652 0.8655 2.0890 2.0898 2.6975 2.6977 3.4997 3.5006 3.9650 3.9656 4.7956 4.7958 5.8637 5.8640 6.1827 6.1840 6.6056 6.6068 8.2339 8.2345 9.6025 9.6031 10.0692 10.0704 10.8915 10.8918 11.2877 11.2879 12.1074 12.1075 12.9066 12.9067 13.4245 13.4248 13.6154 13.6157 14.3719 14.3720 15.7260 15.7262 17.3600 17.3602 19.2608 19.2608 21.5610 21.5614 k = 0.0000 0.0175-0.0000 ( 2434 PWs) bands (ev): -13.0628 -13.0628 -10.9618 -10.9618 -9.2421 -9.2419 -6.1211 -6.1210 -4.2269 -4.2268 -2.3847 -2.3847 0.8673 0.8680 2.0835 2.0851 2.6982 2.6985 3.5004 3.5022 3.9671 3.9684 4.7927 4.7932 5.8623 5.8628 6.1864 6.1890 6.6046 6.6071 8.2304 8.2316 9.5938 9.5950 10.0803 10.0826 10.8927 10.8933 11.2903 11.2907 12.1075 12.1076 12.9086 12.9088 13.4227 13.4233 13.6130 13.6137 14.3715 14.3717 15.7231 15.7235 17.3596 17.3602 19.2656 19.2656 21.5564 21.5571 k = 0.0000 0.0262-0.0000 ( 2432 PWs) bands (ev): -13.0587 -13.0587 -10.9602 -10.9602 -9.2458 -9.2455 -6.1221 -6.1219 -4.2281 -4.2280 -2.3903 -2.3902 0.8709 0.8719 2.0750 2.0773 2.6993 2.6998 3.5017 3.5044 3.9707 3.9726 4.7883 4.7890 5.8598 5.8606 6.1926 6.1966 6.6035 6.6073 8.2249 8.2267 9.5807 9.5823 10.0980 10.1014 10.8948 10.8957 11.2948 11.2953 12.1077 12.1078 12.9119 12.9123 13.4199 13.4209 13.6093 13.6103 14.3709 14.3712 15.7184 15.7189 17.3592 17.3600 19.2735 19.2736 21.5489 21.5500 k = 0.0000 0.0349-0.0000 ( 2438 PWs) bands (ev): -13.0529 -13.0529 -10.9580 -10.9580 -9.2510 -9.2505 -6.1235 -6.1232 -4.2298 -4.2296 -2.3980 -2.3980 0.8758 0.8771 2.0636 2.0667 2.7009 2.7015 3.5035 3.5070 3.9755 3.9781 4.7830 4.7840 5.8559 5.8569 6.2009 6.2063 6.6026 6.6077 8.2177 8.2201 9.5641 9.5661 10.1211 10.1253 10.8977 10.8990 11.3010 11.3017 12.1079 12.1081 12.9166 12.9171 13.4161 13.4173 13.6041 13.6054 14.3701 14.3705 15.7119 15.7125 17.3587 17.3598 19.2846 19.2847 21.5388 21.5401 k = 0.0000 0.0436-0.0000 ( 2442 PWs) bands (ev): -13.0456 -13.0455 -10.9552 -10.9551 -9.2576 -9.2569 -6.1252 -6.1248 -4.2319 -4.2316 -2.4079 -2.4078 0.8817 0.8834 2.0499 2.0537 2.7030 2.7037 3.5056 3.5098 3.9813 3.9845 4.7776 4.7788 5.8504 5.8516 6.2105 6.2174 6.6024 6.6088 8.2091 8.2120 9.5454 9.5476 10.1482 10.1531 10.9016 10.9031 11.3090 11.3098 12.1082 12.1085 12.9227 12.9233 13.4113 13.4127 13.5975 13.5991 14.3692 14.3697 15.7036 15.7044 17.3581 17.3594 19.2986 19.2987 21.5263 21.5279 k = 0.0000 0.0524-0.0000 ( 2452 PWs) bands (ev): -13.0365 -13.0364 -10.9517 -10.9516 -9.2656 -9.2649 -6.1272 -6.1268 -4.2343 -4.2340 -2.4198 -2.4197 0.8884 0.8904 2.0343 2.0388 2.7054 2.7063 3.5078 3.5126 3.9878 3.9915 4.7726 4.7741 5.8430 5.8444 6.2207 6.2290 6.6033 6.6110 8.1994 8.2029 9.5252 9.5276 10.1780 10.1836 10.9062 10.9080 11.3188 11.3197 12.1086 12.1089 12.9301 12.9309 13.4055 13.4071 13.5896 13.5914 14.3683 14.3689 15.6935 15.6944 17.3574 17.3590 19.3154 19.3156 21.5115 21.5134 k = 0.0000 0.0611-0.0000 ( 2452 PWs) bands (ev): -13.0259 -13.0258 -10.9477 -10.9476 -9.2751 -9.2743 -6.1296 -6.1291 -4.2371 -4.2367 -2.4337 -2.4336 0.8956 0.8979 2.0175 2.0226 2.7083 2.7093 3.5099 3.5153 3.9944 3.9987 4.7691 4.7708 5.8336 5.8350 6.2303 6.2399 6.6059 6.6148 8.1892 8.1932 9.5045 9.5070 10.2096 10.2157 10.9117 10.9137 11.3303 11.3314 12.1091 12.1095 12.9389 12.9398 13.3988 13.4005 13.5804 13.5824 14.3676 14.3682 15.6817 15.6828 17.3567 17.3585 19.3350 19.3352 21.4948 21.4970 k = 0.0000 0.0698-0.0000 ( 2456 PWs) bands (ev): -13.0137 -13.0135 -10.9431 -10.9430 -9.2861 -9.2851 -6.1322 -6.1317 -4.2402 -4.2398 -2.4495 -2.4494 0.9029 0.9055 2.0001 2.0058 2.7116 2.7127 3.5117 3.5177 4.0010 4.0057 4.7675 4.7695 5.8219 5.8235 6.2384 6.2491 6.6108 6.6207 8.1789 8.1834 9.4837 9.4862 10.2419 10.2485 10.9179 10.9202 11.3436 11.3448 12.1097 12.1101 12.9490 12.9501 13.3913 13.3931 13.5700 13.5720 14.3670 14.3677 15.6682 15.6695 17.3560 17.3581 19.3572 19.3574 21.4764 21.4787 k = 0.0000 0.0785-0.0000 ( 2470 PWs) bands (ev): -12.9998 -12.9997 -10.9380 -10.9379 -9.2986 -9.2975 -6.1351 -6.1345 -4.2436 -4.2431 -2.4671 -2.4671 0.9099 0.9127 1.9827 1.9889 2.7152 2.7164 3.5131 3.5195 4.0071 4.0121 4.7687 4.7708 5.8078 5.8095 6.2440 6.2556 6.6183 6.6289 8.1691 8.1741 9.4630 9.4656 10.2743 10.2813 10.9249 10.9275 11.3586 11.3599 12.1103 12.1108 12.9604 12.9618 13.3830 13.3848 13.5584 13.5605 14.3667 14.3673 15.6532 15.6546 17.3553 17.3576 19.3816 19.3819 21.4564 21.4589 k = 0.0000 0.0873-0.0000 ( 2468 PWs) bands (ev): -12.9844 -12.9842 -10.9324 -10.9323 -9.3125 -9.3113 -6.1383 -6.1376 -4.2471 -4.2466 -2.4865 -2.4864 0.9161 0.9191 1.9659 1.9726 2.7192 2.7205 3.5141 3.5209 4.0125 4.0178 4.7728 4.7751 5.7915 5.7933 6.2465 6.2587 6.6286 6.6397 8.1604 8.1657 9.4429 9.4455 10.3061 10.3135 10.9325 10.9353 11.3753 11.3768 12.1111 12.1116 12.9731 12.9747 13.3741 13.3759 13.5457 13.5477 14.3666 14.3673 15.6367 15.6382 17.3546 17.3572 19.4083 19.4086 21.4349 21.4376 k = 0.0000 0.0960-0.0000 ( 2476 PWs) bands (ev): -12.9674 -12.9673 -10.9263 -10.9262 -9.3278 -9.3265 -6.1417 -6.1409 -4.2508 -4.2502 -2.5075 -2.5075 0.9210 0.9242 1.9506 1.9577 2.7234 2.7249 3.5145 3.5217 4.0171 4.0226 4.7801 4.7825 5.7728 5.7747 6.2456 6.2579 6.6416 6.6528 8.1533 8.1590 9.4232 9.4259 10.3367 10.3445 10.9408 10.9438 11.3937 11.3953 12.1119 12.1125 12.9869 12.9888 13.3649 13.3665 13.5320 13.5339 14.3669 14.3675 15.6189 15.6204 17.3540 17.3568 19.4369 19.4372 21.4121 21.4149 k = 0.0000 0.1047-0.0000 ( 2472 PWs) bands (ev): -12.9489 -12.9487 -10.9198 -10.9197 -9.3446 -9.3432 -6.1452 -6.1444 -4.2545 -4.2538 -2.5301 -2.5300 0.9242 0.9276 1.9371 1.9447 2.7280 2.7296 3.5145 3.5220 4.0209 4.0264 4.7906 4.7930 5.7518 5.7537 6.2413 6.2536 6.6567 6.6677 8.1484 8.1543 9.4042 9.4069 10.3658 10.3740 10.9496 10.9528 11.4137 11.4154 12.1129 12.1135 13.0016 13.0040 13.3555 13.3568 13.5173 13.5190 14.3675 14.3681 15.5998 15.6014 17.3535 17.3565 19.4672 19.4676 21.3878 21.3909 k = 0.0000 0.1134-0.0000 ( 2468 PWs) bands (ev): -12.9289 -12.9287 -10.9130 -10.9128 -9.3629 -9.3614 -6.1489 -6.1481 -4.2582 -4.2575 -2.5542 -2.5541 0.9251 0.9287 1.9262 1.9342 2.7327 2.7345 3.5142 3.5219 4.0240 4.0295 4.8039 4.8062 5.7285 5.7304 6.2339 6.2458 6.6733 6.6838 8.1460 8.1522 9.3858 9.3886 10.3929 10.4014 10.9588 10.9622 11.4354 11.4373 12.1139 12.1146 13.0172 13.0200 13.3462 13.3473 13.5019 13.5033 14.3684 14.3690 15.5797 15.5813 17.3531 17.3563 19.4991 19.4995 21.3622 21.3655 k = 0.0000 0.1222-0.0000 ( 2468 PWs) bands (ev): -12.9073 -12.9071 -10.9058 -10.9057 -9.3825 -9.3810 -6.1528 -6.1519 -4.2618 -4.2610 -2.5797 -2.5796 0.9236 0.9272 1.9183 1.9266 2.7377 2.7396 3.5136 3.5216 4.0266 4.0320 4.8196 4.8218 5.7030 5.7049 6.2237 6.2352 6.6907 6.7006 8.1466 8.1530 9.3681 9.3709 10.4177 10.4264 10.9685 10.9720 11.4588 11.4607 12.1152 12.1158 13.0331 13.0366 13.3373 13.3383 13.4859 13.4868 14.3695 14.3700 15.5585 15.5602 17.3528 17.3562 19.5323 19.5327 21.3352 21.3385 k = 0.0000 0.1309-0.0000 ( 2458 PWs) bands (ev): -12.8843 -12.8841 -10.8984 -10.8982 -9.4036 -9.4019 -6.1567 -6.1558 -4.2652 -4.2643 -2.6065 -2.6063 0.9192 0.9228 1.9137 1.9223 2.7429 2.7449 3.5130 3.5212 4.0288 4.0341 4.8370 4.8392 5.6753 5.6773 6.2112 6.2221 6.7084 6.7176 8.1506 8.1571 9.3508 9.3538 10.4400 10.4490 10.9784 10.9821 11.4837 11.4857 12.1165 12.1173 13.0489 13.0532 13.3290 13.3305 13.4695 13.4699 14.3707 14.3713 15.5367 15.5384 17.3526 17.3562 19.5667 19.5671 21.3065 21.3100 k = 0.0000 0.1396-0.0000 ( 2466 PWs) bands (ev): -12.8599 -12.8597 -10.8908 -10.8906 -9.4260 -9.4243 -6.1607 -6.1597 -4.2684 -4.2674 -2.6345 -2.6343 0.9117 0.9154 1.9127 1.9215 2.7482 2.7503 3.5125 3.5209 4.0309 4.0361 4.8555 4.8575 5.6456 5.6475 6.1968 6.2072 6.7259 6.7344 8.1579 8.1645 9.3341 9.3371 10.4594 10.4686 10.9885 10.9923 11.5101 11.5123 12.1181 12.1188 13.0640 13.0692 13.3218 13.3244 13.4526 13.4533 14.3719 14.3726 15.5142 15.5159 17.3526 17.3563 19.6018 19.6024 21.2760 21.2797 k = 0.0000 0.1483-0.0000 ( 2470 PWs) bands (ev): -12.8340 -12.8338 -10.8830 -10.8828 -9.4497 -9.4479 -6.1648 -6.1638 -4.2711 -4.2701 -2.6637 -2.6635 0.9011 0.9048 1.9152 1.9243 2.7537 2.7559 3.5124 3.5210 4.0332 4.0382 4.8743 4.8762 5.6139 5.6159 6.1810 6.1907 6.7431 6.7509 8.1687 8.1754 9.3177 9.3209 10.4759 10.4854 10.9988 11.0026 11.5381 11.5404 12.1198 12.1206 13.0775 13.0837 13.3160 13.3202 13.4359 13.4377 14.3729 14.3737 15.4913 15.4931 17.3527 17.3565 19.6378 19.6383 21.2437 21.2474 k = 0.0000 0.1571-0.0000 ( 2468 PWs) bands (ev): -12.8068 -12.8066 -10.8752 -10.8749 -9.4746 -9.4728 -6.1689 -6.1678 -4.2734 -4.2724 -2.6940 -2.6938 0.8876 0.8912 1.9213 1.9306 2.7593 2.7616 3.5130 3.5217 4.0358 4.0406 4.8926 4.8944 5.5806 5.5825 6.1641 6.1731 6.7600 6.7670 8.1829 8.1896 9.3018 9.3051 10.4894 10.4990 11.0091 11.0129 11.5675 11.5699 12.1217 12.1226 13.0885 13.0958 13.3117 13.3181 13.4207 13.4241 14.3736 14.3747 15.4683 15.4700 17.3530 17.3570 19.6742 19.6748 21.2092 21.2130 k = 0.0000 0.1658-0.0000 ( 2480 PWs) bands (ev): -12.7783 -12.7781 -10.8674 -10.8672 -9.5008 -9.4989 -6.1730 -6.1719 -4.2752 -4.2740 -2.7253 -2.7251 0.8712 0.8748 1.9307 1.9402 2.7650 2.7674 3.5144 3.5232 4.0388 4.0434 4.9098 4.9114 5.5457 5.5476 6.1462 6.1546 6.7767 6.7830 8.2002 8.2068 9.2862 9.2896 10.4997 10.5095 11.0194 11.0232 11.5983 11.6009 12.1239 12.1249 13.0961 13.1045 13.3078 13.3166 13.4091 13.4145 14.3739 14.3751 15.4453 15.4470 17.3534 17.3575 19.7109 19.7116 21.1724 21.1763 k = 0.0000 0.1745-0.0000 ( 2480 PWs) bands (ev): -12.7485 -12.7482 -10.8598 -10.8595 -9.5280 -9.5260 -6.1772 -6.1760 -4.2763 -4.2751 -2.7576 -2.7574 0.8523 0.8558 1.9431 1.9528 2.7708 2.7733 3.5169 3.5259 4.0424 4.0469 4.9251 4.9266 5.5095 5.5113 6.1278 6.1355 6.7936 6.7992 8.2204 8.2268 9.2708 9.2744 10.5069 10.5169 11.0296 11.0334 11.6305 11.6332 12.1265 12.1275 13.0998 13.1091 13.3022 13.3131 13.4046 13.4116 14.3735 14.3750 15.4226 15.4243 17.3542 17.3584 19.7478 19.7485 21.1333 21.1371 k = 0.0000 0.1832-0.0000 ( 2480 PWs) bands (ev): -12.7174 -12.7172 -10.8523 -10.8520 -9.5562 -9.5542 -6.1813 -6.1801 -4.2766 -4.2754 -2.7909 -2.7906 0.8312 0.8347 1.9583 1.9681 2.7768 2.7793 3.5208 3.5298 4.0466 4.0509 4.9377 4.9393 5.4723 5.4741 6.1089 6.1160 6.8110 6.8159 8.2428 8.2492 9.2558 9.2595 10.5109 10.5210 11.0397 11.0434 11.6639 11.6669 12.1293 12.1304 13.0997 13.1097 13.2929 13.3047 13.4101 13.4177 14.3724 14.3741 15.4004 15.4020 17.3551 17.3594 19.7846 19.7854 21.0916 21.0954 k = 0.0000 0.1920-0.0000 ( 2480 PWs) bands (ev): -12.6852 -12.6849 -10.8452 -10.8448 -9.5854 -9.5833 -6.1854 -6.1842 -4.2761 -4.2748 -2.8250 -2.8247 0.8083 0.8116 1.9757 1.9856 2.7829 2.7855 3.5261 3.5352 4.0513 4.0555 4.9473 4.9488 5.4344 5.4362 6.0897 6.0962 6.8293 6.8336 8.2672 8.2733 9.2410 9.2449 10.5118 10.5221 11.0497 11.0533 11.6986 11.7018 12.1326 12.1338 13.0959 13.1064 13.2795 13.2913 13.4251 13.4325 14.3703 14.3723 15.3789 15.3804 17.3564 17.3607 19.8213 19.8221 21.0474 21.0512 k = 0.0000 0.2007-0.0000 ( 2476 PWs) bands (ev): -12.6518 -12.6515 -10.8385 -10.8381 -9.6153 -9.6132 -6.1895 -6.1883 -4.2747 -4.2733 -2.8599 -2.8596 0.7839 0.7871 1.9951 2.0051 2.7892 2.7918 3.5330 3.5422 4.0567 4.0607 4.9530 4.9546 5.3962 5.3981 6.0704 6.0763 6.8489 6.8528 8.2928 8.2987 9.2265 9.2307 10.5096 10.5201 11.0597 11.0631 11.7344 11.7378 12.1364 12.1377 13.0891 13.0999 13.2634 13.2749 13.4473 13.4541 14.3672 14.3694 15.3583 15.3598 17.3579 17.3623 19.8576 19.8584 21.0007 21.0044 k = 0.0000 0.2094-0.0000 ( 2484 PWs) bands (ev): -12.6174 -12.6171 -10.8324 -10.8320 -9.6458 -9.6437 -6.1935 -6.1923 -4.2722 -4.2707 -2.8956 -2.8953 0.7583 0.7615 2.0160 2.0260 2.7956 2.7982 3.5416 3.5508 4.0625 4.0665 4.9545 4.9563 5.3580 5.3600 6.0509 6.0563 6.8702 6.8737 8.3191 8.3248 9.2124 9.2168 10.5045 10.5151 11.0695 11.0727 11.7712 11.7748 12.1406 12.1422 13.0796 13.0906 13.2460 13.2572 13.4741 13.4804 14.3629 14.3653 15.3388 15.3402 17.3597 17.3642 19.8933 19.8942 20.9518 20.9553 k = 0.0000 0.2181-0.0000 ( 2486 PWs) bands (ev): -12.5819 -12.5816 -10.8270 -10.8265 -9.6768 -9.6746 -6.1976 -6.1963 -4.2685 -4.2671 -2.9321 -2.9317 0.7321 0.7352 2.0381 2.0481 2.8022 2.8047 3.5519 3.5612 4.0689 4.0727 4.9513 4.9535 5.3202 5.3226 6.0315 6.0363 6.8936 6.8967 8.3455 8.3509 9.1989 9.2036 10.4967 10.5073 11.0791 11.0822 11.8090 11.8128 12.1455 12.1473 13.0676 13.0788 13.2283 13.2394 13.5041 13.5099 14.3573 14.3600 15.3206 15.3220 17.3618 17.3663 19.9282 19.9292 20.9010 20.9043 k = 0.0000 0.2269-0.0000 ( 2482 PWs) bands (ev): -12.5455 -12.5452 -10.8224 -10.8219 -9.7080 -9.7059 -6.2015 -6.2003 -4.2637 -4.2622 -2.9692 -2.9688 0.7054 0.7084 2.0612 2.0711 2.8089 2.8115 3.5640 3.5734 4.0756 4.0794 4.9432 4.9459 5.2834 5.2863 6.0121 6.0164 6.9192 6.9220 8.3714 8.3765 9.1860 9.1910 10.4863 10.4970 11.0887 11.0916 11.8475 11.8516 12.1510 12.1531 13.0534 13.0645 13.2111 13.2221 13.5360 13.5415 14.3505 14.3534 15.3038 15.3052 17.3643 17.3688 19.9623 19.9634 20.8486 20.8516 k = 0.0000 0.2356-0.0000 ( 2482 PWs) bands (ev): -12.5083 -12.5080 -10.8188 -10.8183 -9.7394 -9.7372 -6.2055 -6.2043 -4.2576 -4.2560 -3.0069 -3.0065 0.6786 0.6815 2.0848 2.0946 2.8158 2.8184 3.5778 3.5872 4.0827 4.0864 4.9300 4.9334 5.2478 5.2514 5.9929 5.9967 6.9471 6.9498 8.3961 8.4008 9.1741 9.1794 10.4736 10.4843 11.0981 11.1008 11.8867 11.8910 12.1573 12.1598 13.0370 13.0479 13.1950 13.2059 13.5690 13.5742 14.3425 14.3456 15.2887 15.2899 17.3672 17.3716 19.9951 19.9963 20.7952 20.7979 k = 0.0000 0.2443-0.0000 ( 2478 PWs) bands (ev): -12.4704 -12.4701 -10.8164 -10.8158 -9.7706 -9.7684 -6.2094 -6.2082 -4.2501 -4.2485 -3.0453 -3.0448 0.6520 0.6548 2.1087 2.1184 2.8229 2.8254 3.5933 3.6027 4.0900 4.0937 4.9119 4.9160 5.2139 5.2183 5.9738 5.9772 6.9775 6.9801 8.4190 8.4232 9.1633 9.1690 10.4588 10.4694 11.1074 11.1099 11.9263 11.9309 12.1645 12.1675 13.0184 13.0291 13.1803 13.1909 13.6023 13.6074 14.3333 14.3365 15.2752 15.2764 17.3704 17.3748 20.0264 20.0278 20.7414 20.7437 k = 0.0000 0.2530-0.0000 ( 2478 PWs) bands (ev): -12.4317 -12.4315 -10.8152 -10.8146 -9.8014 -9.7993 -6.2132 -6.2120 -4.2412 -4.2395 -3.0841 -3.0836 0.6257 0.6284 2.1327 2.1423 2.8302 2.8326 3.6104 3.6198 4.0973 4.1011 4.8892 4.8939 5.1818 5.1869 5.9550 5.9580 7.0103 7.0128 8.4394 8.4432 9.1540 9.1600 10.4421 10.4527 11.1165 11.1188 11.9660 11.9711 12.1727 12.1763 12.9979 13.0081 13.1672 13.1773 13.6353 13.6402 14.3231 14.3265 15.2634 15.2645 17.3739 17.3783 20.0557 20.0574 20.6880 20.6900 k = 0.0000 0.2618-0.0000 ( 2478 PWs) bands (ev): -12.3926 -12.3923 -10.8155 -10.8148 -9.8316 -9.8295 -6.2170 -6.2158 -4.2307 -4.2291 -3.1234 -3.1229 0.6000 0.6026 2.1567 2.1660 2.8376 2.8400 3.6289 3.6383 4.1047 4.1085 4.8625 4.8678 5.1515 5.1573 5.9364 5.9391 7.0453 7.0477 8.4567 8.4600 9.1465 9.1529 10.4240 10.4345 11.1254 11.1275 12.0056 12.0112 12.1820 12.1864 12.9757 12.9853 13.1555 13.1652 13.6675 13.6723 14.3120 14.3156 15.2534 15.2545 17.3778 17.3821 20.0826 20.0846 20.6360 20.6377 k = 0.0000 0.2705-0.0000 ( 2478 PWs) bands (ev): -12.3531 -12.3528 -10.8174 -10.8167 -9.8610 -9.8589 -6.2207 -6.2196 -4.2188 -4.2172 -3.1632 -3.1626 0.5750 0.5775 2.1803 2.1894 2.8451 2.8475 3.6488 3.6581 4.1119 4.1157 4.8324 4.8383 5.1229 5.1293 5.9183 5.9206 7.0823 7.0848 8.4704 8.4732 9.1410 9.1478 10.4046 10.4150 11.1341 11.1360 12.0446 12.0508 12.1928 12.1982 12.9519 12.9610 13.1451 13.1543 13.6982 13.7029 14.3004 14.3041 15.2452 15.2463 17.3820 17.3861 20.1060 20.1085 20.5866 20.5882 k = 0.0000 0.2792-0.0000 ( 2474 PWs) bands (ev): -12.3133 -12.3130 -10.8210 -10.8203 -9.8892 -9.8872 -6.2244 -6.2233 -4.2053 -4.2037 -3.2033 -3.2026 0.5510 0.5534 2.2036 2.2123 2.8527 2.8550 3.6699 3.6791 4.1189 4.1227 4.7999 4.8061 5.0959 5.1026 5.9005 5.9026 7.1212 7.1236 8.4800 8.4823 9.1379 9.1450 10.3843 10.3945 11.1425 11.1442 12.0823 12.0894 12.2055 12.2121 12.9269 12.9354 13.1359 13.1445 13.7270 13.7317 14.2886 14.2922 15.2388 15.2399 17.3864 17.3905 20.1248 20.1279 20.5414 20.5433 k = 0.0000 0.2880-0.0000 ( 2478 PWs) bands (ev): -12.2735 -12.2732 -10.8264 -10.8257 -9.9161 -9.9141 -6.2280 -6.2269 -4.1902 -4.1886 -3.2436 -3.2430 0.5281 0.5303 2.2262 2.2347 2.8603 2.8625 3.6919 3.7011 4.1254 4.1293 4.7658 4.7723 5.0701 5.0771 5.8833 5.8851 7.1616 7.1640 8.4851 8.4870 9.1373 9.1446 10.3635 10.3735 11.1505 11.1520 12.1178 12.1259 12.2207 12.2289 12.9009 12.9089 13.1275 13.1357 13.7535 13.7581 14.2767 14.2804 15.2341 15.2352 17.3910 17.3950 20.1372 20.1410 20.5026 20.5051 k = 0.0000 0.2967-0.0000 ( 2482 PWs) bands (ev): -12.2337 -12.2335 -10.8337 -10.8330 -9.9414 -9.9395 -6.2314 -6.2304 -4.1735 -4.1719 -3.2842 -3.2835 0.5063 0.5084 2.2482 2.2562 2.8678 2.8700 3.7149 3.7239 4.1312 4.1352 4.7309 4.7375 5.0455 5.0527 5.8667 5.8683 7.2032 7.2055 8.4857 8.4872 9.1391 9.1466 10.3423 10.3520 11.1582 11.1596 12.1501 12.1592 12.2397 12.2493 12.8742 12.8818 13.1199 13.1275 13.7773 13.7818 14.2653 14.2689 15.2311 15.2322 17.3958 17.3996 20.1412 20.1457 20.4727 20.4760 k = 0.0000 0.3054-0.0000 ( 2486 PWs) bands (ev): -12.1943 -12.1941 -10.8428 -10.8421 -9.9650 -9.9632 -6.2348 -6.2338 -4.1553 -4.1536 -3.3249 -3.3242 0.4859 0.4878 2.2693 2.2769 2.8753 2.8774 3.7385 3.7474 4.1363 4.1403 4.6960 4.7025 5.0220 5.0291 5.8508 5.8522 7.2456 7.2478 8.4819 8.4831 9.1433 9.1508 10.3213 10.3306 11.1655 11.1667 12.1784 12.1877 12.2635 12.2740 12.8471 12.8543 13.1128 13.1199 13.7980 13.8023 14.2545 14.2580 15.2296 15.2307 17.4007 17.4043 20.1354 20.1403 20.4540 20.4578 k = 0.0000 0.3141-0.0000 ( 2482 PWs) bands (ev): -12.1555 -12.1553 -10.8537 -10.8530 -9.9866 -9.9849 -6.2380 -6.2371 -4.1354 -4.1337 -3.3657 -3.3649 0.4668 0.4686 2.2895 2.2966 2.8826 2.8847 3.7627 3.7714 4.1402 4.1444 4.6617 4.6681 4.9996 5.0066 5.8357 5.8369 7.2884 7.2906 8.4740 8.4750 9.1495 9.1570 10.3006 10.3095 11.1723 11.1734 12.2027 12.2114 12.2920 12.3024 12.8197 12.8266 13.1061 13.1129 13.8154 13.8195 14.2449 14.2482 15.2295 15.2306 17.4056 17.4090 20.1199 20.1249 20.4466 20.4506 k = 0.0000 0.3229-0.0000 ( 2482 PWs) bands (ev): -12.1176 -12.1174 -10.8663 -10.8656 -10.0061 -10.0045 -6.2410 -6.2402 -4.1140 -4.1123 -3.4064 -3.4055 0.4492 0.4508 2.3085 2.3152 2.8897 2.8917 3.7872 3.7957 4.1429 4.1472 4.6288 4.6349 4.9783 4.9850 5.8215 5.8225 7.3312 7.3333 8.4623 8.4632 9.1574 9.1647 10.2805 10.2890 11.1787 11.1796 12.2240 12.2317 12.3233 12.3333 12.7923 12.7990 13.0998 13.1061 13.8294 13.8333 14.2364 14.2395 15.2306 15.2317 17.4105 17.4137 20.0971 20.1018 20.4486 20.4525 k = 0.0000 0.3316-0.0000 ( 2482 PWs) bands (ev): -12.0809 -12.0807 -10.8802 -10.8795 -10.0236 -10.0221 -6.2438 -6.2431 -4.0910 -4.0895 -3.4469 -3.4460 0.4331 0.4346 2.3263 2.3324 2.8965 2.8983 3.8118 3.8202 4.1439 4.1484 4.5977 4.6036 4.9582 4.9647 5.8083 5.8091 7.3734 7.3755 8.4475 8.4483 9.1665 9.1735 10.2614 10.2693 11.1845 11.1853 12.2435 12.2501 12.3557 12.3651 12.7650 12.7716 13.0938 13.0997 13.8401 13.8437 14.2294 14.2322 15.2327 15.2338 17.4152 17.4181 20.0698 20.0741 20.4571 20.4607 k = 0.0000 0.3403-0.0000 ( 2484 PWs) bands (ev): -12.0459 -12.0457 -10.8950 -10.8944 -10.0389 -10.0376 -6.2465 -6.2458 -4.0667 -4.0651 -3.4871 -3.4862 0.4186 0.4199 2.3428 2.3483 2.9029 2.9046 3.8365 3.8446 4.1431 4.1478 4.5691 4.5745 4.9396 4.9456 5.7961 5.7969 7.4147 7.4166 8.4302 8.4310 9.1762 9.1828 10.2435 10.2508 11.1898 11.1905 12.2619 12.2676 12.3875 12.3966 12.7381 12.7447 13.0880 13.0934 13.8477 13.8509 14.2239 14.2263 15.2356 15.2368 17.4197 17.4224 20.0409 20.0447 20.4694 20.4727 k = 0.0000 0.3490-0.0000 ( 2494 PWs) bands (ev): -12.0129 -12.0127 -10.9104 -10.9099 -10.0521 -10.0510 -6.2489 -6.2483 -4.0410 -4.0395 -3.5268 -3.5259 0.4057 0.4069 2.3577 2.3626 2.9088 2.9104 3.8609 3.8688 4.1402 4.1451 4.5434 4.5483 4.9225 4.9281 5.7851 5.7858 7.4542 7.4560 8.4114 8.4122 9.1861 9.1922 10.2271 10.2337 11.1945 11.1951 12.2797 12.2847 12.4178 12.4267 12.7119 12.7185 13.0825 13.0875 13.8526 13.8554 14.2197 14.2218 15.2391 15.2401 17.4239 17.4263 20.0124 20.0157 20.4835 20.4864 k = 0.0000 0.3578-0.0000 ( 2486 PWs) bands (ev): -11.9826 -11.9824 -10.9258 -10.9253 -10.0633 -10.0623 -6.2510 -6.2505 -4.0142 -4.0127 -3.5660 -3.5650 0.3945 0.3955 2.3710 2.3753 2.9142 2.9156 3.8850 3.8925 4.1352 4.1402 4.5211 4.5253 4.9073 4.9123 5.7754 5.7759 7.4914 7.4930 8.3919 8.3927 9.1958 9.2012 10.2124 10.2182 11.1987 11.1991 12.2969 12.3013 12.4459 12.4548 12.6865 12.6933 13.0774 13.0818 13.8553 13.8577 14.2167 14.2185 15.2428 15.2438 17.4278 17.4299 19.9858 19.9886 20.4981 20.5005 k = 0.0000 0.3665-0.0000 ( 2494 PWs) bands (ev): -11.9554 -11.9552 -10.9405 -10.9401 -10.0726 -10.0717 -6.2528 -6.2524 -3.9865 -3.9850 -3.6042 -3.6031 0.3849 0.3858 2.3825 2.3861 2.9189 2.9201 3.9083 3.9155 4.1278 4.1330 4.5023 4.5059 4.8941 4.8984 5.7670 5.7675 7.5254 7.5268 8.3726 8.3733 9.2048 9.2095 10.1996 10.2046 11.2022 11.2026 12.3134 12.3172 12.4713 12.4803 12.6624 12.6696 13.0727 13.0766 13.8562 13.8582 14.2147 14.2161 15.2465 15.2474 17.4312 17.4329 19.9621 19.9643 20.5120 20.5141 k = 0.0000 0.3752-0.0000 ( 2494 PWs) bands (ev): -11.9320 -11.9318 -10.9539 -10.9535 -10.0799 -10.0792 -6.2544 -6.2540 -3.9582 -3.9568 -3.6410 -3.6400 0.3771 0.3778 2.3922 2.3951 2.9229 2.9239 3.9306 3.9374 4.1186 4.1238 4.4872 4.4901 4.8831 4.8866 5.7601 5.7604 7.5554 7.5565 8.3546 8.3552 9.2128 9.2166 10.1889 10.1931 11.2051 11.2054 12.3289 12.3321 12.4936 12.5028 12.6400 12.6476 13.0686 13.0718 13.8562 13.8577 14.2134 14.2145 15.2500 15.2507 17.4341 17.4355 19.9419 19.9437 20.5246 20.5262 k = 0.0000 0.3839-0.0000 ( 2492 PWs) bands (ev): -11.9129 -11.9128 -10.9652 -10.9649 -10.0855 -10.0850 -6.2556 -6.2553 -3.9301 -3.9288 -3.6757 -3.6748 0.3711 0.3716 2.4000 2.4022 2.9262 2.9269 3.9513 3.9574 4.1082 4.1132 4.4758 4.4779 4.8744 4.8771 5.7546 5.7549 7.5803 7.5812 8.3390 8.3395 9.2194 9.2224 10.1806 10.1838 11.2074 11.2076 12.3426 12.3452 12.5125 12.5218 12.6199 12.6279 13.0652 13.0678 13.8555 13.8567 14.2127 14.2135 15.2530 15.2536 17.4364 17.4375 19.9258 19.9271 20.5351 20.5363 k = 0.0000 0.3927-0.0000 ( 2488 PWs) bands (ev): -11.8988 -11.8987 -10.9738 -10.9736 -10.0894 -10.0890 -6.2564 -6.2562 -3.9037 -3.9027 -3.7068 -3.7059 0.3667 0.3671 2.4057 2.4071 2.9286 2.9291 3.9695 3.9744 4.0979 4.1022 4.4679 4.4693 4.8682 4.8701 5.7507 5.7509 7.5991 7.5997 8.3269 8.3272 9.2245 9.2265 10.1747 10.1768 11.2090 11.2092 12.3537 12.3556 12.5279 12.5368 12.6032 12.6111 13.0628 13.0646 13.8548 13.8556 14.2123 14.2128 15.2554 15.2558 17.4382 17.4390 19.9141 19.9150 20.5431 20.5439 k = 0.0000 0.4014-0.0000 ( 2486 PWs) bands (ev): -11.8901 -11.8901 -10.9792 -10.9791 -10.0917 -10.0915 -6.2569 -6.2568 -3.8826 -3.8819 -3.7305 -3.7299 0.3642 0.3644 2.4093 2.4100 2.9301 2.9304 3.9831 3.9861 4.0902 4.0928 4.4634 4.4641 4.8647 4.8656 5.7483 5.7484 7.6108 7.6111 8.3192 8.3193 9.2278 9.2288 10.1713 10.1724 11.2100 11.2101 12.3613 12.3623 12.5399 12.5463 12.5920 12.5979 13.0615 13.0624 13.8543 13.8547 14.2122 14.2124 15.2569 15.2571 17.4394 17.4398 19.9071 19.9076 20.5481 20.5485 k = 0.0000 0.4101-0.0000 ( 2486 PWs) bands (ev): -11.8871 -11.8871 -10.9810 -10.9810 -10.0923 -10.0923 -6.2570 -6.2570 -3.8736 -3.8736 -3.7398 -3.7398 0.3634 0.3634 2.4107 2.4107 2.9307 2.9307 3.9894 3.9894 4.0880 4.0880 4.4621 4.4621 4.8638 4.8638 5.7476 5.7476 7.6149 7.6149 8.3166 8.3166 9.2293 9.2293 10.1706 10.1706 11.2104 11.2104 12.3643 12.3643 12.5473 12.5473 12.5902 12.5902 13.0613 13.0613 13.8542 13.8542 14.2122 14.2122 15.2574 15.2574 17.4399 17.4399 19.9049 19.9049 20.5500 20.5500 k = 0.5000 0.4101-0.0000 ( 2488 PWs) bands (ev): -11.0327 -11.0327 -10.0902 -10.0902 -9.6952 -9.6952 -5.8041 -5.8041 -3.2035 -3.2035 -3.0071 -3.0071 -1.2091 -1.2091 0.6951 0.6951 1.1645 1.1645 2.5321 2.5321 3.9843 3.9843 4.3780 4.3780 4.8927 4.8927 5.6232 5.6232 7.2764 7.2764 7.3261 7.3261 7.7654 7.7654 9.3256 9.3256 9.8541 9.8541 10.2039 10.2039 10.6575 10.6575 13.3002 13.3002 13.4989 13.4989 13.9324 13.9324 15.9215 15.9215 16.8125 16.8125 18.8485 18.8485 19.7029 19.7029 20.9642 20.9642 k = 0.4932 0.4045-0.0000 ( 2488 PWs) bands (ev): -11.0334 -11.0334 -10.0914 -10.0911 -9.6953 -9.6949 -5.8041 -5.8040 -3.2039 -3.2039 -3.0074 -3.0073 -1.2075 -1.2073 0.6955 0.6956 1.1651 1.1652 2.5325 2.5330 3.9828 3.9833 4.3775 4.3783 4.8938 4.8945 5.6234 5.6236 7.2747 7.2750 7.3275 7.3277 7.7683 7.7684 9.3240 9.3243 9.8554 9.8563 10.2022 10.2036 10.6586 10.6601 13.2984 13.2994 13.4994 13.5001 13.9324 13.9333 15.9209 15.9211 16.8118 16.8121 18.8476 18.8481 19.7025 19.7028 20.9634 20.9635 k = 0.4863 0.3989-0.0000 ( 2490 PWs) bands (ev): -11.0356 -11.0355 -10.0944 -10.0939 -9.6950 -9.6944 -5.8040 -5.8039 -3.2051 -3.2050 -3.0083 -3.0081 -1.2027 -1.2023 0.6968 0.6971 1.1669 1.1672 2.5343 2.5353 3.9789 3.9799 4.3770 4.3785 4.8978 4.8991 5.6243 5.6246 7.2698 7.2705 7.3323 7.3327 7.7767 7.7770 9.3195 9.3201 9.8599 9.8617 10.1986 10.2012 10.6633 10.6661 13.2939 13.2959 13.5017 13.5030 13.9331 13.9349 15.9192 15.9198 16.8099 16.8105 18.8455 18.8464 19.7017 19.7023 20.9610 20.9613 k = 0.4795 0.3933-0.0000 ( 2490 PWs) bands (ev): -11.0392 -11.0391 -10.0994 -10.0986 -9.6946 -9.6936 -5.8039 -5.8037 -3.2071 -3.2070 -3.0096 -3.0094 -1.1946 -1.1940 0.6990 0.6995 1.1700 1.1704 2.5375 2.5389 3.9725 3.9741 4.3763 4.3785 4.9046 4.9066 5.6257 5.6261 7.2617 7.2626 7.3410 7.3415 7.7904 7.7908 9.3125 9.3133 9.8671 9.8698 10.1935 10.1973 10.6714 10.6755 13.2869 13.2898 13.5056 13.5074 13.9347 13.9373 15.9167 15.9175 16.8069 16.8078 18.8421 18.8434 19.7004 19.7013 20.9572 20.9575 k = 0.4726 0.3876-0.0000 ( 2490 PWs) bands (ev): -11.0443 -11.0441 -10.1061 -10.1051 -9.6939 -9.6926 -5.8037 -5.8035 -3.2100 -3.2099 -3.0113 -3.0110 -1.1833 -1.1824 0.7022 0.7028 1.1743 1.1749 2.5419 2.5439 3.9639 3.9659 4.3757 4.3786 4.9142 4.9167 5.6276 5.6283 7.2506 7.2517 7.3538 7.3545 7.8085 7.8091 9.3035 9.3046 9.8759 9.8797 10.1876 10.1925 10.6829 10.6881 13.2776 13.2813 13.5111 13.5133 13.9369 13.9403 15.9131 15.9143 16.8028 16.8040 18.8375 18.8392 19.6986 19.6997 20.9518 20.9523 k = 0.4658 0.3820-0.0000 ( 2487 PWs) bands (ev): -11.0510 -11.0507 -10.1145 -10.1132 -9.6931 -9.6915 -5.8034 -5.8032 -3.2140 -3.2138 -3.0133 -3.0129 -1.1687 -1.1676 0.7064 0.7071 1.1800 1.1807 2.5477 2.5501 3.9530 3.9555 4.3752 4.3787 4.9263 4.9294 5.6301 5.6309 7.2373 7.2387 7.3708 7.3716 7.8304 7.8311 9.2931 9.2944 9.8853 9.8901 10.1818 10.1876 10.6975 10.7037 13.2662 13.2707 13.5178 13.5204 13.9398 13.9439 15.9086 15.9101 16.7977 16.7992 18.8317 18.8338 19.6961 19.6975 20.9452 20.9458 k = 0.4589 0.3764-0.0000 ( 2487 PWs) bands (ev): -11.0592 -11.0589 -10.1243 -10.1229 -9.6922 -9.6903 -5.8032 -5.8029 -3.2190 -3.2189 -3.0154 -3.0149 -1.1510 -1.1497 0.7115 0.7123 1.1869 1.1878 2.5547 2.5576 3.9399 3.9428 4.3749 4.3789 4.9407 4.9443 5.6330 5.6340 7.2226 7.2242 7.3917 7.3926 7.8553 7.8563 9.2819 9.2833 9.8937 9.8996 10.1772 10.1837 10.7150 10.7220 13.2529 13.2581 13.5256 13.5285 13.9432 13.9480 15.9031 15.9049 16.7917 16.7935 18.8247 18.8272 19.6928 19.6945 20.9372 20.9379 k = 0.4521 0.3708-0.0000 ( 2487 PWs) bands (ev): -11.0690 -11.0687 -10.1354 -10.1338 -9.6912 -9.6891 -5.8029 -5.8026 -3.2254 -3.2252 -3.0174 -3.0169 -1.1301 -1.1286 0.7176 0.7186 1.1951 1.1961 2.5629 2.5662 3.9247 3.9280 4.3749 4.3794 4.9573 4.9615 5.6363 5.6374 7.2072 7.2090 7.4164 7.4174 7.8828 7.8840 9.2704 9.2720 9.8995 9.9066 10.1750 10.1820 10.7353 10.7430 13.2378 13.2436 13.5344 13.5375 13.9471 13.9524 15.8967 15.8988 16.7848 16.7869 18.8166 18.8195 19.6887 19.6906 20.9281 20.9289 k = 0.4452 0.3652-0.0000 ( 2478 PWs) bands (ev): -11.0806 -11.0802 -10.1476 -10.1459 -9.6902 -9.6879 -5.8026 -5.8023 -3.2332 -3.2330 -3.0192 -3.0186 -1.1060 -1.1043 0.7247 0.7258 1.2046 1.2058 2.5723 2.5760 3.9077 3.9113 4.3753 4.3803 4.9759 4.9805 5.6398 5.6412 7.1917 7.1937 7.4445 7.4457 7.9123 7.9137 9.2591 9.2608 9.9016 9.9096 10.1765 10.1837 10.7582 10.7664 13.2211 13.2275 13.5440 13.5473 13.9512 13.9571 15.8894 15.8917 16.7772 16.7796 18.8075 18.8107 19.6837 19.6857 20.9180 20.9189 k = 0.4384 0.3596-0.0000 ( 2470 PWs) bands (ev): -11.0939 -11.0935 -10.1607 -10.1589 -9.6892 -9.6867 -5.8023 -5.8020 -3.2426 -3.2423 -3.0206 -3.0199 -1.0790 -1.0771 0.7328 0.7341 1.2154 1.2167 2.5827 2.5869 3.8888 3.8927 4.3761 4.3815 4.9962 5.0013 5.6436 5.6451 7.1766 7.1788 7.4760 7.4773 7.9433 7.9450 9.2485 9.2504 9.8989 9.9078 10.1823 10.1895 10.7835 10.7922 13.2029 13.2098 13.5543 13.5577 13.9554 13.9617 15.8811 15.8837 16.7689 16.7716 18.7973 18.8009 19.6776 19.6798 20.9070 20.9080 k = 0.4315 0.3539-0.0000 ( 2472 PWs) bands (ev): -11.1091 -11.1086 -10.1746 -10.1726 -9.6882 -9.6856 -5.8021 -5.8017 -3.2537 -3.2534 -3.0214 -3.0207 -1.0490 -1.0469 0.7420 0.7434 1.2275 1.2290 2.5941 2.5987 3.8682 3.8725 4.3775 4.3832 5.0180 5.0235 5.6475 5.6492 7.1622 7.1646 7.5106 7.5120 7.9757 7.9776 9.2389 9.2409 9.8913 9.9008 10.1925 10.1995 10.8112 10.8203 13.1834 13.1907 13.5650 13.5686 13.9597 13.9664 15.8719 15.8748 16.7601 16.7631 18.7861 18.7900 19.6702 19.6726 20.8953 20.8964 k = 0.4247 0.3483-0.0000 ( 2470 PWs) bands (ev): -11.1262 -11.1256 -10.1889 -10.1869 -9.6873 -9.6845 -5.8020 -5.8015 -3.2665 -3.2661 -3.0216 -3.0208 -1.0161 -1.0138 0.7522 0.7537 1.2409 1.2425 2.6065 2.6114 3.8462 3.8507 4.3794 4.3854 5.0412 5.0471 5.6513 5.6532 7.1488 7.1514 7.5479 7.5495 8.0091 8.0112 9.2306 9.2329 9.8791 9.8890 10.2065 10.2131 10.8411 10.8504 13.1625 13.1702 13.5762 13.5799 13.9639 13.9708 15.8618 15.8649 16.7508 16.7541 18.7740 18.7782 19.6617 19.6641 20.8829 20.8841 k = 0.4178 0.3427-0.0000 ( 2464 PWs) bands (ev): -11.1452 -11.1446 -10.2036 -10.2016 -9.6865 -9.6836 -5.8019 -5.8013 -3.2810 -3.2806 -3.0210 -3.0202 -0.9804 -0.9779 0.7634 0.7651 1.2556 1.2574 2.6197 2.6250 3.8228 3.8275 4.3818 4.3882 5.0655 5.0719 5.6551 5.6572 7.1368 7.1396 7.5878 7.5896 8.0433 8.0458 9.2240 9.2264 9.8631 9.8733 10.2236 10.2298 10.8732 10.8826 13.1404 13.1485 13.5877 13.5916 13.9678 13.9749 15.8507 15.8541 16.7411 16.7447 18.7611 18.7655 19.6519 19.6544 20.8701 20.8713 k = 0.4110 0.3371-0.0000 ( 2458 PWs) bands (ev): -11.1663 -11.1656 -10.2185 -10.2165 -9.6856 -9.6826 -5.8019 -5.8013 -3.2973 -3.2968 -3.0196 -3.0187 -0.9419 -0.9393 0.7757 0.7775 1.2715 1.2735 2.6338 2.6394 3.7982 3.8032 4.3849 4.3915 5.0908 5.0975 5.6587 5.6610 7.1263 7.1293 7.6298 7.6319 8.0784 8.0812 9.2193 9.2218 9.8442 9.8545 10.2429 10.2486 10.9072 10.9168 13.1172 13.1255 13.5993 13.6034 13.9713 13.9785 15.8388 15.8424 16.7312 16.7350 18.7474 18.7520 19.6407 19.6433 20.8570 20.8584 k = 0.4041 0.3315-0.0000 ( 2462 PWs) bands (ev): -11.1893 -11.1886 -10.2335 -10.2315 -9.6848 -9.6818 -5.8020 -5.8014 -3.3153 -3.3147 -3.0174 -3.0164 -0.9009 -0.8982 0.7891 0.7909 1.2887 1.2909 2.6485 2.6545 3.7726 3.7778 4.3885 4.3954 5.1169 5.1239 5.6621 5.6646 7.1175 7.1206 7.6737 7.6760 8.1142 8.1173 9.2166 9.2192 9.8231 9.8334 10.2637 10.2689 10.9431 10.9527 13.0928 13.1014 13.6109 13.6153 13.9743 13.9817 15.8259 15.8298 16.7210 16.7251 18.7330 18.7378 19.6282 19.6308 20.8438 20.8452 k = 0.3973 0.3258-0.0000 ( 2460 PWs) bands (ev): -11.2144 -11.2137 -10.2485 -10.2464 -9.6840 -9.6809 -5.8023 -5.8017 -3.3348 -3.3342 -3.0143 -3.0133 -0.8574 -0.8545 0.8034 0.8054 1.3072 1.3095 2.6640 2.6702 3.7462 3.7516 4.3928 4.3998 5.1436 5.1510 5.6652 5.6678 7.1103 7.1136 7.7189 7.7215 8.1508 8.1542 9.2161 9.2189 9.8005 9.8109 10.2854 10.2903 10.9807 10.9903 13.0675 13.0763 13.6224 13.6271 13.9768 13.9842 15.8121 15.8162 16.7107 16.7150 18.7178 18.7228 19.6144 19.6170 20.8307 20.8321 k = 0.3904 0.3202-0.0000 ( 2462 PWs) bands (ev): -11.2416 -11.2408 -10.2634 -10.2613 -9.6831 -9.6799 -5.8028 -5.8021 -3.3558 -3.3552 -3.0104 -3.0093 -0.8116 -0.8085 0.8188 0.8209 1.3268 1.3293 2.6799 2.6864 3.7193 3.7248 4.3977 4.4049 5.1707 5.1785 5.6678 5.6706 7.1049 7.1084 7.7651 7.7680 8.1882 8.1920 9.2178 9.2207 9.7771 9.7875 10.3078 10.3123 11.0198 11.0295 13.0411 13.0501 13.6335 13.6387 13.9786 13.9860 15.7974 15.8017 16.7003 16.7049 18.7021 18.7072 19.5994 19.6020 20.8179 20.8193 k = 0.3836 0.3146-0.0000 ( 2458 PWs) bands (ev): -11.2707 -11.2699 -10.2781 -10.2760 -9.6821 -9.6789 -5.8035 -5.8027 -3.3782 -3.3775 -3.0057 -3.0046 -0.7634 -0.7602 0.8352 0.8373 1.3477 1.3503 2.6964 2.7031 3.6919 3.6976 4.4031 4.4105 5.1982 5.2062 5.6701 5.6730 7.1013 7.1049 7.8116 7.8150 8.2265 8.2307 9.2219 9.2250 9.7535 9.7638 10.3305 10.3347 11.0603 11.0699 13.0139 13.0230 13.6442 13.6498 13.9798 13.9871 15.7817 15.7863 16.6898 16.6946 18.6857 18.6910 19.5833 19.5858 20.8055 20.8070 k = 0.3767 0.3090-0.0000 ( 2457 PWs) bands (ev): -11.3018 -11.3010 -10.2926 -10.2905 -9.6810 -9.6777 -5.8044 -5.8036 -3.4018 -3.4010 -3.0003 -2.9991 -0.7132 -0.7098 0.8525 0.8547 1.3696 1.3725 2.7133 2.7202 3.6643 3.6702 4.4091 4.4166 5.2257 5.2341 5.6720 5.6750 7.0993 7.1030 7.8581 7.8618 8.2659 8.2704 9.2283 9.2316 9.7302 9.7404 10.3535 10.3574 11.1019 11.1114 12.9858 12.9951 13.6541 13.6603 13.9803 13.9876 15.7651 15.7699 16.6792 16.6842 18.6688 18.6742 19.5661 19.5687 20.7940 20.7955 k = 0.3699 0.3034-0.0000 ( 2461 PWs) bands (ev): -11.3348 -11.3339 -10.3068 -10.3048 -9.6796 -9.6763 -5.8055 -5.8047 -3.4264 -3.4256 -2.9941 -2.9929 -0.6609 -0.6575 0.8706 0.8729 1.3927 1.3957 2.7304 2.7375 3.6368 3.6428 4.4157 4.4233 5.2533 5.2620 5.6734 5.6766 7.0989 7.1027 7.9039 7.9080 8.3065 8.3114 9.2370 9.2404 9.7077 9.7177 10.3768 10.3805 11.1445 11.1539 12.9569 12.9662 13.6631 13.6700 13.9802 13.9874 15.7476 15.7525 16.6686 16.6738 18.6513 18.6568 19.5481 19.5507 20.7833 20.7849 k = 0.3630 0.2978-0.0000 ( 2461 PWs) bands (ev): -11.3696 -11.3687 -10.3209 -10.3189 -9.6780 -9.6746 -5.8069 -5.8060 -3.4520 -3.4511 -2.9872 -2.9859 -0.6068 -0.6032 0.8896 0.8920 1.4168 1.4200 2.7476 2.7548 3.6096 3.6157 4.4227 4.4304 5.2808 5.2898 5.6745 5.6777 7.0999 7.1039 7.9485 7.9531 8.3486 8.3538 9.2478 9.2513 9.6868 9.6966 10.4004 10.4038 11.1878 11.1971 12.9273 12.9367 13.6710 13.6785 13.9796 13.9868 15.7291 15.7342 16.6579 16.6633 18.6333 18.6388 19.5294 19.5320 20.7740 20.7756 k = 0.3562 0.2921-0.0000 ( 2466 PWs) bands (ev): -11.4060 -11.4051 -10.3348 -10.3328 -9.6761 -9.6726 -5.8086 -5.8077 -3.4783 -3.4774 -2.9796 -2.9784 -0.5509 -0.5472 0.9093 0.9118 1.4419 1.4453 2.7648 2.7721 3.5830 3.5893 4.4303 4.4380 5.3080 5.3172 5.6752 5.6786 7.1022 7.1063 7.9914 7.9964 8.3921 8.3976 9.2602 9.2638 9.6681 9.6776 10.4242 10.4275 11.2316 11.2408 12.8969 12.9064 13.6774 13.6857 13.9785 13.9856 15.7095 15.7148 16.6470 16.6526 18.6146 18.6201 19.5103 19.5130 20.7662 20.7678 k = 0.3493 0.2865-0.0000 ( 2466 PWs) bands (ev): -11.4441 -11.4431 -10.3485 -10.3466 -9.6737 -9.6703 -5.8106 -5.8096 -3.5053 -3.5043 -2.9714 -2.9701 -0.4934 -0.4897 0.9297 0.9322 1.4680 1.4716 2.7817 2.7891 3.5574 3.5637 4.4383 4.4460 5.3348 5.3442 5.6758 5.6791 7.1055 7.1097 8.0322 8.0376 8.4372 8.4429 9.2738 9.2775 9.6527 9.6618 10.4485 10.4516 11.2758 11.2849 12.8660 12.8754 13.6822 13.6913 13.9772 13.9843 15.6889 15.6943 16.6360 16.6417 18.5953 18.6008 19.4909 19.4937 20.7602 20.7619 k = 0.3425 0.2809-0.0000 ( 2462 PWs) bands (ev): -11.4835 -11.4826 -10.3621 -10.3602 -9.6709 -9.6675 -5.8129 -5.8119 -3.5328 -3.5318 -2.9626 -2.9613 -0.4345 -0.4306 0.9506 0.9533 1.4950 1.4989 2.7982 2.8055 3.5331 3.5395 4.4467 4.4545 5.3609 5.3706 5.6763 5.6796 7.1096 7.1140 8.0706 8.0763 8.4837 8.4897 9.2877 9.2915 9.6418 9.6503 10.4733 10.4762 11.3202 11.3291 12.8345 12.8439 13.6851 13.6949 13.9757 13.9830 15.6672 15.6728 16.6248 16.6307 18.5752 18.5806 19.4717 19.4747 20.7564 20.7582 k = 0.3356 0.2753-0.0000 ( 2466 PWs) bands (ev): -11.5243 -11.5234 -10.3757 -10.3739 -9.6676 -9.6642 -5.8156 -5.8146 -3.5607 -3.5596 -2.9532 -2.9519 -0.3742 -0.3702 0.9720 0.9747 1.5229 1.5270 2.8138 2.8211 3.5106 3.5169 4.4556 4.4634 5.3864 5.3962 5.6768 5.6801 7.1143 7.1187 8.1064 8.1124 8.5315 8.5376 9.3008 9.3047 9.6367 9.6445 10.4987 10.5014 11.3645 11.3733 12.8024 12.8118 13.6857 13.6963 13.9744 13.9817 15.6444 15.6501 16.6132 16.6193 18.5542 18.5596 19.4530 19.4561 20.7550 20.7568 k = 0.3288 0.2697-0.0000 ( 2460 PWs) bands (ev): -11.5663 -11.5653 -10.3893 -10.3875 -9.6638 -9.6604 -5.8186 -5.8176 -3.5888 -3.5877 -2.9433 -2.9419 -0.3126 -0.3086 0.9937 0.9965 1.5517 1.5560 2.8283 2.8353 3.4903 3.4966 4.4648 4.4726 5.4108 5.4208 5.6777 5.6808 7.1192 7.1238 8.1395 8.1458 8.5803 8.5865 9.3117 9.3159 9.6390 9.6458 10.5248 10.5274 11.4088 11.4174 12.7700 12.7792 13.6841 13.6953 13.9734 13.9808 15.6203 15.6262 16.6013 16.6075 18.5322 18.5375 19.4350 19.4384 20.7563 20.7581 k = 0.3219 0.2640-0.0000 ( 2460 PWs) bands (ev): -11.6093 -11.6084 -10.4029 -10.4011 -9.6595 -9.6560 -5.8221 -5.8209 -3.6170 -3.6159 -2.9328 -2.9314 -0.2500 -0.2459 1.0156 1.0185 1.5814 1.5859 2.8412 2.8479 3.4728 3.4789 4.4745 4.4822 5.4342 5.4441 5.6791 5.6821 7.1242 7.1289 8.1700 8.1766 8.6299 8.6360 9.3192 9.3238 9.6500 9.6557 10.5516 10.5541 11.4527 11.4612 12.7371 12.7463 13.6799 13.6917 13.9729 13.9804 15.5951 15.6010 16.5890 16.5953 18.5089 18.5141 19.4184 19.4221 20.7604 20.7624 k = 0.3151 0.2584-0.0000 ( 2460 PWs) bands (ev): -11.6532 -11.6523 -10.4166 -10.4149 -9.6545 -9.6511 -5.8259 -5.8247 -3.6453 -3.6440 -2.9218 -2.9204 -0.1864 -0.1823 1.0376 1.0406 1.6119 1.6166 2.8520 2.8584 3.4585 3.4643 4.4845 4.4921 5.4560 5.4660 5.6813 5.6841 7.1289 7.1336 8.1979 8.2047 8.6798 8.6858 9.3229 9.3280 9.6702 9.6748 10.5794 10.5818 11.4962 11.5046 12.7039 12.7130 13.6731 13.6854 13.9729 13.9805 15.5685 15.5745 16.5762 16.5826 18.4842 18.4894 19.4034 19.4074 20.7676 20.7696 k = 0.3082 0.2528-0.0000 ( 2455 PWs) bands (ev): -11.6978 -11.6969 -10.4305 -10.4288 -9.6489 -9.6455 -5.8301 -5.8289 -3.6733 -3.6721 -2.9103 -2.9089 -0.1220 -0.1178 1.0595 1.0627 1.6431 1.6480 2.8604 2.8663 3.4480 3.4535 4.4949 4.5024 5.4762 5.4860 5.6846 5.6872 7.1330 7.1378 8.2234 8.2303 8.7298 8.7357 9.3230 9.3286 9.6995 9.7031 10.6082 10.6104 11.5393 11.5475 12.6705 12.6794 13.6638 13.6764 13.9736 13.9812 15.5407 15.5467 16.5627 16.5692 18.4580 18.4631 19.3907 19.3950 20.7781 20.7801 k = 0.3014 0.2472-0.0000 ( 2457 PWs) bands (ev): -11.7431 -11.7423 -10.4445 -10.4429 -9.6427 -9.6393 -5.8347 -5.8334 -3.7012 -3.6999 -2.8983 -2.8969 -0.0569 -0.0527 1.0813 1.0846 1.6751 1.6803 2.8660 2.8713 3.4416 3.4466 4.5057 4.5131 5.4944 5.5039 5.6893 5.6920 7.1364 7.1413 8.2465 8.2536 8.7797 8.7854 9.3203 9.3263 9.7368 9.7395 10.6379 10.6400 11.5818 11.5899 12.6368 12.6456 13.6520 13.6647 13.9749 13.9825 15.5114 15.5175 16.5486 16.5552 18.4300 18.4351 19.3805 19.3851 20.7918 20.7939 k = 0.2945 0.2416-0.0000 ( 2456 PWs) bands (ev): -11.7889 -11.7881 -10.4588 -10.4573 -9.6358 -9.6325 -5.8397 -5.8384 -3.7288 -3.7275 -2.8859 -2.8845 0.0087 0.0130 1.1028 1.1063 1.7079 1.7133 2.8686 2.8732 3.4395 3.4442 4.5169 4.5241 5.5103 5.5194 5.6957 5.6986 7.1388 7.1437 8.2674 8.2746 8.8292 8.8347 9.3158 9.3221 9.7809 9.7831 10.6688 10.6707 11.6236 11.6316 12.6031 12.6117 13.6379 13.6507 13.9767 13.9841 15.4807 15.4868 16.5338 16.5404 18.4002 18.4052 19.3735 19.3784 20.8088 20.8109 k = 0.2877 0.2360-0.0000 ( 2458 PWs) bands (ev): -11.8351 -11.8342 -10.4733 -10.4718 -9.6283 -9.6250 -5.8451 -5.8438 -3.7559 -3.7545 -2.8731 -2.8717 0.0747 0.0791 1.1239 1.1275 1.7413 1.7469 2.8681 2.8720 3.4418 3.4461 4.5286 4.5356 5.5238 5.5323 5.7040 5.7074 7.1399 7.1448 8.2861 8.2934 8.8783 8.8836 9.3104 9.3169 9.8306 9.8324 10.7008 10.7026 11.6649 11.6726 12.5693 12.5777 13.6217 13.6344 13.9789 13.9861 15.4486 15.4547 16.5181 16.5248 18.3685 18.3735 19.3698 19.3750 20.8290 20.8312 k = 0.2808 0.2303-0.0000 ( 2462 PWs) bands (ev): -11.8815 -11.8807 -10.4880 -10.4866 -9.6202 -9.6169 -5.8509 -5.8496 -3.7825 -3.7811 -2.8599 -2.8585 0.1411 0.1454 1.1446 1.1483 1.7754 1.7811 2.8647 2.8679 3.4483 3.4523 4.5408 4.5476 5.5348 5.5428 5.7141 5.7183 7.1396 7.1446 8.3027 8.3100 8.9269 8.9320 9.3048 9.3115 9.8848 9.8864 10.7339 10.7356 11.7054 11.7130 12.5356 12.5437 13.6036 13.6162 13.9813 13.9883 15.4150 15.4210 16.5017 16.5083 18.3349 18.3399 19.3699 19.3753 20.8523 20.8545 k = 0.2740 0.2247-0.0000 ( 2465 PWs) bands (ev): -11.9280 -11.9272 -10.5030 -10.5016 -9.6115 -9.6082 -5.8571 -5.8558 -3.8085 -3.8071 -2.8464 -2.8449 0.2075 0.2118 1.1647 1.1686 1.8099 1.8159 2.8587 2.8613 3.4584 3.4624 4.5535 4.5601 5.5435 5.5510 5.7262 5.7311 7.1378 7.1428 8.3173 8.3247 8.9752 8.9801 9.2997 9.3065 9.9424 9.9440 10.7682 10.7698 11.7453 11.7527 12.5020 12.5099 13.5839 13.5962 13.9839 13.9906 15.3799 15.3859 16.4843 16.4910 18.2995 18.3045 19.3740 19.3796 20.8783 20.8805 k = 0.2671 0.2191-0.0000 ( 2463 PWs) bands (ev): -11.9745 -11.9738 -10.5182 -10.5169 -9.6022 -9.5989 -5.8638 -5.8624 -3.8339 -3.8325 -2.8325 -2.8310 0.2738 0.2781 1.1843 1.1883 1.8449 1.8510 2.8508 2.8529 3.4717 3.4758 4.5669 4.5732 5.5504 5.5575 5.7397 5.7455 7.1344 7.1394 8.3298 8.3373 9.0231 9.0277 9.2954 9.3022 10.0025 10.0043 10.8036 10.8051 11.7846 11.7918 12.4688 12.4764 13.5628 13.5749 13.9864 13.9929 15.3433 15.3492 16.4662 16.4728 18.2625 18.2676 19.3822 19.3880 20.9066 20.9088 k = 0.2603 0.2135-0.0000 ( 2459 PWs) bands (ev): -12.0210 -12.0202 -10.5336 -10.5323 -9.5923 -9.5890 -5.8708 -5.8694 -3.8585 -3.8571 -2.8182 -2.8168 0.3399 0.3442 1.2033 1.2075 1.8800 1.8863 2.8416 2.8434 3.4875 3.4920 4.5810 4.5871 5.5558 5.5625 5.7545 5.7611 7.1292 7.1343 8.3405 8.3479 9.0707 9.0752 9.2922 9.2989 10.0643 10.0663 10.8400 10.8414 11.8233 11.8303 12.4360 12.4433 13.5405 13.5523 13.9888 13.9951 15.3053 15.3111 16.4471 16.4537 18.2241 18.2292 19.3946 19.4006 20.9363 20.9386 k = 0.2534 0.2079-0.0000 ( 2461 PWs) bands (ev): -12.0672 -12.0665 -10.5493 -10.5481 -9.5819 -9.5786 -5.8781 -5.8767 -3.8824 -3.8810 -2.8037 -2.8023 0.4054 0.4097 1.2218 1.2261 1.9151 1.9216 2.8317 2.8336 3.5052 3.5102 4.5959 4.6017 5.5601 5.5666 5.7702 5.7773 7.1223 7.1274 8.3492 8.3567 9.1181 9.1224 9.2903 9.2968 10.1269 10.1292 10.8774 10.8788 11.8613 11.8681 12.4038 12.4108 13.5173 13.5287 13.9909 13.9970 15.2657 15.2714 16.4272 16.4337 18.1846 18.1897 19.4113 19.4174 20.9660 20.9683 k = 0.2466 0.2022-0.0000 ( 2460 PWs) bands (ev): -12.1132 -12.1125 -10.5651 -10.5640 -9.5710 -9.5678 -5.8858 -5.8844 -3.9055 -3.9041 -2.7890 -2.7875 0.4701 0.4744 1.2400 1.2444 1.9499 1.9565 2.8220 2.8240 3.5243 3.5298 4.6115 4.6172 5.5638 5.5701 5.7863 5.7940 7.1136 7.1187 8.3560 8.3635 9.1653 9.1694 9.2898 9.2962 10.1897 10.1923 10.9155 10.9170 11.8987 11.9054 12.3726 12.3792 13.4934 13.5044 13.9928 13.9986 15.2247 15.2303 16.4065 16.4129 18.1442 18.1493 19.4321 19.4383 20.9924 20.9948 k = 0.2397 0.1966-0.0000 ( 2460 PWs) bands (ev): -12.1588 -12.1581 -10.5812 -10.5800 -9.5596 -9.5565 -5.8938 -5.8924 -3.9277 -3.9263 -2.7740 -2.7726 0.5338 0.5380 1.2579 1.2624 1.9841 1.9909 2.8132 2.8155 3.5441 3.5501 4.6280 4.6336 5.5673 5.5733 5.8027 5.8108 7.1032 7.1083 8.3610 8.3685 9.2121 9.2162 9.2910 9.2971 10.2520 10.2549 10.9544 10.9560 11.9354 11.9418 12.3428 12.3489 13.4688 13.4795 13.9943 13.9999 15.1824 15.1878 16.3850 16.3913 18.1032 18.1084 19.4570 19.4633 21.0085 21.0110 k = 0.2329 0.1910-0.0000 ( 2462 PWs) bands (ev): -12.2039 -12.2032 -10.5973 -10.5962 -9.5479 -9.5448 -5.9021 -5.9007 -3.9490 -3.9476 -2.7588 -2.7574 0.5960 0.6001 1.2759 1.2804 2.0172 2.0242 2.8062 2.8088 3.5641 3.5707 4.6453 4.6508 5.5707 5.5767 5.8191 5.8276 7.0910 7.0961 8.3643 8.3718 9.2566 9.2615 9.2955 9.3011 10.3131 10.3164 10.9937 10.9954 11.9710 11.9772 12.3149 12.3205 13.4439 13.4542 13.9953 14.0007 15.1388 15.1440 16.3628 16.3690 18.0620 18.0672 19.4859 19.4922 21.0027 21.0050 k = 0.2260 0.1854-0.0000 ( 2460 PWs) bands (ev): -12.2484 -12.2478 -10.6135 -10.6125 -9.5358 -9.5328 -5.9107 -5.9093 -3.9694 -3.9680 -2.7435 -2.7421 0.6563 0.6602 1.2941 1.2988 2.0488 2.0560 2.8017 2.8046 3.5839 3.5910 4.6634 4.6689 5.5745 5.5803 5.8354 5.8441 7.0772 7.0823 8.3660 8.3735 9.2853 9.2922 9.3171 9.3211 10.3724 10.3761 11.0331 11.0351 12.0047 12.0107 12.2902 12.2953 13.4188 13.4287 13.9958 14.0011 15.0940 15.0990 16.3400 16.3461 18.0208 18.0261 19.5186 19.5249 20.9700 20.9715 k = 0.2192 0.1798-0.0000 ( 2462 PWs) bands (ev): -12.2923 -12.2917 -10.6298 -10.6288 -9.5234 -9.5204 -5.9195 -5.9181 -3.9888 -3.9875 -2.7280 -2.7267 0.7141 0.7178 1.3131 1.3178 2.0785 2.0858 2.8005 2.8037 3.6031 3.6107 4.6821 4.6878 5.5787 5.5844 5.8515 5.8604 7.0617 7.0669 8.3661 8.3735 9.2939 9.3004 9.3609 9.3640 10.4294 10.4335 11.0725 11.0747 12.0348 12.0407 12.2707 12.2752 13.3936 13.4031 13.9957 14.0009 15.0481 15.0529 16.3167 16.3226 17.9800 17.9853 19.5548 19.5611 20.9190 20.9199 k = 0.2123 0.1742-0.0000 ( 2458 PWs) bands (ev): -12.3355 -12.3349 -10.6461 -10.6452 -9.5108 -9.5079 -5.9285 -5.9272 -4.0074 -4.0060 -2.7125 -2.7111 0.7688 0.7723 1.3333 1.3380 2.1058 2.1133 2.8033 2.8067 3.6215 3.6296 4.7013 4.7072 5.5837 5.5894 5.8672 5.8763 7.0448 7.0500 8.3648 8.3722 9.2999 9.3060 9.4080 9.4109 10.4838 10.4883 11.1114 11.1140 12.0579 12.0639 12.2598 12.2643 13.3683 13.3775 13.9951 14.0002 15.0014 15.0060 16.2929 16.2987 17.9399 17.9451 19.5944 19.6006 20.8591 20.8598 k = 0.2055 0.1685-0.0000 ( 2460 PWs) bands (ev): -12.3779 -12.3774 -10.6624 -10.6615 -9.4979 -9.4951 -5.9377 -5.9363 -4.0250 -4.0236 -2.6968 -2.6955 0.8197 0.8229 1.3554 1.3600 2.1303 2.1381 2.8105 2.8142 3.6387 3.6473 4.7208 4.7271 5.5896 5.5952 5.8825 5.8917 7.0264 7.0317 8.3623 8.3696 9.3061 9.3120 9.4557 9.4585 10.5350 10.5399 11.1495 11.1523 12.0696 12.0760 12.2623 12.2672 13.3432 13.3520 13.9938 13.9988 14.9540 14.9584 16.2688 16.2744 17.9005 17.9057 19.6371 19.6432 20.7949 20.7958 k = 0.1986 0.1629-0.0000 ( 2460 PWs) bands (ev): -12.4195 -12.4190 -10.6787 -10.6778 -9.4850 -9.4822 -5.9470 -5.9457 -4.0416 -4.0403 -2.6812 -2.6799 0.8660 0.8688 1.3798 1.3845 2.1519 2.1598 2.8225 2.8265 3.6548 3.6638 4.7403 4.7470 5.5966 5.6022 5.8973 5.9066 7.0067 7.0120 8.3586 8.3658 9.3128 9.3185 9.5035 9.5063 10.5828 10.5881 11.1863 11.1894 12.0684 12.0751 12.2804 12.2860 13.3184 13.3267 13.9917 13.9967 14.9062 14.9105 16.2443 16.2498 17.8622 17.8673 19.6825 19.6885 20.7291 20.7302 k = 0.1918 0.1573-0.0000 ( 2458 PWs) bands (ev): -12.4602 -12.4597 -10.6948 -10.6940 -9.4719 -9.4692 -5.9564 -5.9551 -4.0574 -4.0561 -2.6655 -2.6642 0.9069 0.9093 1.4072 1.4120 2.1706 2.1786 2.8395 2.8438 3.6695 3.6789 4.7596 4.7667 5.6050 5.6104 5.9116 5.9211 6.9858 6.9912 8.3539 8.3611 9.3201 9.3257 9.5513 9.5540 10.6269 10.6326 11.2214 11.2249 12.0577 12.0642 12.3116 12.3174 13.2938 13.3017 13.9889 13.9938 14.8582 14.8624 16.2197 16.2250 17.8250 17.8301 19.7303 19.7361 20.6629 20.6642 k = 0.1849 0.1517-0.0000 ( 2458 PWs) bands (ev): -12.4999 -12.4994 -10.7108 -10.7100 -9.4588 -9.4561 -5.9658 -5.9645 -4.0722 -4.0709 -2.6499 -2.6487 0.9418 0.9440 1.4380 1.4429 2.1865 2.1946 2.8615 2.8659 3.6829 3.6926 4.7783 4.7857 5.6150 5.6202 5.9255 5.9351 6.9637 6.9693 8.3484 8.3555 9.3279 9.3333 9.5989 9.6016 10.6671 10.6732 11.2545 11.2583 12.0418 12.0480 12.3516 12.3574 13.2696 13.2772 13.9851 13.9900 14.8104 14.8145 16.1950 16.2001 17.7892 17.7942 19.7797 19.7853 20.5975 20.5990 k = 0.1781 0.1461-0.0000 ( 2456 PWs) bands (ev): -12.5386 -12.5381 -10.7266 -10.7259 -9.4457 -9.4431 -5.9752 -5.9739 -4.0861 -4.0849 -2.6343 -2.6331 0.9705 0.9725 1.4722 1.4773 2.2000 2.2081 2.8880 2.8926 3.6951 3.7051 4.7960 4.8038 5.6265 5.6315 5.9390 5.9487 6.9408 6.9465 8.3422 8.3492 9.3362 9.3414 9.6460 9.6487 10.7033 10.7097 11.2852 11.2892 12.0240 12.0298 12.3973 12.4030 13.2459 13.2531 13.9802 13.9853 14.7632 14.7672 16.1703 16.1751 17.7549 17.7597 19.8299 19.8351 20.5342 20.5360 k = 0.1712 0.1404-0.0000 ( 2459 PWs) bands (ev): -12.5762 -12.5757 -10.7422 -10.7415 -9.4327 -9.4302 -5.9846 -5.9833 -4.0992 -4.0980 -2.6189 -2.6177 0.9929 0.9949 1.5097 1.5151 2.2118 2.2199 2.9186 2.9233 3.7060 3.7162 4.8123 4.8204 5.6398 5.6445 5.9520 5.9619 6.9170 6.9228 8.3354 8.3423 9.3449 9.3500 9.6925 9.6953 10.7354 10.7421 11.3131 11.3173 12.0060 12.0114 12.4470 12.4525 13.2228 13.2296 13.9742 13.9793 14.7168 14.7209 16.1455 16.1502 17.7220 17.7267 19.8793 19.8840 20.4746 20.4769 k = 0.1644 0.1348-0.0000 ( 2462 PWs) bands (ev): -12.6127 -12.6123 -10.7575 -10.7568 -9.4198 -9.4173 -5.9939 -5.9927 -4.1114 -4.1102 -2.6036 -2.6025 1.0093 1.0115 1.5498 1.5556 2.2226 2.2306 2.9526 2.9574 3.7159 3.7263 4.8269 4.8353 5.6547 5.6591 5.9647 5.9748 6.8924 6.8985 8.3283 8.3351 9.3540 9.3589 9.7382 9.7410 10.7633 10.7702 11.3379 11.3422 11.9891 11.9941 12.4998 12.5051 13.2002 13.2067 13.9668 13.9721 14.6719 14.6760 16.1208 16.1253 17.6907 17.6953 19.9251 19.9290 20.4217 20.4247 k = 0.1575 0.1292-0.0000 ( 2460 PWs) bands (ev): -12.6480 -12.6476 -10.7725 -10.7719 -9.4071 -9.4047 -6.0031 -6.0019 -4.1227 -4.1216 -2.5885 -2.5874 1.0204 1.0229 1.5918 1.5981 2.2329 2.2408 2.9894 2.9943 3.7249 3.7354 4.8396 4.8482 5.6713 5.6753 5.9773 5.9875 6.8674 6.8737 8.3210 8.3276 9.3633 9.3681 9.7827 9.7856 10.7872 10.7942 11.3593 11.3638 11.9740 11.9786 12.5548 12.5598 13.1782 13.1844 13.9578 13.9633 14.6287 14.6331 16.0963 16.1006 17.6610 17.6654 19.9624 19.9652 20.3806 20.3846 k = 0.1507 0.1236-0.0000 ( 2460 PWs) bands (ev): -12.6821 -12.6817 -10.7872 -10.7866 -9.3945 -9.3922 -6.0121 -6.0109 -4.1333 -4.1323 -2.5736 -2.5725 1.0269 1.0296 1.6349 1.6416 2.2437 2.2513 3.0282 3.0331 3.7331 3.7438 4.8502 4.8589 5.6893 5.6928 5.9897 6.0002 6.8419 6.8485 8.3135 8.3200 9.3730 9.3776 9.8259 9.8289 10.8071 10.8141 11.3772 11.3817 11.9613 11.9656 12.6115 12.6163 13.1570 13.1629 13.9472 13.9529 14.5879 14.5925 16.0720 16.0760 17.6329 17.6372 19.9836 19.9850 20.3588 20.3642 k = 0.1438 0.1180-0.0000 ( 2458 PWs) bands (ev): -12.7150 -12.7146 -10.8014 -10.8009 -9.3822 -9.3800 -6.0209 -6.0198 -4.1432 -4.1421 -2.5589 -2.5579 1.0294 1.0323 1.6782 1.6852 2.2554 2.2628 3.0685 3.0733 3.7408 3.7515 4.8585 4.8672 5.7083 5.7113 6.0023 6.0131 6.8163 6.8231 8.3060 8.3124 9.3829 9.3874 9.8674 9.8706 10.8232 10.8302 11.3912 11.3957 11.9516 11.9556 12.6694 12.6737 13.1365 13.1422 13.9346 13.9406 14.5499 14.5548 16.0478 16.0517 17.6065 17.6105 19.9814 19.9821 20.3634 20.3702 k = 0.1370 0.1124-0.0000 ( 2455 PWs) bands (ev): -12.7465 -12.7462 -10.8153 -10.8148 -9.3702 -9.3681 -6.0295 -6.0284 -4.1523 -4.1513 -2.5446 -2.5436 1.0285 1.0315 1.7208 1.7282 2.2687 2.2758 3.1094 3.1142 3.7482 3.7589 4.8646 4.8732 5.7278 5.7304 6.0151 6.0263 6.7906 6.7978 8.2987 8.3048 9.3931 9.3975 9.9070 9.9103 10.8357 10.8426 11.4015 11.4059 11.9451 11.9488 12.7278 12.7317 13.1168 13.1224 13.9200 13.9262 14.5152 14.5203 16.0240 16.0276 17.5816 17.5855 19.9563 19.9576 20.3939 20.4015 k = 0.1301 0.1067-0.0000 ( 2453 PWs) bands (ev): -12.7768 -12.7765 -10.8287 -10.8282 -9.3586 -9.3565 -6.0378 -6.0368 -4.1607 -4.1597 -2.5306 -2.5297 1.0249 1.0279 1.7619 1.7696 2.2842 2.2909 3.1504 3.1551 3.7555 3.7661 4.8683 4.8768 5.7474 5.7497 6.0284 6.0400 6.7651 6.7727 8.2916 8.2975 9.4036 9.4079 9.9442 9.9477 10.8451 10.8517 11.4079 11.4121 11.9421 11.9455 12.7863 12.7896 13.0981 13.1036 13.9034 13.9098 14.4840 14.4894 16.0005 16.0039 17.5583 17.5620 19.9164 19.9179 20.4429 20.4508 k = 0.1233 0.1011-0.0000 ( 2453 PWs) bands (ev): -12.8056 -12.8054 -10.8416 -10.8412 -9.3473 -9.3453 -6.0459 -6.0449 -4.1684 -4.1675 -2.5170 -2.5161 1.0189 1.0219 1.8010 1.8088 2.3020 2.3083 3.1909 3.1954 3.7629 3.7735 4.8700 4.8784 5.7663 5.7685 6.0423 6.0543 6.7401 6.7481 8.2847 8.2905 9.4143 9.4185 9.9787 9.9824 10.8516 10.8580 11.4106 11.4146 11.9425 11.9456 12.8441 12.8466 13.0804 13.0862 13.8847 13.8914 14.4566 14.4623 15.9774 15.9806 17.5365 17.5400 19.8685 19.8701 20.5035 20.5115 k = 0.1164 0.0955-0.0000 ( 2454 PWs) bands (ev): -12.8331 -12.8329 -10.8540 -10.8536 -9.3364 -9.3346 -6.0536 -6.0527 -4.1755 -4.1747 -2.5037 -2.5029 1.0110 1.0140 1.8375 1.8454 2.3225 2.3284 3.2302 3.2346 3.7708 3.7812 4.8698 4.8779 5.7840 5.7863 6.0569 6.0695 6.7157 6.7242 8.2783 8.2838 9.4254 9.4294 10.0101 10.0141 10.8559 10.8618 11.4100 11.4138 11.9461 11.9489 12.9005 12.9016 13.0642 13.0709 13.8641 13.8710 14.4331 14.4390 15.9547 15.9577 17.5162 17.5195 19.8169 19.8185 20.5711 20.5791 k = 0.1096 0.0899-0.0000 ( 2450 PWs) bands (ev): -12.8592 -12.8589 -10.8659 -10.8655 -9.3260 -9.3242 -6.0609 -6.0601 -4.1821 -4.1812 -2.4910 -2.4902 1.0016 1.0045 1.8710 1.8789 2.3458 2.3511 3.2679 3.2720 3.7794 3.7897 4.8678 4.8758 5.8001 5.8026 6.0723 6.0854 6.6924 6.7015 8.2722 8.2775 9.4367 9.4406 10.0381 10.0423 10.8583 10.8638 11.4065 11.4099 11.9526 11.9552 12.9516 12.9540 13.0508 13.0599 13.8420 13.8491 14.4135 14.4195 15.9326 15.9354 17.4974 17.5004 19.7641 19.7655 20.6432 20.6511 k = 0.1027 0.0843-0.0000 ( 2450 PWs) bands (ev): -12.8838 -12.8836 -10.8772 -10.8768 -9.3160 -9.3144 -6.0679 -6.0671 -4.1880 -4.1872 -2.4787 -2.4779 0.9910 0.9939 1.9015 1.9092 2.3715 2.3763 3.3033 3.3071 3.7889 3.7989 4.8644 4.8721 5.8142 5.8170 6.0883 6.1017 6.6705 6.6801 8.2666 8.2716 9.4484 9.4522 10.0624 10.0668 10.8595 10.8645 11.4005 11.4036 11.9615 11.9639 12.9876 12.9956 13.0481 13.0623 13.8186 13.8259 14.3976 14.4036 15.9110 15.9137 17.4799 17.4827 19.7113 19.7127 20.7181 20.7258 k = 0.0959 0.0787-0.0000 ( 2452 PWs) bands (ev): -12.9069 -12.9067 -10.8878 -10.8875 -9.3066 -9.3050 -6.0746 -6.0738 -4.1934 -4.1927 -2.4670 -2.4663 0.9796 0.9824 1.9288 1.9364 2.3994 2.4037 3.3360 3.3395 3.7996 3.8093 4.8598 4.8673 5.8263 5.8293 6.1044 6.1183 6.6503 6.6604 8.2615 8.2663 9.4603 9.4640 10.0826 10.0872 10.8600 10.8644 11.3926 11.3954 11.9723 11.9745 12.9958 13.0029 13.0786 13.0914 13.7946 13.8020 14.3851 14.3910 15.8901 15.8926 17.4638 17.4664 19.6597 19.6609 20.7946 20.8023 k = 0.0890 0.0730-0.0000 ( 2452 PWs) bands (ev): -12.9286 -12.9284 -10.8979 -10.8976 -9.2977 -9.2962 -6.0808 -6.0801 -4.1983 -4.1977 -2.4558 -2.4552 0.9677 0.9703 1.9533 1.9605 2.4289 2.4326 3.3656 3.3688 3.8116 3.8209 4.8543 4.8615 5.8363 5.8394 6.1202 6.1344 6.6323 6.6429 8.2569 8.2614 9.4726 9.4762 10.0985 10.1033 10.8602 10.8641 11.3833 11.3858 11.9846 11.9866 12.9889 12.9936 13.1239 13.1340 13.7703 13.7779 14.3757 14.3814 15.8700 15.8724 17.4489 17.4514 19.6097 19.6109 20.8719 20.8795 k = 0.0822 0.0674-0.0000 ( 2456 PWs) bands (ev): -12.9487 -12.9485 -10.9073 -10.9070 -9.2893 -9.2880 -6.0866 -6.0859 -4.2028 -4.2021 -2.4453 -2.4447 0.9556 0.9580 1.9751 1.9819 2.4594 2.4626 3.3917 3.3947 3.8248 3.8338 4.8482 4.8551 5.8443 5.8474 6.1352 6.1495 6.6169 6.6278 8.2528 8.2570 9.4852 9.4887 10.1100 10.1150 10.8607 10.8641 11.3730 11.3752 11.9978 11.9996 12.9786 12.9822 13.1694 13.1781 13.7464 13.7541 14.3689 14.3744 15.8508 15.8530 17.4353 17.4375 19.5619 19.5630 20.9492 20.9567 k = 0.0753 0.0618-0.0000 ( 2455 PWs) bands (ev): -12.9673 -12.9671 -10.9160 -10.9158 -9.2816 -9.2803 -6.0919 -6.0913 -4.2067 -4.2062 -2.4354 -2.4349 0.9434 0.9457 1.9944 2.0008 2.4903 2.4929 3.4144 3.4171 3.8393 3.8478 4.8416 4.8482 5.8504 5.8535 6.1486 6.1629 6.6044 6.6155 8.2492 8.2531 9.4980 9.5014 10.1172 10.1222 10.8617 10.8645 11.3623 11.3642 12.0115 12.0132 12.9679 12.9708 13.2124 13.2204 13.7233 13.7312 14.3643 14.3697 15.8326 15.8346 17.4230 17.4250 19.5167 19.5177 21.0257 21.0330 k = 0.0685 0.0562-0.0000 ( 2454 PWs) bands (ev): -12.9843 -12.9842 -10.9241 -10.9238 -9.2744 -9.2733 -6.0968 -6.0963 -4.2103 -4.2098 -2.4263 -2.4257 0.9315 0.9336 2.0115 2.0174 2.5208 2.5230 3.4336 3.4360 3.8547 3.8627 4.8349 4.8412 5.8551 5.8580 6.1599 6.1739 6.5952 6.6062 8.2461 8.2497 9.5111 9.5143 10.1203 10.1254 10.8634 10.8658 11.3514 11.3531 12.0253 12.0268 12.9576 12.9600 13.2520 13.2597 13.7015 13.7097 14.3617 14.3667 15.8155 15.8173 17.4118 17.4136 19.4744 19.4753 21.1007 21.1078 k = 0.0616 0.0506-0.0000 ( 2456 PWs) bands (ev): -12.9998 -12.9996 -10.9314 -10.9312 -9.2679 -9.2668 -6.1013 -6.1008 -4.2134 -4.2129 -2.4178 -2.4174 0.9201 0.9220 2.0267 2.0321 2.5503 2.5522 3.4496 3.4517 3.8707 3.8781 4.8283 4.8342 5.8584 5.8612 6.1689 6.1823 6.5892 6.5999 8.2435 8.2468 9.5242 9.5272 10.1197 10.1247 10.8659 10.8678 11.3407 11.3422 12.0388 12.0401 12.9480 12.9501 13.2879 13.2954 13.6816 13.6899 14.3606 14.3653 15.7995 15.8012 17.4017 17.4034 19.4353 19.4361 21.1733 21.1802 k = 0.0548 0.0449-0.0000 ( 2452 PWs) bands (ev): -13.0136 -13.0135 -10.9380 -10.9378 -9.2620 -9.2610 -6.1053 -6.1048 -4.2162 -4.2157 -2.4102 -2.4097 0.9093 0.9110 2.0401 2.0449 2.5784 2.5798 3.4625 3.4644 3.8867 3.8935 4.8219 4.8274 5.8608 5.8633 6.1754 6.1879 6.5864 6.5964 8.2413 8.2442 9.5373 9.5402 10.1159 10.1207 10.8690 10.8706 11.3305 11.3317 12.0517 12.0529 12.9393 12.9411 13.3195 13.3270 13.6639 13.6723 14.3607 14.3650 15.7849 15.7864 17.3928 17.3943 19.3996 19.4003 21.2427 21.2493 k = 0.0479 0.0393-0.0000 ( 2448 PWs) bands (ev): -13.0259 -13.0258 -10.9438 -10.9436 -9.2567 -9.2559 -6.1088 -6.1084 -4.2185 -4.2182 -2.4033 -2.4029 0.8994 0.9009 2.0518 2.0561 2.6043 2.6055 3.4729 3.4746 3.9024 3.9085 4.8160 4.8210 5.8623 5.8646 6.1796 6.1909 6.5862 6.5954 8.2395 8.2421 9.5501 9.5528 10.1097 10.1142 10.8726 10.8738 11.3210 11.3220 12.0638 12.0647 12.9315 12.9331 13.3468 13.3542 13.6488 13.6572 14.3617 14.3656 15.7718 15.7731 17.3850 17.3863 19.3675 19.3681 21.3080 21.3143 k = 0.0411 0.0337-0.0000 ( 2452 PWs) bands (ev): -13.0365 -13.0364 -10.9489 -10.9488 -9.2521 -9.2514 -6.1119 -6.1115 -4.2206 -4.2202 -2.3973 -2.3970 0.8905 0.8918 2.0620 2.0656 2.6277 2.6286 3.4810 3.4825 3.9170 3.9224 4.8107 4.8152 5.8632 5.8652 6.1818 6.1918 6.5881 6.5962 8.2380 8.2403 9.5625 9.5649 10.1018 10.1059 10.8764 10.8774 11.3123 11.3132 12.0746 12.0755 12.9247 12.9260 13.3695 13.3767 13.6366 13.6448 14.3633 14.3667 15.7601 15.7613 17.3783 17.3794 19.3393 19.3398 21.3682 21.3741 k = 0.0342 0.0281-0.0000 ( 2452 PWs) bands (ev): -13.0456 -13.0455 -10.9532 -10.9531 -9.2482 -9.2476 -6.1145 -6.1142 -4.2222 -4.2220 -2.3922 -2.3919 0.8827 0.8838 2.0706 2.0736 2.6483 2.6489 3.4872 3.4886 3.9303 3.9349 4.8062 4.8101 5.8637 5.8654 6.1825 6.1910 6.5914 6.5982 8.2369 8.2388 9.5740 9.5761 10.0931 10.0967 10.8803 10.8810 11.3048 11.3055 12.0842 12.0849 12.9189 12.9200 13.3878 13.3944 13.6275 13.6351 14.3652 14.3680 15.7501 15.7511 17.3726 17.3735 19.3151 19.3155 21.4225 21.4278 k = 0.0274 0.0225-0.0000 ( 2442 PWs) bands (ev): -13.0530 -13.0529 -10.9568 -10.9567 -9.2450 -9.2445 -6.1166 -6.1163 -4.2236 -4.2234 -2.3879 -2.3877 0.8762 0.8771 2.0777 2.0802 2.6655 2.6660 3.4920 3.4931 3.9418 3.9456 4.8025 4.8057 5.8639 5.8653 6.1824 6.1892 6.5953 6.6008 8.2361 8.2377 9.5843 9.5862 10.0844 10.0875 10.8838 10.8844 11.2984 11.2990 12.0923 12.0929 12.9142 12.9151 13.4018 13.4077 13.6213 13.6280 14.3671 14.3695 15.7418 15.7426 17.3681 17.3688 19.2951 19.2955 21.4696 21.4742 k = 0.0205 0.0169-0.0000 ( 2436 PWs) bands (ev): -13.0587 -13.0587 -10.9596 -10.9595 -9.2425 -9.2421 -6.1182 -6.1180 -4.2246 -4.2245 -2.3846 -2.3844 0.8711 0.8718 2.0833 2.0852 2.6793 2.6796 3.4954 3.4963 3.9512 3.9541 4.7997 4.8021 5.8640 5.8651 6.1819 6.1870 6.5992 6.6034 8.2356 8.2367 9.5931 9.5945 10.0766 10.0791 10.8869 10.8873 11.2934 11.2938 12.0988 12.0992 12.9105 12.9112 13.4120 13.4167 13.6176 13.6230 14.3690 14.3707 15.7353 15.7359 17.3645 17.3651 19.2794 19.2797 21.5084 21.5121 k = 0.0137 0.0112-0.0000 ( 2435 PWs) bands (ev): -13.0628 -13.0628 -10.9615 -10.9615 -9.2407 -9.2404 -6.1194 -6.1193 -4.2254 -4.2253 -2.3822 -2.3821 0.8674 0.8679 2.0874 2.0886 2.6893 2.6895 3.4978 3.4984 3.9582 3.9601 4.7977 4.7994 5.8641 5.8648 6.1814 6.1849 6.6026 6.6053 8.2353 8.2360 9.5998 9.6008 10.0706 10.0722 10.8892 10.8895 11.2898 11.2900 12.1035 12.1038 12.9079 12.9083 13.4189 13.4223 13.6160 13.6197 14.3705 14.3716 15.7306 15.7310 17.3620 17.3624 19.2682 19.2683 21.5376 21.5402 k = 0.0068 0.0056-0.0000 ( 2435 PWs) bands (ev): -13.0653 -13.0653 -10.9627 -10.9627 -9.2395 -9.2394 -6.1201 -6.1200 -4.2258 -4.2257 -2.3807 -2.3807 0.8652 0.8654 2.0900 2.0906 2.6953 2.6954 3.4992 3.4995 3.9626 3.9636 4.7968 4.7976 5.8641 5.8645 6.1814 6.1831 6.6050 6.6064 8.2352 8.2355 9.6041 9.6046 10.0668 10.0677 10.8907 10.8908 11.2876 11.2877 12.1064 12.1065 12.9064 12.9066 13.4232 13.4249 13.6157 13.6176 14.3715 14.3721 15.7279 15.7281 17.3606 17.3608 19.2614 19.2615 21.5560 21.5574 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0000 0.0086 ( 2437 PWs) bands (ev): -13.0661 -13.0661 -10.9633 -10.9633 -9.2390 -9.2390 -6.1199 -6.1199 -4.2264 -4.2263 -2.3803 -2.3803 0.8646 0.8646 2.0910 2.0910 2.6973 2.6974 3.4998 3.5000 3.9645 3.9645 4.7969 4.7970 5.8641 5.8643 6.1821 6.1822 6.6057 6.6059 8.2363 8.2367 9.6044 9.6046 10.0662 10.0663 10.8912 10.8913 11.2872 11.2873 12.1074 12.1074 12.9021 12.9028 13.4274 13.4286 13.6161 13.6166 14.3718 14.3723 15.7264 15.7264 17.3599 17.3599 19.2592 19.2593 21.5604 21.5608 k = 0.0000 0.0000 0.0171 ( 2433 PWs) bands (ev): -13.0659 -13.0659 -10.9638 -10.9638 -9.2388 -9.2388 -6.1186 -6.1186 -4.2277 -4.2276 -2.3807 -2.3806 0.8646 0.8646 2.0909 2.0910 2.6972 2.6974 3.5001 3.5004 3.9646 3.9647 4.7975 4.7977 5.8639 5.8643 6.1827 6.1830 6.6040 6.6045 8.2398 8.2406 9.6006 9.6011 10.0673 10.0676 10.8913 10.8914 11.2882 11.2885 12.1075 12.1075 12.8915 12.8930 13.4351 13.4374 13.6162 13.6172 14.3714 14.3725 15.7247 15.7248 17.3593 17.3594 19.2593 19.2596 21.5541 21.5550 k = 0.0000 0.0000 0.0257 ( 2437 PWs) bands (ev): -13.0657 -13.0657 -10.9646 -10.9646 -9.2383 -9.2383 -6.1166 -6.1166 -4.2298 -4.2298 -2.3812 -2.3812 0.8646 0.8646 2.0907 2.0909 2.6970 2.6973 3.5006 3.5010 3.9647 3.9650 4.7986 4.7988 5.8636 5.8642 6.1839 6.1843 6.6013 6.6020 8.2456 8.2468 9.5945 9.5951 10.0693 10.0697 10.8914 10.8916 11.2898 11.2902 12.1076 12.1076 12.8749 12.8770 13.4476 13.4509 13.6165 13.6181 14.3710 14.3725 15.7219 15.7220 17.3582 17.3583 19.2596 19.2600 21.5444 21.5457 k = 0.0000 0.0000 0.0343 ( 2437 PWs) bands (ev): -13.0654 -13.0654 -10.9658 -10.9658 -9.2377 -9.2377 -6.1137 -6.1137 -4.2328 -4.2327 -2.3820 -2.3819 0.8647 0.8647 2.0905 2.0908 2.6968 2.6971 3.5013 3.5018 3.9650 3.9653 4.8001 4.8003 5.8633 5.8641 6.1854 6.1860 6.5977 6.5986 8.2536 8.2552 9.5861 9.5870 10.0722 10.0726 10.8917 10.8918 11.2919 11.2925 12.1078 12.1078 12.8533 12.8559 13.4639 13.4681 13.6172 13.6194 14.3704 14.3724 15.7180 15.7182 17.3567 17.3569 19.2600 19.2606 21.5322 21.5338 k = 0.0000 0.0000 0.0428 ( 2445 PWs) bands (ev): -13.0651 -13.0651 -10.9672 -10.9672 -9.2369 -9.2369 -6.1102 -6.1102 -4.2365 -4.2364 -2.3829 -2.3828 0.8647 0.8647 2.0902 2.0906 2.6965 2.6969 3.5022 3.5027 3.9653 3.9656 4.8019 4.8022 5.8629 5.8639 6.1874 6.1881 6.5932 6.5944 8.2637 8.2655 9.5756 9.5767 10.0760 10.0765 10.8919 10.8922 11.2944 11.2952 12.1079 12.1080 12.8276 12.8306 13.4830 13.4881 13.6183 13.6214 14.3696 14.3721 15.7131 15.7133 17.3548 17.3550 19.2606 19.2613 21.5184 21.5202 k = 0.0000 0.0000 0.0514 ( 2449 PWs) bands (ev): -13.0646 -13.0646 -10.9689 -10.9689 -9.2360 -9.2360 -6.1059 -6.1059 -4.2409 -4.2409 -2.3840 -2.3839 0.8648 0.8648 2.0900 2.0904 2.6962 2.6966 3.5032 3.5039 3.9656 3.9661 4.8040 4.8044 5.8626 5.8637 6.1899 6.1906 6.5880 6.5894 8.2755 8.2777 9.5632 9.5645 10.0808 10.0813 10.8923 10.8925 11.2971 11.2981 12.1081 12.1082 12.7989 12.8021 13.5037 13.5097 13.6203 13.6244 14.3687 14.3716 15.7071 15.7074 17.3526 17.3528 19.2614 19.2622 21.5038 21.5058 k = 0.0000 0.0000 0.0600 ( 2455 PWs) bands (ev): -13.0641 -13.0641 -10.9709 -10.9709 -9.2350 -9.2350 -6.1011 -6.1011 -4.2460 -4.2459 -2.3853 -2.3851 0.8648 0.8649 2.0897 2.0901 2.6959 2.6964 3.5044 3.5051 3.9661 3.9666 4.8064 4.8068 5.8623 5.8636 6.1926 6.1935 6.5823 6.5839 8.2888 8.2912 9.5492 9.5507 10.0865 10.0871 10.8927 10.8930 11.2999 11.3011 12.1084 12.1085 12.7679 12.7713 13.5247 13.5315 13.6237 13.6291 14.3675 14.3709 15.7002 15.7005 17.3500 17.3503 19.2624 19.2632 21.4893 21.4915 k = 0.0000 0.0000 0.0686 ( 2455 PWs) bands (ev): -13.0636 -13.0636 -10.9730 -10.9730 -9.2339 -9.2339 -6.0957 -6.0957 -4.2516 -4.2515 -2.3866 -2.3865 0.8649 0.8650 2.0894 2.0898 2.6955 2.6960 3.5057 3.5064 3.9666 3.9671 4.8089 4.8094 5.8622 5.8636 6.1957 6.1966 6.5761 6.5778 8.3033 8.3060 9.5337 9.5355 10.0933 10.0938 10.8932 10.8936 11.3025 11.3039 12.1086 12.1087 12.7355 12.7391 13.5443 13.5519 13.6297 13.6366 14.3661 14.3699 15.6925 15.6929 17.3472 17.3475 19.2636 19.2645 21.4755 21.4778 k = 0.0000 0.0000 0.0771 ( 2453 PWs) bands (ev): -13.0630 -13.0630 -10.9753 -10.9752 -9.2327 -9.2327 -6.0899 -6.0899 -4.2577 -4.2576 -2.3881 -2.3879 0.8650 0.8651 2.0891 2.0896 2.6952 2.6957 3.5071 3.5079 3.9672 3.9677 4.8116 4.8121 5.8623 5.8638 6.1990 6.2001 6.5696 6.5715 8.3187 8.3215 9.5172 9.5191 10.1011 10.1016 10.8938 10.8942 11.3048 11.3064 12.1088 12.1090 12.7023 12.7060 13.5606 13.5686 13.6401 13.6482 14.3644 14.3685 15.6841 15.6844 17.3441 17.3444 19.2650 19.2659 21.4629 21.4652 k = 0.0000 0.0000 0.0857 ( 2447 PWs) bands (ev): -13.0624 -13.0624 -10.9776 -10.9776 -9.2314 -9.2314 -6.0838 -6.0838 -4.2641 -4.2640 -2.3896 -2.3895 0.8651 0.8652 2.0888 2.0893 2.6948 2.6954 3.5085 3.5094 3.9678 3.9684 4.8143 4.8148 5.8625 5.8641 6.2025 6.2037 6.5630 6.5649 8.3346 8.3376 9.4999 9.5019 10.1098 10.1103 10.8944 10.8949 11.3065 11.3083 12.1091 12.1093 12.6689 12.6726 13.5726 13.5802 13.6560 13.6646 14.3624 14.3668 15.6750 15.6753 17.3408 17.3411 19.2666 19.2675 21.4518 21.4542 k = 0.0000 0.0000 0.0943 ( 2449 PWs) bands (ev): -13.0617 -13.0617 -10.9801 -10.9801 -9.2301 -9.2301 -6.0774 -6.0774 -4.2707 -4.2706 -2.3911 -2.3910 0.8652 0.8653 2.0885 2.0890 2.6944 2.6950 3.5100 3.5109 3.9684 3.9690 4.8169 4.8175 5.8629 5.8645 6.2062 6.2074 6.5563 6.5583 8.3508 8.3539 9.4821 9.4842 10.1194 10.1199 10.8951 10.8956 11.3076 11.3096 12.1093 12.1096 12.6359 12.6396 13.5805 13.5871 13.6768 13.6852 14.3600 14.3647 15.6654 15.6657 17.3373 17.3376 19.2683 19.2692 21.4424 21.4448 k = 0.0000 0.0000 0.1028 ( 2449 PWs) bands (ev): -13.0611 -13.0611 -10.9826 -10.9826 -9.2288 -9.2288 -6.0710 -6.0709 -4.2775 -4.2773 -2.3927 -2.3926 0.8653 0.8654 2.0882 2.0887 2.6940 2.6946 3.5115 3.5123 3.9690 3.9696 4.8195 4.8200 5.8635 5.8651 6.2099 6.2112 6.5496 6.5517 8.3669 8.3700 9.4642 9.4664 10.1296 10.1301 10.8959 10.8965 11.3080 11.3102 12.1095 12.1098 12.6038 12.6075 13.5856 13.5910 13.7003 13.7083 14.3573 14.3622 15.6554 15.6558 17.3337 17.3340 19.2701 19.2710 21.4348 21.4372 k = 0.0000 0.0000 0.1114 ( 2445 PWs) bands (ev): -13.0604 -13.0604 -10.9850 -10.9850 -9.2275 -9.2275 -6.0645 -6.0645 -4.2842 -4.2841 -2.3943 -2.3941 0.8654 0.8655 2.0879 2.0884 2.6936 2.6942 3.5130 3.5138 3.9696 3.9702 4.8219 4.8225 5.8643 5.8660 6.2137 6.2149 6.5432 6.5452 8.3826 8.3857 9.4465 9.4487 10.1405 10.1410 10.8968 10.8974 11.3075 11.3098 12.1096 12.1101 12.5731 12.5767 13.5888 13.5933 13.7250 13.7326 14.3543 14.3592 15.6453 15.6457 17.3301 17.3304 19.2720 19.2729 21.4290 21.4313 k = 0.0000 0.0000 0.1200 ( 2445 PWs) bands (ev): -13.0598 -13.0598 -10.9874 -10.9874 -9.2263 -9.2262 -6.0582 -6.0582 -4.2908 -4.2907 -2.3957 -2.3956 0.8655 0.8656 2.0877 2.0881 2.6933 2.6938 3.5144 3.5152 3.9702 3.9708 4.8242 4.8247 5.8653 5.8669 6.2174 6.2186 6.5370 6.5390 8.3977 8.4007 9.4293 9.4315 10.1518 10.1523 10.8977 10.8983 11.3062 11.3086 12.1098 12.1103 12.5441 12.5476 13.5909 13.5947 13.7498 13.7570 14.3509 14.3559 15.6352 15.6356 17.3266 17.3269 19.2740 19.2749 21.4248 21.4271 k = 0.0000 0.0000 0.1285 ( 2447 PWs) bands (ev): -13.0592 -13.0592 -10.9896 -10.9896 -9.2251 -9.2251 -6.0521 -6.0521 -4.2971 -4.2970 -2.3972 -2.3970 0.8656 0.8657 2.0874 2.0879 2.6929 2.6935 3.5157 3.5164 3.9708 3.9714 4.8263 4.8267 5.8665 5.8680 6.2209 6.2221 6.5312 6.5332 8.4119 8.4147 9.4130 9.4152 10.1632 10.1637 10.8987 10.8993 11.3042 11.3066 12.1099 12.1105 12.5173 12.5206 13.5923 13.5955 13.7740 13.7808 14.3473 14.3522 15.6254 15.6257 17.3231 17.3234 19.2760 19.2768 21.4223 21.4244 k = 0.0000 0.0000 0.1371 ( 2447 PWs) bands (ev): -13.0587 -13.0587 -10.9917 -10.9917 -9.2240 -9.2240 -6.0464 -6.0464 -4.3031 -4.3030 -2.3985 -2.3984 0.8657 0.8658 2.0872 2.0877 2.6926 2.6931 3.5169 3.5176 3.9714 3.9719 4.8281 4.8285 5.8678 5.8692 6.2242 6.2254 6.5259 6.5277 8.4250 8.4276 9.3979 9.3999 10.1744 10.1749 10.8998 10.9003 11.3015 11.3038 12.1100 12.1106 12.4930 12.4960 13.5933 13.5959 13.7970 13.8034 14.3436 14.3483 15.6160 15.6163 17.3200 17.3202 19.2779 19.2786 21.4210 21.4230 k = 0.0000 0.0000 0.1457 ( 2445 PWs) bands (ev): -13.0582 -13.0582 -10.9936 -10.9936 -9.2230 -9.2230 -6.0412 -6.0412 -4.3085 -4.3084 -2.3997 -2.3996 0.8658 0.8659 2.0871 2.0875 2.6924 2.6928 3.5181 3.5187 3.9719 3.9724 4.8297 4.8301 5.8692 5.8704 6.2273 6.2284 6.5212 6.5228 8.4367 8.4391 9.3842 9.3860 10.1852 10.1856 10.9008 10.9013 11.2983 11.3005 12.1101 12.1107 12.4715 12.4742 13.5941 13.5962 13.8184 13.8242 14.3398 14.3443 15.6073 15.6076 17.3170 17.3173 19.2797 19.2803 21.4208 21.4226 k = 0.0000 0.0000 0.1543 ( 2449 PWs) bands (ev): -13.0577 -13.0577 -10.9953 -10.9953 -9.2221 -9.2221 -6.0366 -6.0366 -4.3133 -4.3132 -2.4007 -2.4006 0.8659 0.8660 2.0869 2.0873 2.6921 2.6925 3.5191 3.5196 3.9724 3.9727 4.8310 4.8313 5.8705 5.8716 6.2300 6.2310 6.5170 6.5185 8.4470 8.4491 9.3721 9.3738 10.1950 10.1955 10.9018 10.9023 11.2950 11.2970 12.1102 12.1108 12.4530 12.4554 13.5946 13.5963 13.8377 13.8428 14.3362 14.3403 15.5995 15.5997 17.3144 17.3146 19.2813 19.2818 21.4214 21.4229 k = 0.0000 0.0000 0.1628 ( 2454 PWs) bands (ev): -13.0574 -13.0573 -10.9967 -10.9967 -9.2214 -9.2214 -6.0327 -6.0327 -4.3174 -4.3173 -2.4016 -2.4015 0.8660 0.8660 2.0868 2.0871 2.6919 2.6922 3.5199 3.5203 3.9727 3.9731 4.8321 4.8323 5.8717 5.8726 6.2323 6.2331 6.5136 6.5148 8.4556 8.4574 9.3620 9.3633 10.2038 10.2041 10.9027 10.9031 11.2917 11.2935 12.1103 12.1108 12.4377 12.4397 13.5950 13.5963 13.8544 13.8587 14.3330 14.3364 15.5928 15.5930 17.3122 17.3124 19.2827 19.2832 21.4224 21.4237 k = 0.0000 0.0000 0.1714 ( 2450 PWs) bands (ev): -13.0571 -13.0570 -10.9979 -10.9978 -9.2208 -9.2208 -6.0296 -6.0296 -4.3207 -4.3206 -2.4023 -2.4022 0.8660 0.8661 2.0868 2.0870 2.6918 2.6920 3.5206 3.5209 3.9731 3.9733 4.8329 4.8331 5.8728 5.8735 6.2343 6.2349 6.5109 6.5118 8.4625 8.4639 9.3540 9.3550 10.2110 10.2113 10.9035 10.9038 11.2889 11.2902 12.1103 12.1108 12.4257 12.4273 13.5953 13.5963 13.8681 13.8714 14.3303 14.3330 15.5873 15.5875 17.3105 17.3106 19.2839 19.2842 21.4236 21.4246 k = 0.0000 0.0000 0.1800 ( 2448 PWs) bands (ev): -13.0568 -13.0568 -10.9987 -10.9987 -9.2204 -9.2204 -6.0273 -6.0273 -4.3230 -4.3230 -2.4028 -2.4027 0.8661 0.8661 2.0867 2.0869 2.6917 2.6918 3.5211 3.5213 3.9733 3.9735 4.8335 4.8337 5.8736 5.8741 6.2357 6.2361 6.5090 6.5097 8.4676 8.4685 9.3482 9.3489 10.2164 10.2166 10.9041 10.9044 11.2866 11.2876 12.1104 12.1107 12.4172 12.4183 13.5956 13.5962 13.8783 13.8806 14.3283 14.3302 15.5834 15.5835 17.3092 17.3093 19.2848 19.2850 21.4247 21.4254 k = 0.0000 0.0000 0.1885 ( 2448 PWs) bands (ev): -13.0567 -13.0567 -10.9992 -10.9992 -9.2201 -9.2201 -6.0259 -6.0259 -4.3245 -4.3245 -2.4031 -2.4031 0.8661 0.8661 2.0867 2.0868 2.6916 2.6917 3.5214 3.5215 3.9735 3.9736 4.8339 4.8340 5.8742 5.8745 6.2366 6.2368 6.5079 6.5083 8.4707 8.4712 9.3447 9.3451 10.2197 10.2198 10.9046 10.9047 11.2853 11.2858 12.1105 12.1107 12.4122 12.4127 13.5958 13.5961 13.8849 13.8861 14.3272 14.3282 15.5810 15.5810 17.3085 17.3085 19.2853 19.2855 21.4256 21.4259 k = 0.0000 0.0000 0.1971 ( 2450 PWs) bands (ev): -13.0567 -13.0567 -10.9993 -10.9993 -9.2200 -9.2200 -6.0254 -6.0254 -4.3250 -4.3250 -2.4032 -2.4032 0.8661 0.8661 2.0867 2.0867 2.6917 2.6917 3.5216 3.5216 3.9736 3.9736 4.8340 4.8340 5.8745 5.8745 6.2370 6.2370 6.5077 6.5077 8.4720 8.4720 9.3437 9.3437 10.2209 10.2209 10.9048 10.9048 11.2850 11.2850 12.1106 12.1106 12.4107 12.4107 13.5960 13.5960 13.8875 13.8875 14.3272 14.3272 15.5801 15.5801 17.3082 17.3082 19.2856 19.2856 21.4260 21.4260 k = 0.5000-0.0000 0.1971 ( 2460 PWs) bands (ev): -11.4760 -11.4760 -10.4668 -10.4668 -9.8045 -9.8045 -5.2719 -5.2719 -3.3688 -3.3688 -2.8574 -2.8574 -0.2129 -0.2129 0.7298 0.7298 1.3243 1.3243 2.5425 2.5425 3.5253 3.5253 4.5554 4.5554 5.9422 5.9422 6.3048 6.3048 6.4272 6.4272 7.9301 7.9301 8.0214 8.0214 9.3848 9.3848 10.0166 10.0166 11.4758 11.4758 11.6884 11.6884 12.3493 12.3493 12.6196 12.6196 13.3475 13.3475 15.3467 15.3467 16.1796 16.1796 18.0590 18.0590 19.6946 19.6946 20.9373 20.9373 k = 0.4918-0.0000 0.1939 ( 2462 PWs) bands (ev): -11.4782 -11.4780 -10.4666 -10.4664 -9.8037 -9.8036 -5.2726 -5.2725 -3.3702 -3.3701 -2.8562 -2.8561 -0.2118 -0.2118 0.7303 0.7307 1.3256 1.3259 2.5415 2.5418 3.5252 3.5258 4.5554 4.5558 5.9423 5.9425 6.3013 6.3027 6.4293 6.4308 7.9295 7.9301 8.0230 8.0236 9.3856 9.3860 10.0163 10.0166 11.4748 11.4755 11.6890 11.6898 12.3433 12.3440 12.6256 12.6259 13.3472 13.3473 15.3463 15.3465 16.1803 16.1805 18.0597 18.0599 19.6943 19.6946 20.9371 20.9373 k = 0.4836-0.0000 0.1906 ( 2456 PWs) bands (ev): -11.4844 -11.4841 -10.4659 -10.4657 -9.8014 -9.8012 -5.2745 -5.2744 -3.3744 -3.3742 -2.8527 -2.8524 -0.2085 -0.2084 0.7322 0.7330 1.3298 1.3305 2.5390 2.5395 3.5253 3.5265 4.5558 4.5564 5.9428 5.9432 6.2929 6.2955 6.4366 6.4393 7.9283 7.9294 8.0285 8.0296 9.3883 9.3890 10.0157 10.0164 11.4725 11.4739 11.6917 11.6932 12.3275 12.3286 12.6426 12.6432 13.3465 13.3468 15.3454 15.3457 16.1825 16.1829 18.0620 18.0624 19.6938 19.6944 20.9367 20.9373 k = 0.4754-0.0000 0.1874 ( 2454 PWs) bands (ev): -11.4946 -11.4942 -10.4649 -10.4645 -9.7976 -9.7973 -5.2776 -5.2774 -3.3811 -3.3808 -2.8469 -2.8464 -0.2030 -0.2028 0.7357 0.7368 1.3369 1.3379 2.5349 2.5357 3.5256 3.5275 4.5564 4.5575 5.9437 5.9443 6.2812 6.2846 6.4477 6.4512 7.9271 7.9286 8.0373 8.0388 9.3930 9.3940 10.0149 10.0159 11.4691 11.4712 11.6963 11.6984 12.3047 12.3062 12.6677 12.6685 13.3454 13.3458 15.3438 15.3444 16.1863 16.1869 18.0659 18.0665 19.6928 19.6938 20.9363 20.9372 k = 0.4672-0.0000 0.1842 ( 2449 PWs) bands (ev): -11.5086 -11.5081 -10.4636 -10.4631 -9.7922 -9.7918 -5.2819 -5.2817 -3.3903 -3.3899 -2.8389 -2.8384 -0.1953 -0.1950 0.7406 0.7421 1.3467 1.3480 2.5293 2.5304 3.5263 3.5287 4.5574 4.5588 5.9450 5.9458 6.2674 6.2713 6.4612 6.4653 7.9263 7.9280 8.0490 8.0507 9.3995 9.4009 10.0138 10.0152 11.4647 11.4674 11.7027 11.7054 12.2775 12.2793 12.6983 12.6992 13.3439 13.3444 15.3417 15.3424 16.1916 16.1924 18.0713 18.0722 19.6914 19.6927 20.9359 20.9370 k = 0.4590-0.0000 0.1809 ( 2454 PWs) bands (ev): -11.5262 -11.5256 -10.4623 -10.4617 -9.7853 -9.7848 -5.2874 -5.2872 -3.4017 -3.4013 -2.8292 -2.8285 -0.1852 -0.1849 0.7471 0.7490 1.3590 1.3605 2.5225 2.5239 3.5271 3.5301 4.5588 4.5605 5.9466 5.9476 6.2523 6.2565 6.4762 6.4806 7.9263 7.9282 8.0631 8.0650 9.4079 9.4096 10.0126 10.0144 11.4597 11.4628 11.7107 11.7138 12.2477 12.2497 12.7325 12.7335 13.3419 13.3426 15.3390 15.3399 16.1984 16.1994 18.0781 18.0792 19.6895 19.6911 20.9353 20.9367 k = 0.4508-0.0000 0.1777 ( 2451 PWs) bands (ev): -11.5470 -11.5464 -10.4611 -10.4604 -9.7769 -9.7762 -5.2941 -5.2938 -3.4151 -3.4146 -2.8178 -2.8170 -0.1729 -0.1725 0.7553 0.7574 1.3735 1.3754 2.5146 2.5162 3.5282 3.5317 4.5605 4.5625 5.9486 5.9497 6.2364 6.2408 6.4921 6.4967 7.9274 7.9294 8.0794 8.0814 9.4180 9.4201 10.0114 10.0135 11.4541 11.4575 11.7201 11.7236 12.2167 12.2188 12.7691 12.7701 13.3396 13.3404 15.3358 15.3368 16.2066 16.2078 18.0864 18.0876 19.6867 19.6887 20.9349 20.9366 k = 0.4426-0.0000 0.1745 ( 2451 PWs) bands (ev): -11.5710 -11.5702 -10.4603 -10.4596 -9.7670 -9.7662 -5.3019 -5.3016 -3.4302 -3.4296 -2.8050 -2.8041 -0.1582 -0.1577 0.7651 0.7675 1.3901 1.3922 2.5058 2.5076 3.5294 3.5334 4.5625 4.5649 5.9509 5.9521 6.2199 6.2245 6.5083 6.5132 7.9298 7.9319 8.0975 8.0996 9.4297 9.4323 10.0103 10.0127 11.4481 11.4519 11.7307 11.7346 12.1849 12.1871 12.8073 12.8084 13.3368 13.3378 15.3320 15.3331 16.2163 16.2177 18.0958 18.0972 19.6831 19.6854 20.9347 20.9366 k = 0.4344-0.0000 0.1713 ( 2451 PWs) bands (ev): -11.5977 -11.5969 -10.4600 -10.4593 -9.7557 -9.7549 -5.3108 -5.3105 -3.4468 -3.4462 -2.7911 -2.7902 -0.1411 -0.1406 0.7766 0.7793 1.4082 1.4106 2.4964 2.4984 3.5308 3.5353 4.5649 4.5676 5.9535 5.9548 6.2031 6.2079 6.5248 6.5298 7.9336 7.9358 8.1174 8.1195 9.4430 9.4460 10.0093 10.0122 11.4421 11.4460 11.7423 11.7466 12.1530 12.1553 12.8465 12.8477 13.3336 13.3348 15.3276 15.3289 16.2273 16.2288 18.1063 18.1080 19.6783 19.6809 20.9347 20.9369 k = 0.4262-0.0000 0.1680 ( 2451 PWs) bands (ev): -11.6268 -11.6259 -10.4605 -10.4597 -9.7431 -9.7422 -5.3209 -5.3205 -3.4647 -3.4640 -2.7764 -2.7754 -0.1216 -0.1210 0.7900 0.7928 1.4277 1.4302 2.4866 2.4889 3.5323 3.5373 4.5676 4.5707 5.9563 5.9577 6.1861 6.1910 6.5411 6.5463 7.9390 7.9412 8.1388 8.1410 9.4577 9.4611 10.0087 10.0120 11.4359 11.4401 11.7549 11.7594 12.1212 12.1236 12.8864 12.8878 13.3300 13.3314 15.3228 15.3242 16.2395 16.2412 18.1177 18.1196 19.6722 19.6751 20.9350 20.9375 k = 0.4180-0.0000 0.1648 ( 2451 PWs) bands (ev): -11.6581 -11.6572 -10.4619 -10.4611 -9.7293 -9.7283 -5.3319 -5.3316 -3.4838 -3.4830 -2.7610 -2.7599 -0.0996 -0.0990 0.8052 0.8082 1.4480 1.4507 2.4768 2.4793 3.5340 3.5394 4.5708 4.5741 5.9592 5.9607 6.1689 6.1740 6.5573 6.5626 7.9460 7.9482 8.1617 8.1639 9.4736 9.4774 10.0087 10.0124 11.4300 11.4342 11.7683 11.7731 12.0898 12.0923 12.9266 12.9284 13.3261 13.3277 15.3173 15.3189 16.2530 16.2548 18.1299 18.1319 19.6646 19.6679 20.9357 20.9385 k = 0.4098-0.0000 0.1616 ( 2455 PWs) bands (ev): -11.6912 -11.6903 -10.4643 -10.4634 -9.7144 -9.7132 -5.3440 -5.3436 -3.5037 -3.5030 -2.7450 -2.7439 -0.0752 -0.0745 0.8222 0.8254 1.4688 1.4717 2.4674 2.4701 3.5358 3.5416 4.5743 4.5780 5.9622 5.9638 6.1517 6.1570 6.5732 6.5785 7.9545 7.9568 8.1861 8.1883 9.4905 9.4947 10.0095 10.0136 11.4242 11.4285 11.7823 11.7873 12.0591 12.0616 12.9670 12.9691 13.3218 13.3237 15.3113 15.3130 16.2675 16.2695 18.1425 18.1447 19.6554 19.6591 20.9370 20.9401 k = 0.4016-0.0000 0.1583 ( 2456 PWs) bands (ev): -11.7261 -11.7251 -10.4676 -10.4668 -9.6985 -9.6973 -5.3571 -5.3566 -3.5245 -3.5237 -2.7288 -2.7275 -0.0483 -0.0475 0.8411 0.8444 1.4896 1.4926 2.4586 2.4615 3.5377 3.5439 4.5782 4.5822 5.9651 5.9667 6.1345 6.1401 6.5886 6.5940 7.9647 7.9669 8.2118 8.2140 9.5081 9.5129 10.0112 10.0158 11.4188 11.4232 11.7969 11.8021 12.0291 12.0318 13.0072 13.0098 13.3175 13.3197 15.3048 15.3065 16.2829 16.2851 18.1554 18.1578 19.6446 19.6486 20.9387 20.9420 k = 0.3934-0.0000 0.1551 ( 2457 PWs) bands (ev): -11.7623 -11.7613 -10.4721 -10.4713 -9.6818 -9.6804 -5.3710 -5.3706 -3.5459 -3.5451 -2.7123 -2.7110 -0.0188 -0.0180 0.8619 0.8653 1.5098 1.5130 2.4510 2.4540 3.5398 3.5464 4.5826 4.5870 5.9678 5.9694 6.1174 6.1234 6.6034 6.6089 7.9764 7.9786 8.2389 8.2411 9.5263 9.5315 10.0144 10.0194 11.4139 11.4182 11.8118 11.8172 12.0003 12.0030 13.0467 13.0499 13.3132 13.3158 15.2976 15.2995 16.2992 16.3015 18.1682 18.1707 19.6321 19.6365 20.9409 20.9444 k = 0.3852-0.0000 0.1519 ( 2453 PWs) bands (ev): -11.7997 -11.7987 -10.4777 -10.4769 -9.6644 -9.6629 -5.3859 -5.3854 -3.5678 -3.5670 -2.6958 -2.6945 0.0132 0.0141 0.8846 0.8881 1.5292 1.5324 2.4448 2.4480 3.5422 3.5490 4.5876 4.5922 5.9700 5.9716 6.1008 6.1072 6.6177 6.6232 7.9895 7.9917 8.2673 8.2694 9.5446 9.5502 10.0190 10.0245 11.4095 11.4138 11.8264 11.8321 11.9731 11.9759 13.0852 13.0891 13.3093 13.3125 15.2899 15.2918 16.3162 16.3186 18.1806 18.1833 19.6182 19.6228 20.9434 20.9471 k = 0.3770-0.0000 0.1486 ( 2455 PWs) bands (ev): -11.8381 -11.8371 -10.4844 -10.4835 -9.6465 -9.6449 -5.4016 -5.4010 -3.5902 -3.5894 -2.6793 -2.6780 0.0477 0.0487 0.9092 0.9127 1.5471 1.5504 2.4404 2.4438 3.5447 3.5518 4.5930 4.5979 5.9712 5.9729 6.0848 6.0918 6.6312 6.6369 8.0041 8.0062 8.2970 8.2991 9.5628 9.5689 10.0256 10.0315 11.4057 11.4099 11.8397 11.8454 11.9488 11.9517 13.1215 13.1264 13.3068 13.3107 15.2814 15.2834 16.3337 16.3362 18.1923 18.1951 19.6029 19.6078 20.9459 20.9499 k = 0.3689-0.0000 0.1454 ( 2453 PWs) bands (ev): -11.8772 -11.8763 -10.4920 -10.4912 -9.6281 -9.6265 -5.4180 -5.4175 -3.6129 -3.6120 -2.6630 -2.6616 0.0847 0.0857 0.9355 0.9390 1.5632 1.5666 2.4382 2.4418 3.5475 3.5548 4.5990 4.6043 5.9707 5.9728 6.0702 6.0778 6.6441 6.6497 8.0199 8.0220 8.3280 8.3301 9.5805 9.5870 10.0345 10.0408 11.4026 11.4067 11.8486 11.8540 11.9309 11.9337 13.1541 13.1601 13.3071 13.3120 15.2722 15.2743 16.3516 16.3542 18.2028 18.2058 19.5867 19.5919 20.9483 20.9524 k = 0.3607-0.0000 0.1422 ( 2456 PWs) bands (ev): -11.9170 -11.9161 -10.5007 -10.4999 -9.6095 -9.6078 -5.4352 -5.4346 -3.6358 -3.6349 -2.6469 -2.6455 0.1241 0.1252 0.9635 0.9671 1.5771 1.5805 2.4386 2.4422 3.5506 3.5581 4.6058 4.6113 5.9678 5.9703 6.0576 6.0659 6.6561 6.6618 8.0368 8.0389 8.3602 8.3623 9.5973 9.6042 10.0457 10.0524 11.4003 11.4042 11.8472 11.8513 11.9253 11.9281 13.1803 13.1873 13.3132 13.3188 15.2622 15.2643 16.3695 16.3722 18.2116 18.2147 19.5700 19.5755 20.9502 20.9543 k = 0.3525-0.0000 0.1389 ( 2452 PWs) bands (ev): -11.9573 -11.9564 -10.5103 -10.5095 -9.5908 -9.5890 -5.4530 -5.4524 -3.6588 -3.6580 -2.6312 -2.6297 0.1659 0.1671 0.9933 0.9967 1.5887 1.5921 2.4416 2.4453 3.5540 3.5617 4.6133 4.6191 5.9616 5.9646 6.0482 6.0570 6.6673 6.6731 8.0547 8.0567 8.3938 8.3959 9.6132 9.6203 10.0597 10.0667 11.3988 11.4026 11.8336 11.8366 11.9330 11.9367 13.1972 13.2045 13.3284 13.3341 15.2513 15.2534 16.3874 16.3902 18.2184 18.2216 19.5534 19.5592 20.9510 20.9550 k = 0.3443-0.0000 0.1357 ( 2454 PWs) bands (ev): -11.9979 -11.9970 -10.5208 -10.5200 -9.5721 -9.5703 -5.4715 -5.4709 -3.6820 -3.6811 -2.6157 -2.6143 0.2100 0.2112 1.0245 1.0278 1.5977 1.6010 2.4474 2.4512 3.5578 3.5657 4.6215 4.6276 5.9517 5.9549 6.0424 6.0514 6.6777 6.6835 8.0734 8.0753 8.4286 8.4307 9.6277 9.6352 10.0765 10.0838 11.3981 11.4019 11.8136 11.8164 11.9486 11.9531 13.2045 13.2111 13.3533 13.3581 15.2393 15.2415 16.4048 16.4078 18.2225 18.2258 19.5376 19.5436 20.9502 20.9542 k = 0.3361-0.0000 0.1325 ( 2460 PWs) bands (ev): -12.0387 -12.0378 -10.5321 -10.5313 -9.5535 -9.5516 -5.4905 -5.4899 -3.7051 -3.7042 -2.6007 -2.5993 0.2563 0.2576 1.0570 1.0603 1.6041 1.6074 2.4561 2.4598 3.5621 3.5701 4.6307 4.6371 5.9386 5.9418 6.0398 6.0487 6.6871 6.6929 8.0927 8.0946 8.4646 8.4667 9.6409 9.6485 10.0961 10.1035 11.3984 11.4021 11.7915 11.7944 11.9682 11.9731 13.2045 13.2102 13.3848 13.3885 15.2263 15.2285 16.4216 16.4247 18.2235 18.2269 19.5233 19.5296 20.9472 20.9511 k = 0.3279-0.0000 0.1292 ( 2457 PWs) bands (ev): -12.0796 -12.0787 -10.5440 -10.5433 -9.5351 -9.5332 -5.5101 -5.5095 -3.7281 -3.7272 -2.5862 -2.5847 0.3046 0.3061 1.0907 1.0939 1.6083 1.6115 2.4675 2.4712 3.5668 3.5749 4.6409 4.6476 5.9228 5.9259 6.0395 6.0482 6.6957 6.7015 8.1123 8.1142 8.5019 8.5039 9.6528 9.6605 10.1185 10.1260 11.3998 11.4033 11.7690 11.7721 11.9902 11.9954 13.1999 13.2049 13.4197 13.4224 15.2120 15.2143 16.4375 16.4407 18.2209 18.2245 19.5115 19.5180 20.9417 20.9454 k = 0.3197-0.0000 0.1260 ( 2454 PWs) bands (ev): -12.1205 -12.1196 -10.5566 -10.5559 -9.5170 -9.5151 -5.5301 -5.5295 -3.7510 -3.7501 -2.5722 -2.5707 0.3549 0.3564 1.1253 1.1283 1.6105 1.6135 2.4814 2.4851 3.5720 3.5801 4.6522 4.6592 5.9053 5.9083 6.0408 6.0491 6.7034 6.7092 8.1322 8.1341 8.5403 8.5424 9.6634 9.6712 10.1433 10.1508 11.4021 11.4055 11.7467 11.7501 12.0140 12.0195 13.1927 13.1971 13.4560 13.4581 15.1964 15.1988 16.4521 16.4554 18.2145 18.2182 19.5027 19.5094 20.9331 20.9366 k = 0.3115-0.0000 0.1228 ( 2458 PWs) bands (ev): -12.1612 -12.1604 -10.5698 -10.5691 -9.4994 -9.4974 -5.5505 -5.5499 -3.7737 -3.7727 -2.5587 -2.5572 0.4069 0.4086 1.1605 1.1632 1.6112 1.6140 2.4975 2.5012 3.5777 3.5858 4.6647 4.6720 5.8865 5.8895 6.0428 6.0510 6.7101 6.7160 8.1521 8.1540 8.5798 8.5820 9.6729 9.6806 10.1703 10.1778 11.4054 11.4089 11.7249 11.7287 12.0395 12.0452 13.1837 13.1878 13.4928 13.4945 15.1793 15.1817 16.4652 16.4685 18.2039 18.2076 19.4978 19.5047 20.9210 20.9242 k = 0.3033-0.0000 0.1196 ( 2452 PWs) bands (ev): -12.2018 -12.2009 -10.5835 -10.5828 -9.4822 -9.4801 -5.5713 -5.5707 -3.7961 -3.7952 -2.5457 -2.5442 0.4604 0.4622 1.1958 1.1983 1.6111 1.6137 2.5157 2.5192 3.5838 3.5919 4.6785 4.6861 5.8670 5.8700 6.0453 6.0533 6.7159 6.7218 8.1718 8.1736 8.6205 8.6226 9.6815 9.6892 10.1992 10.2066 11.4098 11.4133 11.7037 11.7080 12.0665 12.0725 13.1735 13.1774 13.5296 13.5311 15.1606 15.1630 16.4763 16.4797 18.1891 18.1929 19.4972 19.5043 20.9051 20.9082 k = 0.2951-0.0000 0.1163 ( 2452 PWs) bands (ev): -12.2420 -12.2412 -10.5975 -10.5969 -9.4655 -9.4634 -5.5924 -5.5917 -3.8182 -3.8173 -2.5333 -2.5318 0.5151 0.5171 1.2307 1.2330 1.6111 1.6133 2.5355 2.5390 3.5903 3.5983 4.6936 4.7015 5.8470 5.8501 6.0480 6.0559 6.7208 6.7267 8.1910 8.1928 8.6621 8.6643 9.6894 9.6970 10.2296 10.2369 11.4152 11.4189 11.6834 11.6882 12.0952 12.1013 13.1626 13.1662 13.5660 13.5675 15.1400 15.1426 16.4852 16.4887 18.1701 18.1740 19.5015 19.5086 20.8854 20.8884 k = 0.2869-0.0000 0.1131 ( 2451 PWs) bands (ev): -12.2818 -12.2810 -10.6119 -10.6113 -9.4494 -9.4473 -5.6137 -5.6131 -3.8400 -3.8390 -2.5215 -2.5200 0.5707 0.5728 1.2645 1.2668 1.6121 1.6140 2.5567 2.5601 3.5971 3.6051 4.7102 4.7183 5.8268 5.8300 6.0507 6.0585 6.7248 6.7306 8.2097 8.2115 8.7046 8.7069 9.6969 9.7044 10.2610 10.2682 11.4215 11.4256 11.6640 11.6695 12.1255 12.1318 13.1511 13.1546 13.6019 13.6034 15.1176 15.1203 16.4914 16.4950 18.1473 18.1512 19.5107 19.5179 20.8618 20.8648 k = 0.2787-0.0000 0.1099 ( 2449 PWs) bands (ev): -12.3212 -12.3204 -10.6266 -10.6260 -9.4338 -9.4318 -5.6352 -5.6346 -3.8613 -3.8604 -2.5103 -2.5088 0.6266 0.6290 1.2965 1.2989 1.6152 1.6168 2.5791 2.5824 3.6043 3.6121 4.7281 4.7365 5.8067 5.8099 6.0533 6.0611 6.7278 6.7336 8.2275 8.2293 8.7478 8.7502 9.7041 9.7116 10.2931 10.3002 11.4286 11.4333 11.6456 11.6518 12.1574 12.1639 13.1391 13.1426 13.6369 13.6387 15.0932 15.0960 16.4948 16.4985 18.1211 18.1250 19.5250 19.5323 20.8344 20.8377 k = 0.2705-0.0000 0.1066 ( 2447 PWs) bands (ev): -12.3600 -12.3593 -10.6415 -10.6408 -9.4190 -9.4169 -5.6568 -5.6562 -3.8822 -3.8813 -2.4996 -2.4982 0.6825 0.6851 1.3258 1.3286 1.6216 1.6233 2.6025 2.6058 3.6116 3.6193 4.7474 4.7561 5.7869 5.7902 6.0557 6.0635 6.7299 6.7357 8.2444 8.2462 8.7918 8.7943 9.7113 9.7188 10.3256 10.3325 11.4364 11.4418 11.6283 11.6355 12.1911 12.1977 13.1270 13.1303 13.6711 13.6732 15.0666 15.0695 16.4950 16.4987 18.0921 18.0960 19.5442 19.5515 20.8035 20.8071 k = 0.2623-0.0000 0.1034 ( 2450 PWs) bands (ev): -12.3982 -12.3975 -10.6565 -10.6559 -9.4048 -9.4028 -5.6785 -5.6779 -3.9026 -3.9017 -2.4896 -2.4882 0.7375 0.7403 1.3519 1.3555 1.6323 1.6343 2.6267 2.6301 3.6190 3.6265 4.7680 4.7770 5.7675 5.7709 6.0579 6.0657 6.7310 6.7368 8.2602 8.2620 8.8362 8.8388 9.7186 9.7260 10.3580 10.3648 11.4445 11.4510 11.6126 11.6209 12.2265 12.2332 13.1147 13.1180 13.7044 13.7067 15.0377 15.0408 16.4917 16.4955 18.0609 18.0647 19.5681 19.5753 20.7695 20.7735 k = 0.2541-0.0000 0.1002 ( 2448 PWs) bands (ev): -12.4358 -12.4351 -10.6716 -10.6710 -9.3913 -9.3893 -5.7002 -5.6997 -3.9225 -3.9216 -2.4801 -2.4787 0.7908 0.7939 1.3751 1.3796 1.6481 1.6507 2.6519 2.6553 3.6264 3.6337 4.7898 4.7990 5.7489 5.7524 6.0598 6.0677 6.7312 6.7370 8.2747 8.2766 8.8810 8.8838 9.7262 9.7336 10.3903 10.3969 11.4525 11.4603 11.5987 11.6084 12.2637 12.2704 13.1023 13.1057 13.7365 13.7391 15.0066 15.0098 16.4849 16.4887 18.0281 18.0319 19.5962 19.6034 20.7329 20.7373 k = 0.2459-0.0000 0.0969 ( 2445 PWs) bands (ev): -12.4726 -12.4720 -10.6868 -10.6861 -9.3785 -9.3765 -5.7219 -5.7214 -3.9419 -3.9410 -2.4712 -2.4698 0.8412 0.8445 1.3964 1.4018 1.6690 1.6721 2.6778 2.6814 3.6336 3.6408 4.8126 4.8220 5.7313 5.7350 6.0615 6.0694 6.7304 6.7362 8.2880 8.2899 8.9260 8.9289 9.7342 9.7416 10.4220 10.4285 11.4597 11.4688 11.5877 11.5988 12.3026 12.3094 13.0901 13.0934 13.7675 13.7703 14.9730 14.9765 16.4744 16.4782 17.9944 17.9981 19.6281 19.6351 20.6941 20.6990 k = 0.2377-0.0000 0.0937 ( 2446 PWs) bands (ev): -12.5087 -12.5081 -10.7019 -10.7013 -9.3664 -9.3644 -5.7435 -5.7430 -3.9607 -3.9598 -2.4628 -2.4615 0.8874 0.8910 1.4177 1.4238 1.6943 1.6978 2.7048 2.7086 3.6407 3.6476 4.8360 4.8456 5.7151 5.7189 6.0629 6.0708 6.7286 6.7344 8.2998 8.3018 8.9710 8.9739 9.7427 9.7501 10.4529 10.4593 11.4648 11.4752 11.5807 11.5930 12.3433 12.3502 13.0780 13.0814 13.7971 13.8003 14.9372 14.9408 16.4602 16.4640 17.9604 17.9640 19.6629 19.6697 20.6540 20.6593 k = 0.2295-0.0000 0.0905 ( 2442 PWs) bands (ev): -12.5440 -12.5434 -10.7169 -10.7163 -9.3550 -9.3530 -5.7650 -5.7644 -3.9789 -3.9781 -2.4550 -2.4537 0.9280 0.9317 1.4413 1.4479 1.7229 1.7267 2.7328 2.7369 3.6474 3.6541 4.8596 4.8695 5.7006 5.7046 6.0640 6.0720 6.7260 6.7317 8.3101 8.3121 9.0157 9.0188 9.7518 9.7592 10.4829 10.4892 11.4671 11.4780 11.5794 11.5922 12.3856 12.3925 13.0662 13.0696 13.8254 13.8288 14.8990 14.9030 16.4423 16.4461 17.9265 17.9299 19.7000 19.7065 20.6133 20.6191 k = 0.2213-0.0000 0.0872 ( 2439 PWs) bands (ev): -12.5784 -12.5778 -10.7318 -10.7312 -9.3442 -9.3423 -5.7862 -5.7857 -3.9965 -3.9957 -2.4477 -2.4465 0.9616 0.9653 1.4693 1.4762 1.7536 1.7575 2.7621 2.7664 3.6537 3.6602 4.8831 4.8931 5.6882 5.6924 6.0647 6.0729 6.7223 6.7281 8.3190 8.3210 9.0600 9.0632 9.7615 9.7689 10.5119 10.5180 11.4657 11.4760 11.5847 11.5969 12.4296 12.4365 13.0547 13.0581 13.8520 13.8558 14.8587 14.8629 16.4210 16.4247 17.8930 17.8964 19.7381 19.7441 20.5735 20.5798 k = 0.2131-0.0000 0.0840 ( 2441 PWs) bands (ev): -12.6118 -12.6113 -10.7465 -10.7459 -9.3342 -9.3323 -5.8072 -5.8067 -4.0135 -4.0127 -2.4410 -2.4397 0.9875 0.9910 1.5034 1.5105 1.7852 1.7893 2.7929 2.7974 3.6597 3.6659 4.9057 4.9159 5.6784 5.6828 6.0653 6.0735 6.7178 6.7235 8.3263 8.3284 9.1036 9.1069 9.7719 9.7794 10.5397 10.5456 11.4610 11.4701 11.5958 11.6067 12.4750 12.4818 13.0437 13.0471 13.8769 13.8811 14.8164 14.8210 16.3964 16.4001 17.8603 17.8635 19.7757 19.7812 20.5359 20.5429 k = 0.2049-0.0000 0.0808 ( 2444 PWs) bands (ev): -12.6444 -12.6438 -10.7610 -10.7604 -9.3248 -9.3230 -5.8279 -5.8273 -4.0298 -4.0290 -2.4347 -2.4335 1.0054 1.0088 1.5442 1.5512 1.8170 1.8211 2.8251 2.8300 3.6652 3.6712 4.9270 4.9373 5.6716 5.6763 6.0655 6.0739 6.7124 6.7181 8.3321 8.3342 9.1462 9.1497 9.7831 9.7905 10.5661 10.5719 11.4539 11.4616 11.6113 11.6207 12.5217 12.5285 13.0332 13.0366 13.8998 13.9044 14.7725 14.7774 16.3689 16.3726 17.8284 17.8315 19.8107 19.8155 20.5029 20.5106 k = 0.1967-0.0000 0.0775 ( 2446 PWs) bands (ev): -12.6759 -12.6754 -10.7752 -10.7747 -9.3161 -9.3143 -5.8482 -5.8477 -4.0455 -4.0447 -2.4289 -2.4278 1.0162 1.0193 1.5911 1.5980 1.8481 1.8524 2.8591 2.8643 3.6702 3.6761 4.9463 4.9565 5.6683 5.6732 6.0656 6.0741 6.7061 6.7117 8.3364 8.3385 9.1877 9.1912 9.7950 9.8024 10.5913 10.5969 11.4452 11.4516 11.6299 11.6380 12.5695 12.5762 13.0233 13.0268 13.9206 13.9257 14.7272 14.7325 16.3388 16.3424 17.7976 17.8006 19.8403 19.8444 20.4774 20.4859 k = 0.1885-0.0000 0.0743 ( 2448 PWs) bands (ev): -12.7064 -12.7059 -10.7891 -10.7886 -9.3080 -9.3063 -5.8680 -5.8676 -4.0606 -4.0598 -2.4236 -2.4225 1.0210 1.0237 1.6431 1.6501 1.8783 1.8826 2.8949 2.9004 3.6750 3.6806 4.9629 4.9731 5.6689 5.6740 6.0656 6.0742 6.6990 6.7046 8.3392 8.3413 9.2277 9.2314 9.8076 9.8151 10.6151 10.6206 11.4357 11.4410 11.6508 11.6578 12.6181 12.6246 13.0142 13.0177 13.9388 13.9444 14.6812 14.6869 16.3066 16.3102 17.7677 17.7706 19.8613 19.8647 20.4626 20.4720 k = 0.1803-0.0000 0.0711 ( 2446 PWs) bands (ev): -12.7358 -12.7354 -10.8027 -10.8022 -9.3005 -9.2988 -5.8875 -5.8870 -4.0749 -4.0742 -2.4187 -2.4176 1.0209 1.0232 1.6990 1.7059 1.9071 1.9117 2.9325 2.9382 3.6794 3.6848 4.9763 4.9864 5.6735 5.6789 6.0655 6.0742 6.6911 6.6968 8.3406 8.3427 9.2661 9.2698 9.8211 9.8285 10.6376 10.6429 11.4257 11.4301 11.6735 11.6796 12.6672 12.6734 13.0061 13.0096 13.9542 13.9604 14.6350 14.6413 16.2727 16.2762 17.7388 17.7416 19.8706 19.8734 20.4618 20.4721 k = 0.1721-0.0000 0.0679 ( 2450 PWs) bands (ev): -12.7642 -12.7638 -10.8159 -10.8154 -9.2936 -9.2920 -5.9064 -5.9059 -4.0886 -4.0879 -2.4142 -2.4132 1.0172 1.0192 1.7570 1.7642 1.9347 1.9397 2.9718 2.9778 3.6835 3.6888 4.9861 4.9959 5.6821 5.6878 6.0654 6.0743 6.6826 6.6882 8.3407 8.3428 9.3026 9.3063 9.8353 9.8426 10.6588 10.6640 11.4155 11.4192 11.6976 11.7029 12.7161 12.7220 12.9992 13.0028 13.9662 13.9730 14.5895 14.5963 16.2374 16.2408 17.7108 17.7135 19.8665 19.8690 20.4767 20.4877 k = 0.1639-0.0000 0.0646 ( 2454 PWs) bands (ev): -12.7914 -12.7910 -10.8287 -10.8282 -9.2873 -9.2857 -5.9247 -5.9243 -4.1017 -4.1010 -2.4101 -2.4091 1.0108 1.0125 1.8155 1.8233 1.9614 1.9671 3.0127 3.0188 3.6876 3.6928 4.9921 5.0017 5.6947 5.7006 6.0655 6.0746 6.6735 6.6792 8.3395 8.3415 9.3370 9.3407 9.8501 9.8573 10.6788 10.6838 11.4053 11.4085 11.7227 11.7274 12.7642 12.7696 12.9942 12.9979 13.9742 13.9818 14.5456 14.5530 16.2012 16.2045 17.6837 17.6863 19.8496 19.8521 20.5070 20.5183 k = 0.1557-0.0000 0.0614 ( 2452 PWs) bands (ev): -12.8174 -12.8171 -10.8410 -10.8406 -9.2815 -9.2800 -5.9425 -5.9421 -4.1140 -4.1134 -2.4064 -2.4055 1.0025 1.0041 1.8722 1.8808 1.9888 1.9953 3.0548 3.0611 3.6918 3.6969 4.9944 5.0037 5.7105 5.7168 6.0659 6.0752 6.6640 6.6697 8.3371 8.3392 9.3691 9.3729 9.8656 9.8726 10.6976 10.7024 11.3952 11.3980 11.7488 11.7529 12.8101 12.8148 12.9921 12.9960 13.9776 13.9858 14.5044 14.5124 16.1645 16.1678 17.6574 17.6599 19.8224 19.8248 20.5503 20.5616 k = 0.1475-0.0000 0.0582 ( 2452 PWs) bands (ev): -12.8423 -12.8419 -10.8529 -10.8525 -9.2762 -9.2747 -5.9596 -5.9592 -4.1257 -4.1251 -2.4030 -2.4021 0.9930 0.9943 1.9232 1.9324 2.0204 2.0275 3.0979 3.1043 3.6963 3.7013 4.9931 5.0020 5.7290 5.7356 6.0669 6.0764 6.6542 6.6599 8.3337 8.3357 9.3989 9.4026 9.8815 9.8884 10.7153 10.7200 11.3854 11.3877 11.7754 11.7792 12.8513 12.8547 12.9953 12.9996 13.9754 13.9844 14.4671 14.4758 16.1277 16.1309 17.6319 17.6343 19.7876 19.7900 20.6036 20.6149 k = 0.1393-0.0000 0.0549 ( 2452 PWs) bands (ev): -12.8659 -12.8656 -10.8642 -10.8638 -9.2714 -9.2700 -5.9760 -5.9756 -4.1368 -4.1361 -2.4000 -2.3991 0.9827 0.9839 1.9638 1.9721 2.0616 2.0679 3.1415 3.1480 3.7013 3.7063 4.9886 4.9972 5.7492 5.7560 6.0687 6.0783 6.6443 6.6500 8.3293 8.3312 9.4263 9.4299 9.8978 9.9044 10.7321 10.7365 11.3759 11.3779 11.8025 11.8058 12.8832 12.8854 13.0075 13.0129 13.9672 13.9768 14.4350 14.4441 16.0912 16.0942 17.6071 17.6095 19.7480 19.7502 20.6645 20.6756 k = 0.1311-0.0000 0.0517 ( 2453 PWs) bands (ev): -12.8884 -12.8881 -10.8751 -10.8747 -9.2670 -9.2657 -5.9917 -5.9913 -4.1471 -4.1465 -2.3973 -2.3964 0.9719 0.9730 1.9928 1.9990 2.1128 2.1172 3.1850 3.1915 3.7071 3.7122 4.9814 4.9895 5.7701 5.7770 6.0715 6.0812 6.6345 6.6402 8.3240 8.3259 9.4512 9.4547 9.9142 9.9205 10.7479 10.7522 11.3667 11.3684 11.8297 11.8327 12.9018 12.9040 13.0322 13.0386 13.9526 13.9626 14.4088 14.4181 16.0551 16.0580 17.5831 17.5853 19.7054 19.7076 20.7307 20.7415 k = 0.1230-0.0000 0.0485 ( 2449 PWs) bands (ev): -12.9095 -12.9093 -10.8854 -10.8850 -9.2631 -9.2618 -6.0066 -6.0063 -4.1568 -4.1563 -2.3948 -2.3940 0.9610 0.9619 2.0134 2.0180 2.1690 2.1717 3.2278 3.2342 3.7142 3.7193 4.9718 4.9795 5.7906 5.7975 6.0757 6.0855 6.6251 6.6308 8.3180 8.3199 9.4737 9.4771 9.9306 9.9366 10.7630 10.7670 11.3578 11.3593 11.8569 11.8596 12.9097 12.9124 13.0670 13.0740 13.9319 13.9420 14.3888 14.3980 16.0199 16.0227 17.5598 17.5620 19.6616 19.6636 20.8005 20.8110 k = 0.1148-0.0000 0.0452 ( 2449 PWs) bands (ev): -12.9294 -12.9292 -10.8951 -10.8948 -9.2595 -9.2583 -6.0207 -6.0204 -4.1659 -4.1653 -2.3926 -2.3918 0.9502 0.9510 2.0290 2.0325 2.2262 2.2280 3.2692 3.2754 3.7229 3.7280 4.9602 4.9677 5.8096 5.8165 6.0815 6.0912 6.6162 6.6220 8.3115 8.3133 9.4939 9.4972 9.9468 9.9523 10.7773 10.7811 11.3493 11.3507 11.8838 11.8862 12.9120 12.9150 13.1069 13.1140 13.9058 13.9159 14.3746 14.3835 15.9858 15.9884 17.5373 17.5394 19.6175 19.6194 20.8725 20.8827 k = 0.1066-0.0000 0.0420 ( 2449 PWs) bands (ev): -12.9480 -12.9478 -10.9042 -10.9039 -9.2563 -9.2552 -6.0340 -6.0337 -4.1743 -4.1738 -2.3906 -2.3899 0.9396 0.9403 2.0413 2.0442 2.2828 2.2839 3.3083 3.3143 3.7336 3.7389 4.9471 4.9542 5.8265 5.8330 6.0891 6.0986 6.6082 6.6139 8.3044 8.3061 9.5119 9.5150 9.9624 9.9676 10.7909 10.7945 11.3413 11.3424 11.9102 11.9124 12.9118 12.9149 13.1482 13.1553 13.8757 13.8856 14.3653 14.3738 15.9530 15.9555 17.5157 17.5177 19.5741 19.5758 20.9456 20.9555 k = 0.0984-0.0000 0.0388 ( 2449 PWs) bands (ev): -12.9653 -12.9651 -10.9128 -10.9125 -9.2535 -9.2525 -6.0465 -6.0462 -4.1820 -4.1815 -2.3889 -2.3882 0.9294 0.9300 2.0514 2.0537 2.3375 2.3383 3.3443 3.3500 3.7468 3.7523 4.9329 4.9397 5.8405 5.8465 6.0983 6.1075 6.6013 6.6070 8.2970 8.2987 9.5279 9.5307 9.9773 9.9820 10.8039 10.8072 11.3337 11.3347 11.9358 11.9378 12.9105 12.9136 13.1890 13.1961 13.8429 13.8526 14.3599 14.3678 15.9218 15.9241 17.4950 17.4969 19.5320 19.5336 21.0188 21.0284 k = 0.0902-0.0000 0.0355 ( 2447 PWs) bands (ev): -12.9813 -12.9811 -10.9207 -10.9204 -9.2510 -9.2501 -6.0580 -6.0578 -4.1891 -4.1887 -2.3873 -2.3868 0.9197 0.9202 2.0596 2.0615 2.3899 2.3904 3.3766 3.3819 3.7628 3.7684 4.9179 4.9244 5.8514 5.8568 6.1087 6.1176 6.5957 6.6014 8.2895 8.2910 9.5419 9.5445 9.9913 9.9956 10.8162 10.8193 11.3265 11.3275 11.9604 11.9621 12.9090 12.9120 13.2282 13.2352 13.8090 13.8185 14.3575 14.3647 15.8924 15.8946 17.4753 17.4771 19.4918 19.4932 21.0911 21.1003 k = 0.0820-0.0000 0.0323 ( 2449 PWs) bands (ev): -12.9959 -12.9957 -10.9279 -10.9277 -9.2488 -9.2479 -6.0686 -6.0684 -4.1956 -4.1952 -2.3860 -2.3855 0.9106 0.9111 2.0664 2.0680 2.4393 2.4398 3.4045 3.4094 3.7817 3.7874 4.9024 4.9085 5.8594 5.8639 6.1199 6.1283 6.5917 6.5973 8.2819 8.2833 9.5541 9.5565 10.0042 10.0081 10.8278 10.8307 11.3199 11.3207 11.9837 11.9853 12.9075 12.9104 13.2649 13.2720 13.7752 13.7846 14.3569 14.3635 15.8650 15.8669 17.4568 17.4584 19.4538 19.4552 21.1615 21.1702 k = 0.0738-0.0000 0.0291 ( 2451 PWs) bands (ev): -13.0092 -13.0090 -10.9346 -10.9343 -9.2468 -9.2461 -6.0783 -6.0781 -4.2014 -4.2010 -2.3848 -2.3843 0.9022 0.9026 2.0720 2.0734 2.4853 2.4858 3.4280 3.4324 3.8033 3.8090 4.8867 4.8925 5.8646 5.8685 6.1311 6.1391 6.5894 6.5948 8.2744 8.2757 9.5647 9.5669 10.0160 10.0195 10.8387 10.8413 11.3138 11.3145 12.0056 12.0070 12.9062 12.9090 13.2986 13.3059 13.7427 13.7520 14.3577 14.3637 15.8396 15.8414 17.4395 17.4410 19.4186 19.4198 21.2290 21.2373 k = 0.0656-0.0000 0.0258 ( 2453 PWs) bands (ev): -13.0211 -13.0209 -10.9405 -10.9403 -9.2452 -9.2445 -6.0870 -6.0869 -4.2066 -4.2063 -2.3838 -2.3834 0.8945 0.8949 2.0766 2.0778 2.5276 2.5281 3.4471 3.4509 3.8269 3.8325 4.8712 4.8766 5.8676 5.8708 6.1418 6.1491 6.5887 6.5938 8.2672 8.2684 9.5738 9.5758 10.0266 10.0296 10.8488 10.8511 11.3083 11.3089 12.0258 12.0270 12.9052 12.9079 13.3288 13.3362 13.7126 13.7218 14.3593 14.3646 15.8166 15.8182 17.4236 17.4250 19.3863 19.3874 21.2927 21.3005 k = 0.0574-0.0000 0.0226 ( 2456 PWs) bands (ev): -13.0316 -13.0315 -10.9458 -10.9456 -9.2437 -9.2431 -6.0948 -6.0946 -4.2112 -4.2109 -2.3830 -2.3826 0.8876 0.8879 2.0803 2.0814 2.5659 2.5663 3.4622 3.4655 3.8516 3.8569 4.8562 4.8612 5.8689 5.8715 6.1514 6.1581 6.5895 6.5942 8.2604 8.2615 9.5816 9.5834 10.0358 10.0385 10.8581 10.8601 11.3033 11.3039 12.0442 12.0452 12.9046 12.9070 13.3549 13.3624 13.6857 13.6949 14.3613 14.3659 15.7960 15.7974 17.4092 17.4105 19.3573 19.3582 21.3516 21.3588 k = 0.0492-0.0000 0.0194 ( 2452 PWs) bands (ev): -13.0407 -13.0406 -10.9504 -10.9502 -9.2425 -9.2420 -6.1015 -6.1014 -4.2151 -4.2149 -2.3822 -2.3819 0.8816 0.8818 2.0834 2.0842 2.5997 2.6002 3.4739 3.4767 3.8763 3.8812 4.8420 4.8465 5.8690 5.8710 6.1597 6.1656 6.5915 6.5957 8.2541 8.2551 9.5882 9.5897 10.0438 10.0461 10.8664 10.8681 11.2990 11.2995 12.0604 12.0613 12.9043 12.9065 13.3766 13.3841 13.6629 13.6718 14.3635 14.3675 15.7779 15.7791 17.3965 17.3976 19.3317 19.3325 21.4047 21.4112 k = 0.0410-0.0000 0.0162 ( 2440 PWs) bands (ev): -13.0485 -13.0484 -10.9542 -10.9541 -9.2415 -9.2410 -6.1072 -6.1071 -4.2184 -4.2182 -2.3816 -2.3813 0.8764 0.8766 2.0858 2.0865 2.6290 2.6294 3.4827 3.4851 3.8999 3.9042 4.8291 4.8330 5.8683 5.8699 6.1665 6.1716 6.5944 6.5980 8.2486 8.2494 9.5936 9.5949 10.0505 10.0524 10.8736 10.8751 11.2953 11.2957 12.0745 12.0751 12.9043 12.9063 13.3937 13.4010 13.6447 13.6531 14.3657 14.3690 15.7624 15.7634 17.3856 17.3865 19.3098 19.3105 21.4511 21.4569 k = 0.0328-0.0000 0.0129 ( 2439 PWs) bands (ev): -13.0548 -13.0548 -10.9574 -10.9573 -9.2407 -9.2403 -6.1119 -6.1118 -4.2211 -4.2210 -2.3811 -2.3809 0.8722 0.8723 2.0878 2.0883 2.6532 2.6536 3.4893 3.4911 3.9211 3.9248 4.8178 4.8211 5.8672 5.8684 6.1719 6.1761 6.5976 6.6006 8.2439 8.2446 9.5979 9.5990 10.0560 10.0574 10.8797 10.8809 11.2923 11.2926 12.0861 12.0867 12.9045 12.9062 13.4063 13.4129 13.6314 13.6389 14.3676 14.3703 15.7497 15.7505 17.3765 17.3772 19.2917 19.2922 21.4901 21.4949 k = 0.0246-0.0000 0.0097 ( 2437 PWs) bands (ev): -13.0598 -13.0597 -10.9599 -10.9599 -9.2400 -9.2397 -6.1156 -6.1155 -4.2232 -4.2231 -2.3808 -2.3806 0.8688 0.8690 2.0892 2.0896 2.6724 2.6726 3.4940 3.4953 3.9389 3.9418 4.8086 4.8111 5.8660 5.8668 6.1760 6.1792 6.6008 6.6031 8.2401 8.2406 9.6013 9.6021 10.0602 10.0613 10.8846 10.8855 11.2899 11.2902 12.0953 12.0957 12.9049 12.9062 13.4149 13.4204 13.6227 13.6289 14.3693 14.3713 15.7397 15.7403 17.3693 17.3699 19.2775 19.2779 21.5211 21.5249 k = 0.0164-0.0000 0.0065 ( 2431 PWs) bands (ev): -13.0633 -13.0633 -10.9617 -10.9616 -9.2395 -9.2394 -6.1182 -6.1181 -4.2247 -4.2247 -2.3805 -2.3804 0.8665 0.8665 2.0902 2.0905 2.6862 2.6864 3.4971 3.4981 3.9525 3.9545 4.8018 4.8036 5.8650 5.8656 6.1790 6.1811 6.6035 6.6050 8.2374 8.2377 9.6037 9.6042 10.0632 10.0640 10.8882 10.8887 11.2882 11.2884 12.1020 12.1022 12.9053 12.9062 13.4203 13.4242 13.6180 13.6223 14.3706 14.3720 15.7326 15.7330 17.3642 17.3645 19.2673 19.2676 21.5437 21.5463 k = 0.0082-0.0000 0.0032 ( 2433 PWs) bands (ev): -13.0654 -13.0654 -10.9628 -10.9627 -9.2393 -9.2392 -6.1198 -6.1197 -4.2256 -4.2256 -2.3803 -2.3802 0.8650 0.8651 2.0908 2.0909 2.6945 2.6946 3.4990 3.4995 3.9612 3.9622 4.7978 4.7987 5.8644 5.8647 6.1809 6.1820 6.6054 6.6062 8.2357 8.2359 9.6052 9.6054 10.0651 10.0655 10.8904 10.8907 11.2872 11.2873 12.1060 12.1061 12.9057 12.9061 13.4235 13.4255 13.6161 13.6183 14.3716 14.3722 15.7283 15.7285 17.3611 17.3613 19.2612 19.2613 21.5576 21.5589 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 k = 0.0000 0.0079 0.0038 ( 2436 PWs) bands (ev): -13.0654 -13.0654 -10.9629 -10.9629 -9.2398 -9.2397 -6.1204 -6.1203 -4.2263 -4.2262 -2.3811 -2.3811 0.8651 0.8654 2.0893 2.0901 2.6975 2.6976 3.4996 3.5005 3.9649 3.9655 4.7957 4.7960 5.8636 5.8639 6.1827 6.1840 6.6057 6.6069 8.2342 8.2349 9.6022 9.6027 10.0691 10.0703 10.8914 10.8917 11.2880 11.2882 12.1074 12.1075 12.9052 12.9056 13.4250 13.4255 13.6155 13.6160 14.3720 14.3723 15.7261 15.7263 17.3599 17.3602 19.2599 19.2599 21.5628 21.5630 k = 0.0000 0.0158 0.0076 ( 2432 PWs) bands (ev): -13.0634 -13.0634 -10.9622 -10.9622 -9.2416 -9.2413 -6.1205 -6.1204 -4.2273 -4.2272 -2.3839 -2.3838 0.8670 0.8676 2.0849 2.0864 2.6980 2.6983 3.4999 3.5016 3.9666 3.9679 4.7932 4.7937 5.8618 5.8624 6.1865 6.1890 6.6050 6.6075 8.2317 8.2332 9.5926 9.5935 10.0798 10.0821 10.8923 10.8929 11.2914 11.2918 12.1075 12.1076 12.9034 12.9042 13.4250 13.4260 13.6137 13.6147 14.3721 14.3725 15.7237 15.7240 17.3596 17.3601 19.2621 19.2622 21.5633 21.5636 k = 0.0000 0.0237 0.0114 ( 2432 PWs) bands (ev): -13.0600 -13.0599 -10.9610 -10.9610 -9.2445 -9.2442 -6.1208 -6.1206 -4.2290 -4.2289 -2.3884 -2.3883 0.8702 0.8711 2.0780 2.0801 2.6989 2.6993 3.5006 3.5031 3.9696 3.9715 4.7893 4.7900 5.8588 5.8597 6.1927 6.1965 6.6044 6.6081 8.2281 8.2303 9.5778 9.5790 10.0969 10.1000 10.8939 10.8947 11.2971 11.2976 12.1077 12.1078 12.9006 12.9018 13.4252 13.4267 13.6108 13.6124 14.3722 14.3729 15.7196 15.7201 17.3592 17.3599 19.2659 19.2660 21.5641 21.5645 k = 0.0000 0.0315 0.0152 ( 2441 PWs) bands (ev): -13.0552 -13.0552 -10.9594 -10.9594 -9.2487 -9.2482 -6.1211 -6.1208 -4.2314 -4.2312 -2.3947 -2.3946 0.8745 0.8758 2.0687 2.0715 2.7002 2.7007 3.5015 3.5048 3.9737 3.9761 4.7845 4.7855 5.8544 5.8556 6.2011 6.2062 6.6041 6.6091 8.2235 8.2264 9.5590 9.5604 10.1188 10.1227 10.8961 10.8973 11.3049 11.3056 12.1079 12.1081 12.8970 12.8986 13.4255 13.4275 13.6070 13.6090 14.3723 14.3733 15.7140 15.7146 17.3585 17.3595 19.2712 19.2713 21.5648 21.5654 k = 0.0000 0.0394 0.0190 ( 2442 PWs) bands (ev): -13.0491 -13.0490 -10.9573 -10.9573 -9.2540 -9.2534 -6.1215 -6.1212 -4.2343 -4.2340 -2.4027 -2.4027 0.8799 0.8815 2.0574 2.0609 2.7018 2.7024 3.5027 3.5067 3.9786 3.9817 4.7794 4.7806 5.8485 5.8499 6.2110 6.2174 6.6045 6.6108 8.2185 8.2220 9.5374 9.5389 10.1442 10.1489 10.8990 10.9005 11.3148 11.3157 12.1083 12.1085 12.8928 12.8948 13.4261 13.4285 13.6022 13.6045 14.3726 14.3737 15.7069 15.7076 17.3578 17.3590 19.2780 19.2781 21.5654 21.5661 k = 0.0000 0.0473 0.0227 ( 2447 PWs) bands (ev): -13.0416 -13.0416 -10.9548 -10.9548 -9.2605 -9.2598 -6.1220 -6.1216 -4.2378 -4.2375 -2.4125 -2.4125 0.8862 0.8880 2.0445 2.0486 2.7038 2.7045 3.5038 3.5085 3.9843 3.9878 4.7746 4.7760 5.8408 5.8424 6.2215 6.2293 6.6059 6.6134 8.2134 8.2176 9.5140 9.5156 10.1718 10.1771 10.9026 10.9043 11.3266 11.3277 12.1087 12.1089 12.8881 12.8906 13.4268 13.4295 13.5964 13.5991 14.3728 14.3742 15.6982 15.6991 17.3569 17.3584 19.2863 19.2865 21.5655 21.5664 k = 0.0000 0.0552 0.0265 ( 2452 PWs) bands (ev): -13.0328 -13.0327 -10.9519 -10.9518 -9.2682 -9.2674 -6.1226 -6.1221 -4.2418 -4.2414 -2.4240 -2.4240 0.8931 0.8952 2.0303 2.0350 2.7060 2.7068 3.5048 3.5102 3.9903 3.9943 4.7706 4.7723 5.8312 5.8330 6.2318 6.2407 6.6088 6.6174 8.2088 8.2136 9.4894 9.4910 10.2005 10.2063 10.9068 10.9088 11.3401 11.3413 12.1092 12.1095 12.8835 12.8863 13.4277 13.4307 13.5898 13.5927 14.3731 14.3746 15.6881 15.6891 17.3560 17.3577 19.2962 19.2964 21.5648 21.5658 k = 0.0000 0.0631 0.0303 ( 2453 PWs) bands (ev): -13.0227 -13.0226 -10.9485 -10.9484 -9.2771 -9.2762 -6.1232 -6.1227 -4.2462 -4.2458 -2.4372 -2.4371 0.9004 0.9029 2.0153 2.0206 2.7085 2.7094 3.5056 3.5115 3.9963 4.0009 4.7681 4.7701 5.8196 5.8216 6.2409 6.2509 6.6137 6.6233 8.2052 8.2105 9.4642 9.4657 10.2295 10.2358 10.9117 10.9139 11.3551 11.3565 12.1098 12.1102 12.8790 12.8823 13.4288 13.4320 13.5824 13.5855 14.3732 14.3749 15.6765 15.6776 17.3551 17.3570 19.3076 19.3079 21.5629 21.5641 k = 0.0000 0.0710 0.0341 ( 2457 PWs) bands (ev): -13.0112 -13.0111 -10.9447 -10.9446 -9.2871 -9.2862 -6.1239 -6.1234 -4.2510 -4.2504 -2.4520 -2.4519 0.9079 0.9106 1.9999 2.0057 2.7111 2.7121 3.5061 3.5125 4.0023 4.0072 4.7676 4.7698 5.8061 5.8081 6.2480 6.2589 6.6209 6.6312 8.2032 8.2089 9.4386 9.4401 10.2580 10.2647 10.9172 10.9197 11.3712 11.3728 12.1105 12.1109 12.8752 12.8789 13.4300 13.4334 13.5742 13.5774 14.3732 14.3751 15.6635 15.6648 17.3541 17.3562 19.3206 19.3209 21.5595 21.5610 k = 0.0000 0.0789 0.0379 ( 2458 PWs) bands (ev): -12.9985 -12.9983 -10.9405 -10.9404 -9.2984 -9.2973 -6.1247 -6.1241 -4.2560 -4.2554 -2.4685 -2.4684 0.9153 0.9182 1.9846 1.9909 2.7140 2.7151 3.5062 3.5130 4.0078 4.0130 4.7694 4.7717 5.7906 5.7927 6.2525 6.2639 6.6306 6.6414 8.2032 8.2094 9.4129 9.4143 10.2855 10.2926 10.9233 10.9260 11.3883 11.3901 12.1113 12.1118 12.8724 12.8766 13.4312 13.4347 13.5656 13.5687 14.3730 14.3749 15.6493 15.6506 17.3532 17.3555 19.3351 19.3354 21.5544 21.5561 k = 0.0000 0.0868 0.0417 ( 2459 PWs) bands (ev): -12.9844 -12.9842 -10.9360 -10.9359 -9.3109 -9.3097 -6.1256 -6.1249 -4.2611 -4.2605 -2.4865 -2.4864 0.9222 0.9253 1.9699 1.9766 2.7169 2.7181 3.5058 3.5130 4.0128 4.0183 4.7738 4.7762 5.7730 5.7753 6.2540 6.2657 6.6428 6.6538 8.2056 8.2122 9.3871 9.3885 10.3115 10.3190 10.9299 10.9329 11.4060 11.4080 12.1122 12.1128 12.8709 12.8755 13.4323 13.4358 13.5567 13.5596 14.3724 14.3745 15.6338 15.6353 17.3522 17.3548 19.3511 19.3515 21.5473 21.5492 k = 0.0000 0.0946 0.0455 ( 2463 PWs) bands (ev): -12.9690 -12.9689 -10.9311 -10.9310 -9.3246 -9.3233 -6.1266 -6.1259 -4.2663 -4.2656 -2.5060 -2.5059 0.9283 0.9316 1.9560 1.9631 2.7199 2.7212 3.5051 3.5126 4.0173 4.0229 4.7807 4.7833 5.7537 5.7561 6.2524 6.2642 6.6572 6.6681 8.2108 8.2177 9.3613 9.3627 10.3358 10.3435 10.9371 10.9402 11.4241 11.4263 12.1132 12.1138 12.8712 12.8762 13.4330 13.4366 13.5478 13.5505 14.3713 14.3735 15.6173 15.6188 17.3514 17.3542 19.3686 19.3690 21.5381 21.5402 k = 0.0000 0.1025 0.0493 ( 2464 PWs) bands (ev): -12.9524 -12.9522 -10.9259 -10.9257 -9.3395 -9.3381 -6.1277 -6.1269 -4.2715 -4.2707 -2.5271 -2.5270 0.9334 0.9369 1.9435 1.9510 2.7229 2.7244 3.5040 3.5118 4.0212 4.0269 4.7902 4.7928 5.7326 5.7350 6.2480 6.2595 6.6734 6.6840 8.2190 8.2262 9.3356 9.3369 10.3580 10.3661 10.9447 10.9480 11.4425 11.4448 12.1143 12.1150 12.8734 12.8788 13.4329 13.4367 13.5393 13.5420 14.3696 14.3719 15.5998 15.6013 17.3508 17.3537 19.3875 19.3879 21.5266 21.5289 k = 0.0000 0.1104 0.0531 ( 2465 PWs) bands (ev): -12.9345 -12.9343 -10.9204 -10.9202 -9.3556 -9.3541 -6.1289 -6.1281 -4.2764 -4.2756 -2.5496 -2.5495 0.9371 0.9407 1.9326 1.9405 2.7259 2.7274 3.5026 3.5107 4.0246 4.0303 4.8020 4.8045 5.7099 5.7124 6.2409 6.2522 6.6909 6.7010 8.2303 8.2378 9.3098 9.3112 10.3780 10.3863 10.9527 10.9562 11.4608 11.4633 12.1155 12.1163 12.8777 12.8835 13.4313 13.4355 13.5319 13.5349 14.3671 14.3696 15.5814 15.5830 17.3503 17.3534 19.4078 19.4082 21.5127 21.5152 k = 0.0000 0.1183 0.0569 ( 2465 PWs) bands (ev): -12.9154 -12.9152 -10.9146 -10.9144 -9.3729 -9.3713 -6.1302 -6.1293 -4.2811 -4.2802 -2.5736 -2.5734 0.9391 0.9429 1.9237 1.9319 2.7287 2.7304 3.5011 3.5094 4.0276 4.0333 4.8156 4.8181 5.6858 5.6884 6.2316 6.2424 6.7093 6.7188 8.2447 8.2523 9.2841 9.2855 10.3957 10.4043 10.9611 10.9646 11.4791 11.4817 12.1168 12.1177 12.8844 12.8906 13.4275 13.4324 13.5265 13.5302 14.3637 14.3663 15.5624 15.5640 17.3501 17.3534 19.4293 19.4298 21.4965 21.4992 k = 0.0000 0.1262 0.0606 ( 2468 PWs) bands (ev): -12.8950 -12.8948 -10.9085 -10.9083 -9.3913 -9.3897 -6.1317 -6.1308 -4.2853 -4.2844 -2.5989 -2.5987 0.9393 0.9431 1.9170 1.9255 2.7314 2.7332 3.4995 3.5080 4.0304 4.0359 4.8307 4.8331 5.6607 5.6633 6.2205 6.2308 6.7282 6.7371 8.2620 8.2697 9.2583 9.2597 10.4110 10.4198 10.9697 10.9734 11.4972 11.5000 12.1182 12.1192 12.8934 12.8999 13.4208 13.4265 13.5240 13.5287 14.3592 14.3619 15.5428 15.5444 17.3502 17.3536 19.4521 19.4527 21.4780 21.4809 k = 0.0000 0.1341 0.0644 ( 2468 PWs) bands (ev): -12.8735 -12.8733 -10.9023 -10.9021 -9.4109 -9.4092 -6.1334 -6.1324 -4.2889 -4.2879 -2.6255 -2.6253 0.9374 0.9412 1.9128 1.9216 2.7338 2.7358 3.4980 3.5067 4.0331 4.0385 4.8468 4.8491 5.6347 5.6373 6.2078 6.2176 6.7474 6.7558 8.2818 8.2896 9.2324 9.2340 10.4239 10.4330 10.9786 10.9823 11.5153 11.5182 12.1198 12.1208 12.9047 12.9115 13.4111 13.4175 13.5252 13.5308 14.3535 14.3564 15.5229 15.5244 17.3506 17.3542 19.4761 19.4766 21.4571 21.4601 k = 0.0000 0.1420 0.0682 ( 2468 PWs) bands (ev): -12.8508 -12.8505 -10.8959 -10.8957 -9.4316 -9.4299 -6.1352 -6.1342 -4.2919 -4.2908 -2.6534 -2.6533 0.9332 0.9370 1.9111 1.9201 2.7361 2.7382 3.4968 3.5056 4.0358 4.0411 4.8633 4.8655 5.6083 5.6109 6.1940 6.2033 6.7669 6.7747 8.3038 8.3115 9.2066 9.2082 10.4346 10.4439 10.9876 10.9913 11.5334 11.5364 12.1216 12.1226 12.9179 12.9250 13.3986 13.4055 13.5300 13.5362 14.3464 14.3494 15.5028 15.5043 17.3515 17.3552 19.5010 19.5017 21.4338 21.4369 k = 0.0000 0.1498 0.0720 ( 2476 PWs) bands (ev): -12.8269 -12.8267 -10.8894 -10.8892 -9.4535 -9.4516 -6.1373 -6.1363 -4.2940 -4.2929 -2.6826 -2.6824 0.9266 0.9304 1.9119 1.9212 2.7379 2.7402 3.4959 3.5049 4.0387 4.0438 4.8797 4.8817 5.5818 5.5844 6.1792 6.1880 6.7866 6.7938 8.3273 8.3350 9.1807 9.1825 10.4430 10.4525 10.9967 11.0004 11.5516 11.5547 12.1235 12.1246 12.9327 12.9400 13.3839 13.3910 13.5383 13.5449 14.3378 14.3409 15.4827 15.4842 17.3527 17.3566 19.5269 19.5276 21.4080 21.4113 k = 0.0000 0.1577 0.0758 ( 2471 PWs) bands (ev): -12.8019 -12.8017 -10.8829 -10.8826 -9.4763 -9.4744 -6.1396 -6.1385 -4.2952 -4.2941 -2.7129 -2.7127 0.9176 0.9214 1.9154 1.9249 2.7396 2.7420 3.4955 3.5046 4.0418 4.0468 4.8956 4.8974 5.5556 5.5581 6.1637 6.1720 6.8067 6.8134 8.3517 8.3593 9.1551 9.1569 10.4494 10.4590 11.0058 11.0095 11.5703 11.5735 12.1256 12.1268 12.9488 12.9563 13.3675 13.3746 13.5498 13.5565 14.3276 14.3308 15.4628 15.4642 17.3544 17.3584 19.5537 19.5545 21.3798 21.3833 k = 0.0000 0.1656 0.0796 ( 2468 PWs) bands (ev): -12.7759 -12.7756 -10.8763 -10.8760 -9.5002 -9.4982 -6.1422 -6.1411 -4.2953 -4.2941 -2.7442 -2.7440 0.9061 0.9099 1.9215 1.9311 2.7409 2.7434 3.4958 3.5048 4.0453 4.0500 4.9104 4.9120 5.5300 5.5325 6.1477 6.1555 6.8273 6.8335 8.3763 8.3838 9.1296 9.1316 10.4539 10.4636 11.0149 11.0185 11.5895 11.5928 12.1281 12.1292 12.9656 12.9733 13.3497 13.3569 13.5641 13.5708 14.3157 14.3191 15.4433 15.4446 17.3565 17.3607 19.5812 19.5820 21.3491 21.3527 k = 0.0000 0.1735 0.0834 ( 2469 PWs) bands (ev): -12.7488 -12.7485 -10.8698 -10.8695 -9.5249 -9.5229 -6.1451 -6.1439 -4.2943 -4.2931 -2.7766 -2.7764 0.8922 0.8959 1.9299 1.9396 2.7418 2.7445 3.4967 3.5058 4.0491 4.0536 4.9238 4.9252 5.5053 5.5077 6.1312 6.1386 6.8486 6.8543 8.4003 8.4076 9.1048 9.1070 10.4566 10.4665 11.0240 11.0275 11.6096 11.6129 12.1308 12.1319 12.9826 12.9904 13.3310 13.3381 13.5811 13.5878 14.3021 14.3057 15.4243 15.4256 17.3591 17.3634 19.6092 19.6101 21.3158 21.3195 k = 0.0000 0.1814 0.0872 ( 2471 PWs) bands (ev): -12.7207 -12.7204 -10.8635 -10.8631 -9.5506 -9.5485 -6.1482 -6.1471 -4.2920 -4.2908 -2.8099 -2.8096 0.8760 0.8796 1.9406 1.9505 2.7425 2.7452 3.4984 3.5075 4.0533 4.0576 4.9355 4.9367 5.4818 5.4842 6.1144 6.1214 6.8708 6.8760 8.4228 8.4297 9.0808 9.0833 10.4579 10.4679 11.0331 11.0364 11.6306 11.6341 12.1338 12.1350 12.9991 13.0070 13.3116 13.3186 13.6006 13.6073 14.2869 14.2906 15.4060 15.4072 17.3622 17.3665 19.6378 19.6388 21.2800 21.2837 k = 0.0000 0.1893 0.0910 ( 2472 PWs) bands (ev): -12.6916 -12.6913 -10.8573 -10.8569 -9.5770 -9.5749 -6.1517 -6.1505 -4.2884 -4.2871 -2.8440 -2.8437 0.8575 0.8611 1.9534 1.9634 2.7428 2.7456 3.5010 3.5100 4.0579 4.0620 4.9451 4.9463 5.4596 5.4621 6.0974 6.1039 6.8941 6.8989 8.4428 8.4493 9.0582 9.0611 10.4579 10.4679 11.0421 11.0453 11.6528 11.6564 12.1372 12.1385 13.0147 13.0226 13.2918 13.2989 13.6225 13.6290 14.2700 14.2739 15.3885 15.3897 17.3657 17.3701 19.6667 19.6677 21.2416 21.2453 k = 0.0000 0.1972 0.0948 ( 2474 PWs) bands (ev): -12.6616 -12.6613 -10.8514 -10.8510 -9.6041 -9.6020 -6.1555 -6.1543 -4.2834 -4.2821 -2.8788 -2.8785 0.8369 0.8404 1.9680 1.9781 2.7428 2.7457 3.5045 3.5135 4.0628 4.0668 4.9526 4.9538 5.4389 5.4416 6.0802 6.0863 6.9186 6.9230 8.4593 8.4653 9.0375 9.0409 10.4568 10.4669 11.0510 11.0541 11.6764 11.6801 12.1411 12.1423 13.0285 13.0365 13.2721 13.2792 13.6464 13.6529 14.2518 14.2558 15.3720 15.3731 17.3695 17.3741 19.6959 19.6969 21.2006 21.2043 k = 0.0000 0.2051 0.0986 ( 2470 PWs) bands (ev): -12.6306 -12.6303 -10.8459 -10.8454 -9.6317 -9.6296 -6.1597 -6.1585 -4.2769 -4.2756 -2.9142 -2.9139 0.8144 0.8178 1.9842 1.9943 2.7426 2.7456 3.5090 3.5179 4.0681 4.0719 4.9580 4.9594 5.4196 5.4225 6.0629 6.0686 6.9445 6.9485 8.4713 8.4768 9.0194 9.0234 10.4549 10.4649 11.0599 11.0628 11.7014 11.7052 12.1454 12.1467 13.0401 13.0481 13.2530 13.2602 13.6721 13.6784 14.2324 14.2365 15.3566 15.3576 17.3738 17.3784 19.7251 19.7262 21.1571 21.1608 k = 0.0000 0.2129 0.1023 ( 2471 PWs) bands (ev): -12.5989 -12.5986 -10.8408 -10.8403 -9.6599 -9.6577 -6.1642 -6.1630 -4.2690 -4.2677 -2.9501 -2.9498 0.7900 0.7933 2.0018 2.0119 2.7421 2.7452 3.5145 3.5234 4.0738 4.0774 4.9613 4.9631 5.4016 5.4049 6.0456 6.0509 6.9719 6.9755 8.4779 8.4826 9.0047 9.0093 10.4523 10.4622 11.0687 11.0715 11.7278 11.7318 12.1501 12.1515 13.0486 13.0566 13.2352 13.2425 13.6989 13.7050 14.2122 14.2165 15.3424 15.3434 17.3784 17.3830 19.7543 19.7554 21.1113 21.1149 k = 0.0000 0.2208 0.1061 ( 2471 PWs) bands (ev): -12.5663 -12.5660 -10.8362 -10.8357 -9.6884 -9.6862 -6.1690 -6.1678 -4.2596 -4.2583 -2.9864 -2.9861 0.7640 0.7672 2.0203 2.0304 2.7416 2.7446 3.5213 3.5301 4.0798 4.0832 4.9628 4.9650 5.3849 5.3886 6.0283 6.0332 7.0007 7.0041 8.4783 8.4824 8.9938 8.9991 10.4491 10.4589 11.0775 11.0801 11.7558 11.7599 12.1554 12.1569 13.0530 13.0610 13.2197 13.2270 13.7262 13.7321 14.1917 14.1961 15.3295 15.3305 17.3831 17.3878 19.7832 19.7844 21.0632 21.0667 k = 0.0000 0.2287 0.1099 ( 2471 PWs) bands (ev): -12.5330 -12.5328 -10.8323 -10.8318 -9.7170 -9.7149 -6.1741 -6.1729 -4.2488 -4.2474 -3.0229 -3.0226 0.7366 0.7397 2.0396 2.0497 2.7409 2.7439 3.5293 3.5380 4.0860 4.0893 4.9625 4.9652 5.3691 5.3733 6.0109 6.0156 7.0311 7.0341 8.4722 8.4756 8.9871 8.9931 10.4454 10.4551 11.0862 11.0886 11.7853 11.7896 12.1612 12.1629 13.0524 13.0602 13.2074 13.2148 13.7531 13.7588 14.1717 14.1760 15.3179 15.3189 17.3881 17.3927 19.8117 19.8129 21.0133 21.0166 k = 0.0000 0.2366 0.1137 ( 2473 PWs) bands (ev): -12.4991 -12.4988 -10.8292 -10.8286 -9.7458 -9.7436 -6.1795 -6.1783 -4.2365 -4.2351 -3.0596 -3.0592 0.7079 0.7109 2.0593 2.0693 2.7402 2.7431 3.5387 3.5474 4.0926 4.0957 4.9608 4.9639 5.3542 5.3588 5.9937 5.9980 7.0628 7.0655 8.4595 8.4624 8.9845 8.9912 10.4412 10.4508 11.0948 11.0970 11.8161 11.8206 12.1676 12.1694 13.0463 13.0538 13.1992 13.2064 13.7783 13.7838 14.1529 14.1573 15.3077 15.3088 17.3931 17.3977 19.8396 19.8408 20.9617 20.9648 k = 0.0000 0.2445 0.1175 ( 2473 PWs) bands (ev): -12.4646 -12.4643 -10.8269 -10.8263 -9.7744 -9.7722 -6.1851 -6.1840 -4.2227 -4.2213 -3.0963 -3.0959 0.6781 0.6811 2.0791 2.0889 2.7397 2.7425 3.5496 3.5583 4.0994 4.1023 4.9576 4.9612 5.3399 5.3450 5.9766 5.9806 7.0959 7.0983 8.4409 8.4434 8.9857 8.9930 10.4366 10.4460 11.1033 11.1054 11.8483 11.8530 12.1747 12.1767 13.0348 13.0417 13.1950 13.2018 13.8005 13.8057 14.1369 14.1411 15.2991 15.3002 17.3982 17.4028 19.8666 19.8679 20.9090 20.9118 k = 0.0000 0.2524 0.1213 ( 2476 PWs) bands (ev): -12.4295 -12.4292 -10.8257 -10.8250 -9.8027 -9.8005 -6.1910 -6.1899 -4.2076 -4.2062 -3.1329 -3.1324 0.6475 0.6503 2.0986 2.1082 2.7393 2.7419 3.5622 3.5708 4.1064 4.1092 4.9531 4.9572 5.3261 5.3317 5.9597 5.9634 7.1300 7.1323 8.4172 8.4193 8.9901 8.9977 10.4316 10.4408 11.1117 11.1137 11.8818 11.8865 12.1824 12.1846 13.0188 13.0251 13.1939 13.2004 13.8179 13.8226 14.1251 14.1290 15.2920 15.2932 17.4032 17.4077 19.8924 19.8937 20.8556 20.8581 k = 0.0000 0.2603 0.1251 ( 2474 PWs) bands (ev): -12.3940 -12.3938 -10.8255 -10.8249 -9.8305 -9.8284 -6.1971 -6.1960 -4.1913 -4.1899 -3.1692 -3.1688 0.6162 0.6190 2.1175 2.1269 2.7392 2.7417 3.5766 3.5852 4.1136 4.1163 4.9472 4.9517 5.3129 5.3189 5.9431 5.9465 7.1652 7.1671 8.3892 8.3912 8.9970 9.0048 10.4261 10.4350 11.1200 11.1218 11.9162 11.9212 12.1908 12.1933 12.9994 13.0051 13.1949 13.2011 13.8287 13.8328 14.1191 14.1225 15.2866 15.2879 17.4081 17.4125 19.9167 19.9181 20.8023 20.8045 k = 0.0000 0.2682 0.1289 ( 2470 PWs) bands (ev): -12.3582 -12.3579 -10.8266 -10.8259 -9.8577 -9.8556 -6.2033 -6.2022 -4.1737 -4.1723 -3.2052 -3.2047 0.5845 0.5872 2.1356 2.1447 2.7396 2.7419 3.5929 3.6016 4.1210 4.1236 4.9397 4.9446 5.3003 5.3066 5.9267 5.9299 7.2010 7.2027 8.3581 8.3599 9.0057 9.0137 10.4200 10.4287 11.1281 11.1298 11.9515 11.9566 12.1999 12.2027 12.9775 12.9829 13.1971 13.2030 13.8317 13.8351 14.1200 14.1228 15.2828 15.2842 17.4128 17.4172 19.9390 19.9404 20.7498 20.7517 k = 0.0000 0.2760 0.1327 ( 2464 PWs) bands (ev): -12.3222 -12.3219 -10.8290 -10.8283 -9.8840 -9.8820 -6.2095 -6.2085 -4.1551 -4.1537 -3.2407 -3.2402 0.5527 0.5552 2.1525 2.1612 2.7405 2.7425 3.6114 3.6201 4.1285 4.1311 4.9304 4.9355 5.2885 5.2951 5.9107 5.9136 7.2373 7.2388 8.3247 8.3264 9.0157 9.0238 10.4132 10.4217 11.1361 11.1377 11.9873 11.9926 12.2099 12.2131 12.9541 12.9590 13.1999 13.2055 13.8269 13.8296 14.1276 14.1296 15.2808 15.2821 17.4173 17.4215 19.9588 19.9602 20.6990 20.7006 k = 0.0000 0.2839 0.1365 ( 2466 PWs) bands (ev): -12.2860 -12.2858 -10.8328 -10.8320 -9.9093 -9.9073 -6.2159 -6.2149 -4.1355 -4.1341 -3.2757 -3.2752 0.5208 0.5232 2.1679 2.1762 2.7419 2.7437 3.6321 3.6409 4.1362 4.1387 4.9188 4.9242 5.2777 5.2844 5.8951 5.8978 7.2737 7.2750 8.2897 8.2914 9.0266 9.0346 10.4058 10.4140 11.1438 11.1453 12.0234 12.0289 12.2207 12.2244 12.9296 12.9342 13.2027 13.2083 13.8155 13.8177 14.1403 14.1416 15.2803 15.2817 17.4215 17.4256 19.9754 19.9768 20.6510 20.6523 k = 0.0000 0.2918 0.1402 ( 2466 PWs) bands (ev): -12.2499 -12.2496 -10.8380 -10.8373 -9.9334 -9.9315 -6.2222 -6.2212 -4.1151 -4.1137 -3.3101 -3.3095 0.4892 0.4915 2.1818 2.1895 2.7439 2.7456 3.6552 3.6640 4.1439 4.1464 4.9048 4.9103 5.2681 5.2748 5.8800 5.8825 7.3099 7.3110 8.2541 8.2557 9.0380 9.0460 10.3977 10.4056 11.1513 11.1526 12.0594 12.0651 12.2326 12.2369 12.9044 12.9088 13.2055 13.2109 13.7992 13.8013 14.1563 14.1572 15.2816 15.2830 17.4253 17.4292 19.9879 19.9895 20.6070 20.6081 k = 0.0000 0.2997 0.1440 ( 2468 PWs) bands (ev): -12.2140 -12.2137 -10.8448 -10.8440 -9.9562 -9.9543 -6.2284 -6.2275 -4.0939 -4.0925 -3.3437 -3.3430 0.4581 0.4603 2.1939 2.2011 2.7465 2.7481 3.6806 3.6895 4.1517 4.1542 4.8879 4.8935 5.2600 5.2666 5.8654 5.8677 7.3456 7.3465 8.2184 8.2199 9.0498 9.0576 10.3888 10.3964 11.1585 11.1597 12.0947 12.1007 12.2456 12.2506 12.8788 12.8830 13.2080 13.2133 13.7798 13.7819 14.1739 14.1746 15.2844 15.2858 17.4288 17.4326 19.9956 19.9972 20.5680 20.5692 k = 0.0000 0.3076 0.1478 ( 2465 PWs) bands (ev): -12.1784 -12.1781 -10.8530 -10.8523 -9.9774 -9.9755 -6.2345 -6.2337 -4.0722 -4.0708 -3.3764 -3.3757 0.4278 0.4298 2.2042 2.2109 2.7498 2.7512 3.7084 3.7173 4.1595 4.1620 4.8680 4.8735 5.2535 5.2598 5.8515 5.8536 7.3805 7.3811 8.1832 8.1847 9.0617 9.0693 10.3793 10.3865 11.1653 11.1665 12.1290 12.1352 12.2601 12.2659 12.8530 12.8570 13.2101 13.2153 13.7587 13.7609 14.1919 14.1926 15.2886 15.2900 17.4319 17.4355 19.9976 19.9993 20.5355 20.5368 k = 0.0000 0.3155 0.1516 ( 2461 PWs) bands (ev): -12.1434 -12.1431 -10.8626 -10.8619 -9.9970 -9.9952 -6.2404 -6.2396 -4.0500 -4.0486 -3.4083 -3.4076 0.3985 0.4004 2.2127 2.2188 2.7535 2.7549 3.7386 3.7475 4.1672 4.1698 4.8448 4.8503 5.2486 5.2546 5.8382 5.8402 7.4142 7.4146 8.1490 8.1504 9.0736 9.0809 10.3692 10.3760 11.1719 11.1729 12.1615 12.1680 12.2763 12.2829 12.8273 12.8311 13.2117 13.2169 13.7370 13.7393 14.2094 14.2101 15.2941 15.2955 17.4347 17.4381 19.9934 19.9952 20.5101 20.5117 k = 0.0000 0.3234 0.1554 ( 2458 PWs) bands (ev): -12.1091 -12.1089 -10.8736 -10.8729 -10.0148 -10.0132 -6.2460 -6.2453 -4.0275 -4.0261 -3.4392 -3.4385 0.3704 0.3722 2.2195 2.2250 2.7577 2.7591 3.7709 3.7798 4.1750 4.1776 4.8185 4.8239 5.2452 5.2509 5.8257 5.8275 7.4463 7.4466 8.1164 8.1177 9.0855 9.0924 10.3585 10.3650 11.1780 11.1790 12.1915 12.1982 12.2946 12.3021 12.8017 12.8055 13.2129 13.2180 13.7154 13.7177 14.2258 14.2266 15.3007 15.3020 17.4371 17.4403 19.9832 19.9850 20.4923 20.4941 k = 0.0000 0.3312 0.1592 ( 2454 PWs) bands (ev): -12.0759 -12.0757 -10.8856 -10.8850 -10.0309 -10.0294 -6.2514 -6.2507 -4.0049 -4.0035 -3.4691 -3.4683 0.3438 0.3454 2.2248 2.2297 2.7621 2.7635 3.8051 3.8140 4.1828 4.1855 4.7891 4.7943 5.2433 5.2485 5.8139 5.8156 7.4765 7.4767 8.0856 8.0868 9.0971 9.1037 10.3475 10.3536 11.1838 11.1846 12.2187 12.2254 12.3152 12.3233 12.7765 12.7801 13.2134 13.2185 13.6944 13.6968 14.2409 14.2417 15.3081 15.3094 17.4392 17.4422 19.9677 19.9695 20.4817 20.4836 k = 0.0000 0.3391 0.1630 ( 2452 PWs) bands (ev): -12.0440 -12.0438 -10.8985 -10.8979 -10.0453 -10.0439 -6.2564 -6.2558 -3.9822 -3.9808 -3.4980 -3.4972 0.3189 0.3204 2.2287 2.2330 2.7667 2.7681 3.8409 3.8498 4.1906 4.1934 4.7569 4.7620 5.2426 5.2472 5.8031 5.8046 7.5044 7.5046 8.0571 8.0583 9.1084 9.1145 10.3363 10.3420 11.1891 11.1898 12.2429 12.2494 12.3380 12.3463 12.7518 12.7554 13.2135 13.2184 13.6746 13.6770 14.2544 14.2553 15.3161 15.3173 17.4410 17.4437 19.9482 19.9499 20.4771 20.4791 k = 0.0000 0.3470 0.1668 ( 2452 PWs) bands (ev): -12.0138 -12.0136 -10.9119 -10.9114 -10.0579 -10.0566 -6.2610 -6.2605 -3.9596 -3.9583 -3.5257 -3.5248 0.2959 0.2973 2.2315 2.2352 2.7713 2.7727 3.8779 3.8867 4.1987 4.2016 4.7222 4.7271 5.2428 5.2469 5.7933 5.7946 7.5297 7.5301 8.0312 8.0323 9.1192 9.1249 10.3252 10.3304 11.1939 11.1946 12.2643 12.2703 12.3620 12.3704 12.7277 12.7313 13.2130 13.2177 13.6562 13.6586 14.2664 14.2672 15.3243 15.3254 17.4425 17.4450 19.9263 19.9279 20.4772 20.4792 k = 0.0000 0.3549 0.1706 ( 2459 PWs) bands (ev): -11.9856 -11.9854 -10.9255 -10.9250 -10.0687 -10.0676 -6.2652 -6.2647 -3.9374 -3.9361 -3.5522 -3.5513 0.2751 0.2763 2.2333 2.2365 2.7757 2.7771 3.9154 3.9240 4.2071 4.2101 4.6854 4.6902 5.2437 5.2473 5.7844 5.7855 7.5523 7.5527 8.0082 8.0092 9.1295 9.1346 10.3145 10.3191 11.1982 11.1988 12.2835 12.2889 12.3863 12.3944 12.7046 12.7082 13.2121 13.2165 13.6396 13.6418 14.2766 14.2774 15.3325 15.3334 17.4437 17.4459 19.9035 19.9050 20.4807 20.4826 k = 0.0000 0.3628 0.1744 ( 2463 PWs) bands (ev): -11.9598 -11.9597 -10.9387 -10.9383 -10.0779 -10.0770 -6.2689 -6.2685 -3.9157 -3.9145 -3.5774 -3.5765 0.2567 0.2577 2.2344 2.2371 2.7799 2.7811 3.9526 3.9608 4.2163 4.2194 4.6472 4.6518 5.2450 5.2480 5.7766 5.7776 7.5719 7.5724 7.9882 7.9892 9.1389 9.1435 10.3044 10.3085 11.2020 11.2025 12.3007 12.3055 12.4097 12.4176 12.6826 12.6862 13.2109 13.2149 13.6249 13.6270 14.2853 14.2860 15.3403 15.3411 17.4448 17.4467 19.8813 19.8826 20.4861 20.4879 k = 0.0000 0.3707 0.1782 ( 2467 PWs) bands (ev): -11.9370 -11.9368 -10.9511 -10.9507 -10.0855 -10.0847 -6.2721 -6.2717 -3.8948 -3.8936 -3.6011 -3.6002 0.2407 0.2416 2.2349 2.2371 2.7836 2.7847 3.9883 3.9960 4.2268 4.2299 4.6082 4.6126 5.2465 5.2490 5.7699 5.7707 7.5884 7.5890 7.9715 7.9723 9.1475 9.1513 10.2952 10.2987 11.2052 11.2057 12.3162 12.3204 12.4314 12.4389 12.6620 12.6658 13.2095 13.2131 13.6124 13.6143 14.2924 14.2930 15.3475 15.3482 17.4456 17.4472 19.8609 19.8619 20.4925 20.4941 k = 0.0000 0.3786 0.1819 ( 2466 PWs) bands (ev): -11.9174 -11.9172 -10.9622 -10.9619 -10.0916 -10.0910 -6.2747 -6.2745 -3.8751 -3.8740 -3.6229 -3.6220 0.2275 0.2282 2.2352 2.2369 2.7868 2.7877 4.0210 4.0279 4.2393 4.2422 4.5693 4.5734 5.2480 5.2500 5.7644 5.7650 7.6018 7.6023 7.9580 7.9587 9.1549 9.1580 10.2873 10.2902 11.2079 11.2083 12.3299 12.3334 12.4508 12.4578 12.6434 12.6472 13.2080 13.2111 13.6021 13.6037 14.2981 14.2986 15.3538 15.3543 17.4463 17.4476 19.8430 19.8439 20.4990 20.5003 k = 0.0000 0.3865 0.1857 ( 2470 PWs) bands (ev): -11.9016 -11.9015 -10.9715 -10.9713 -10.0962 -10.0958 -6.2768 -6.2766 -3.8573 -3.8563 -3.6422 -3.6414 0.2171 0.2176 2.2353 2.2366 2.7894 2.7902 4.0488 4.0545 4.2540 4.2566 4.5321 4.5358 5.2495 5.2510 5.7601 5.7606 7.6121 7.6125 7.9477 7.9482 9.1609 9.1633 10.2809 10.2831 11.2101 11.2103 12.3415 12.3443 12.4672 12.4734 12.6274 12.6310 13.2067 13.2091 13.5941 13.5954 14.3024 14.3028 15.3589 15.3594 17.4468 17.4478 19.8285 19.8292 20.5048 20.5058 k = 0.0000 0.3943 0.1895 ( 2470 PWs) bands (ev): -11.8899 -11.8899 -10.9785 -10.9783 -10.0995 -10.0992 -6.2783 -6.2781 -3.8424 -3.8416 -3.6580 -3.6574 0.2096 0.2099 2.2353 2.2361 2.7914 2.7919 4.0701 4.0741 4.2704 4.2723 4.4992 4.5021 5.2506 5.2516 5.7570 5.7573 7.6193 7.6196 7.9405 7.9409 9.1655 9.1671 10.2763 10.2777 11.2116 11.2118 12.3506 12.3525 12.4803 12.4851 12.6150 12.6179 13.2058 13.2074 13.5884 13.5893 14.3055 14.3058 15.3628 15.3631 17.4472 17.4479 19.8178 19.8183 20.5094 20.5101 k = 0.0000 0.4022 0.1933 ( 2472 PWs) bands (ev): -11.8828 -11.8828 -10.9828 -10.9828 -10.1014 -10.1012 -6.2792 -6.2791 -3.8321 -3.8317 -3.6687 -3.6683 0.2051 0.2052 2.2353 2.2358 2.7926 2.7929 4.0836 4.0856 4.2849 4.2861 4.4750 4.4768 5.2515 5.2520 5.7551 5.7553 7.6236 7.6238 7.9363 7.9365 9.1685 9.1693 10.2735 10.2743 11.2125 11.2126 12.3565 12.3575 12.4893 12.4920 12.6072 12.6089 13.2053 13.2062 13.5851 13.5856 14.3073 14.3075 15.3652 15.3653 17.4475 17.4479 19.8113 19.8116 20.5124 20.5127 k = 0.0000 0.4101 0.1971 ( 2468 PWs) bands (ev): -11.8804 -11.8804 -10.9843 -10.9843 -10.1019 -10.1019 -6.2794 -6.2794 -3.8282 -3.8282 -3.6724 -3.6724 0.2036 0.2036 2.2355 2.2355 2.7931 2.7931 4.0888 4.0888 4.2916 4.2916 4.4663 4.4663 5.2519 5.2519 5.7546 5.7546 7.6251 7.6251 7.9350 7.9350 9.1698 9.1698 10.2729 10.2729 11.2129 11.2129 12.3589 12.3589 12.4934 12.4934 12.6051 12.6051 13.2055 13.2055 13.5842 13.5842 14.3080 14.3080 15.3660 15.3660 17.4478 17.4478 19.8092 19.8092 20.5135 20.5135 k = 0.5000 0.4101 0.1971 ( 2464 PWs) bands (ev): -11.0315 -11.0315 -10.0903 -10.0903 -9.6967 -9.6967 -5.8007 -5.8007 -3.1924 -3.1924 -3.0300 -3.0300 -1.2809 -1.2809 0.8276 0.8276 1.2815 1.2815 2.5588 2.5588 3.9157 3.9157 4.2917 4.2917 4.7402 4.7402 5.2598 5.2598 7.3674 7.3674 7.8209 7.8209 8.2960 8.2960 8.8306 8.8306 9.7171 9.7171 10.1989 10.1989 10.4725 10.4725 13.3023 13.3023 13.6888 13.6888 14.0246 14.0246 15.9048 15.9048 16.7969 16.7969 18.8247 18.8247 20.1255 20.1255 21.0192 21.0192 k = 0.4935 0.4048 0.1945 ( 2468 PWs) bands (ev): -11.0322 -11.0322 -10.0913 -10.0911 -9.6968 -9.6964 -5.8007 -5.8006 -3.1928 -3.1928 -3.0302 -3.0302 -1.2794 -1.2792 0.8277 0.8278 1.2819 1.2821 2.5588 2.5593 3.9140 3.9144 4.2920 4.2927 4.7416 4.7422 5.2611 5.2612 7.3658 7.3661 7.8215 7.8218 8.2958 8.2961 8.8323 8.8325 9.7151 9.7163 10.1996 10.2014 10.4732 10.4749 13.3013 13.3019 13.6881 13.6887 14.0241 14.0250 15.9045 15.9048 16.7966 16.7969 18.8239 18.8243 20.1237 20.1243 21.0196 21.0201 k = 0.4870 0.3995 0.1920 ( 2464 PWs) bands (ev): -11.0341 -11.0341 -10.0941 -10.0936 -9.6966 -9.6960 -5.8006 -5.8005 -3.1940 -3.1939 -3.0308 -3.0306 -1.2747 -1.2743 0.8282 0.8284 1.2833 1.2836 2.5593 2.5603 3.9092 3.9102 4.2936 4.2950 4.7465 4.7476 5.2650 5.2653 7.3615 7.3621 7.8235 7.8241 8.2957 8.2963 8.8375 8.8378 9.7104 9.7127 10.2031 10.2066 10.4774 10.4807 13.2989 13.3001 13.6869 13.6880 14.0235 14.0253 15.9038 15.9045 16.7960 16.7965 18.8219 18.8225 20.1192 20.1203 21.0212 21.0222 k = 0.4805 0.3941 0.1894 ( 2467 PWs) bands (ev): -11.0374 -11.0372 -10.0986 -10.0978 -9.6962 -9.6953 -5.8005 -5.8004 -3.1960 -3.1959 -3.0316 -3.0314 -1.2668 -1.2663 0.8290 0.8292 1.2856 1.2861 2.5604 2.5618 3.9017 3.9030 4.2965 4.2986 4.7547 4.7563 5.2714 5.2719 7.3546 7.3554 7.8268 7.8277 8.2956 8.2965 8.8460 8.8464 9.7037 9.7070 10.2085 10.2136 10.4852 10.4902 13.2950 13.2969 13.6851 13.6867 14.0227 14.0254 15.9027 15.9037 16.7950 16.7958 18.8186 18.8196 20.1120 20.1136 21.0239 21.0254 k = 0.4740 0.3888 0.1869 ( 2466 PWs) bands (ev): -11.0419 -11.0417 -10.1047 -10.1037 -9.6957 -9.6945 -5.8004 -5.8002 -3.1988 -3.1987 -3.0326 -3.0323 -1.2558 -1.2551 0.8301 0.8305 1.2889 1.2895 2.5620 2.5639 3.8914 3.8932 4.3005 4.3032 4.7661 4.7683 5.2803 5.2810 7.3454 7.3464 7.8313 7.8324 8.2955 8.2967 8.8577 8.8581 9.6959 9.7000 10.2144 10.2210 10.4974 10.5039 13.2895 13.2921 13.6829 13.6850 14.0218 14.0253 15.9013 15.9026 16.7936 16.7947 18.8141 18.8154 20.1023 20.1044 21.0275 21.0295 k = 0.4675 0.3835 0.1843 ( 2463 PWs) bands (ev): -11.0478 -11.0476 -10.1122 -10.1110 -9.6950 -9.6935 -5.8002 -5.8000 -3.2027 -3.2026 -3.0337 -3.0333 -1.2416 -1.2408 0.8316 0.8320 1.2931 1.2939 2.5644 2.5667 3.8786 3.8807 4.3057 4.3090 4.7807 4.7834 5.2915 5.2923 7.3342 7.3354 7.8368 7.8381 8.2956 8.2971 8.8721 8.8727 9.6880 9.6929 10.2197 10.2274 10.5145 10.5223 13.2826 13.2858 13.6803 13.6829 14.0207 14.0250 15.8994 15.9010 16.7918 16.7932 18.8084 18.8101 20.0905 20.0929 21.0318 21.0342 k = 0.4610 0.3782 0.1817 ( 2466 PWs) bands (ev): -11.0552 -11.0549 -10.1212 -10.1198 -9.6943 -9.6925 -5.8000 -5.7998 -3.2077 -3.2075 -3.0347 -3.0342 -1.2244 -1.2234 0.8334 0.8339 1.2983 1.2993 2.5676 2.5703 3.8635 3.8660 4.3119 4.3156 4.7983 4.8014 5.3047 5.3057 7.3214 7.3227 7.8430 7.8445 8.2959 8.2977 8.8890 8.8896 9.6810 9.6864 10.2231 10.2318 10.5367 10.5457 13.2740 13.2778 13.6777 13.6807 14.0193 14.0243 15.8970 15.8990 16.7896 16.7912 18.8015 18.8035 20.0766 20.0795 21.0364 21.0392 k = 0.4545 0.3728 0.1792 ( 2464 PWs) bands (ev): -11.0639 -11.0636 -10.1313 -10.1298 -9.6935 -9.6915 -5.7998 -5.7996 -3.2138 -3.2136 -3.0355 -3.0350 -1.2042 -1.2030 0.8355 0.8362 1.3045 1.3056 2.5716 2.5747 3.8464 3.8491 4.3189 4.3232 4.8186 4.8222 5.3198 5.3210 7.3074 7.3088 7.8499 7.8515 8.2965 8.2985 8.9080 8.9086 9.6757 9.6816 10.2242 10.2335 10.5639 10.5738 13.2637 13.2681 13.6751 13.6785 14.0177 14.0233 15.8941 15.8964 16.7869 16.7888 18.7935 18.7957 20.0612 20.0643 21.0412 21.0442 k = 0.4481 0.3675 0.1766 ( 2465 PWs) bands (ev): -11.0742 -11.0738 -10.1426 -10.1409 -9.6926 -9.6904 -5.7996 -5.7993 -3.2213 -3.2211 -3.0360 -3.0354 -1.1811 -1.1797 0.8381 0.8388 1.3115 1.3128 2.5767 2.5802 3.8276 3.8305 4.3268 4.3314 4.8415 4.8455 5.3365 5.3378 7.2925 7.2940 7.8573 7.8589 8.2973 8.2997 8.9285 8.9291 9.6729 9.6792 10.2228 10.2325 10.5958 10.6063 13.2517 13.2567 13.6728 13.6764 14.0157 14.0219 15.8906 15.8932 16.7837 16.7859 18.7843 18.7868 20.0445 20.0479 21.0457 21.0490 k = 0.4416 0.3622 0.1741 ( 2469 PWs) bands (ev): -11.0860 -11.0856 -10.1547 -10.1529 -9.6918 -9.6894 -5.7994 -5.7991 -3.2302 -3.2299 -3.0361 -3.0355 -1.1550 -1.1535 0.8409 0.8418 1.3196 1.3210 2.5828 2.5867 3.8071 3.8102 4.3353 4.3403 4.8668 4.8712 5.3545 5.3560 7.2771 7.2786 7.8651 7.8668 8.2986 8.3012 8.9501 8.9507 9.6732 9.6799 10.2190 10.2289 10.6316 10.6425 13.2378 13.2434 13.6708 13.6748 14.0133 14.0201 15.8863 15.8893 16.7800 16.7824 18.7740 18.7768 20.0267 20.0304 21.0498 21.0532 k = 0.4351 0.3569 0.1715 ( 2470 PWs) bands (ev): -11.0994 -11.0990 -10.1675 -10.1656 -9.6910 -9.6885 -5.7993 -5.7989 -3.2405 -3.2402 -3.0357 -3.0350 -1.1262 -1.1245 0.8442 0.8451 1.3285 1.3301 2.5902 2.5945 3.7853 3.7886 4.3444 4.3496 4.8941 4.8989 5.3736 5.3753 7.2614 7.2629 7.8734 7.8751 8.3004 8.3033 8.9723 8.9730 9.6769 9.6839 10.2132 10.2232 10.6707 10.6819 13.2222 13.2283 13.6694 13.6736 14.0106 14.0178 15.8814 15.8846 16.7756 16.7783 18.7627 18.7658 20.0083 20.0120 21.0531 21.0567 k = 0.4286 0.3515 0.1689 ( 2467 PWs) bands (ev): -11.1146 -11.1140 -10.1809 -10.1790 -9.6903 -9.6876 -5.7991 -5.7987 -3.2523 -3.2519 -3.0347 -3.0339 -1.0947 -1.0929 0.8479 0.8489 1.3384 1.3401 2.5989 2.6035 3.7624 3.7658 4.3539 4.3594 4.9233 4.9285 5.3935 5.3954 7.2458 7.2473 7.8821 7.8838 8.3028 8.3060 8.9949 8.9955 9.6843 9.6916 10.2059 10.2159 10.7124 10.7238 13.2048 13.2114 13.6685 13.6731 14.0074 14.0150 15.8756 15.8792 16.7707 16.7736 18.7505 18.7538 19.9893 19.9932 21.0556 21.0592 k = 0.4221 0.3462 0.1664 ( 2470 PWs) bands (ev): -11.1314 -11.1308 -10.1948 -10.1928 -9.6896 -9.6868 -5.7990 -5.7985 -3.2655 -3.2651 -3.0332 -3.0323 -1.0605 -1.0586 0.8519 0.8531 1.3492 1.3511 2.6090 2.6139 3.7385 3.7421 4.3637 4.3695 4.9541 4.9597 5.4140 5.4161 7.2304 7.2319 7.8912 7.8930 8.3060 8.3094 9.0174 9.0181 9.6954 9.7029 10.1976 10.2075 10.7562 10.7677 13.1856 13.1927 13.6683 13.6732 14.0039 14.0118 15.8689 15.8727 16.7651 16.7683 18.7373 18.7408 19.9701 19.9740 21.0569 21.0606 k = 0.4156 0.3409 0.1638 ( 2470 PWs) bands (ev): -11.1500 -11.1494 -10.2089 -10.2068 -9.6889 -9.6860 -5.7990 -5.7985 -3.2801 -3.2797 -3.0310 -3.0300 -1.0239 -1.0218 0.8565 0.8577 1.3609 1.3630 2.6206 2.6258 3.7139 3.7176 4.3737 4.3797 4.9863 4.9922 5.4348 5.4370 7.2155 7.2171 7.9009 7.9028 8.3100 8.3137 9.0396 9.0405 9.7098 9.7175 10.1889 10.1987 10.8015 10.8130 13.1647 13.1723 13.6688 13.6739 13.9999 14.0081 15.8612 15.8653 16.7588 16.7623 18.7232 18.7269 19.9507 19.9547 21.0571 21.0607 k = 0.4091 0.3355 0.1613 ( 2470 PWs) bands (ev): -11.1704 -11.1698 -10.2232 -10.2211 -9.6883 -9.6853 -5.7990 -5.7984 -3.2962 -3.2957 -3.0282 -3.0272 -0.9848 -0.9825 0.8615 0.8629 1.3736 1.3758 2.6337 2.6392 3.6888 3.6926 4.3838 4.3901 5.0194 5.0257 5.4556 5.4581 7.2012 7.2030 7.9113 7.9134 8.3151 8.3189 9.0615 9.0625 9.7271 9.7351 10.1805 10.1902 10.8480 10.8595 13.1422 13.1501 13.6699 13.6754 13.9956 14.0040 15.8525 15.8569 16.7518 16.7555 18.7083 18.7122 19.9314 19.9354 21.0561 21.0597 k = 0.4026 0.3302 0.1587 ( 2467 PWs) bands (ev): -11.1927 -11.1920 -10.2376 -10.2354 -9.6877 -9.6846 -5.7991 -5.7985 -3.3135 -3.3129 -3.0248 -3.0238 -0.9434 -0.9410 0.8670 0.8685 1.3873 1.3897 2.6484 2.6541 3.6632 3.6671 4.3940 4.4004 5.0534 5.0600 5.4763 5.4789 7.1879 7.1898 7.9224 7.9247 8.3212 8.3253 9.0829 9.0841 9.7464 9.7547 10.1733 10.1827 10.8953 10.9068 13.1181 13.1263 13.6716 13.6775 13.9910 13.9995 15.8427 15.8473 16.7441 16.7481 18.6925 18.6966 19.9123 19.9162 21.0538 21.0574 k = 0.3961 0.3249 0.1561 ( 2471 PWs) bands (ev): -11.2168 -11.2160 -10.2519 -10.2498 -9.6870 -9.6839 -5.7993 -5.7987 -3.3320 -3.3314 -3.0209 -3.0198 -0.8998 -0.8973 0.8730 0.8747 1.4019 1.4045 2.6645 2.6704 3.6373 3.6413 4.4041 4.4107 5.0878 5.0948 5.4967 5.4994 7.1755 7.1776 7.9343 7.9368 8.3285 8.3328 9.1039 9.1053 9.7667 9.7753 10.1681 10.1773 10.9431 10.9545 13.0925 13.1011 13.6739 13.6801 13.9860 13.9947 15.8316 15.8365 16.7357 16.7399 18.6760 18.6803 19.8933 19.8973 21.0503 21.0538 k = 0.3896 0.3196 0.1536 ( 2474 PWs) bands (ev): -11.2427 -11.2419 -10.2661 -10.2640 -9.6863 -9.6831 -5.7997 -5.7990 -3.3517 -3.3510 -3.0164 -3.0153 -0.8541 -0.8515 0.8797 0.8814 1.4176 1.4202 2.6820 2.6881 3.6113 3.6155 4.4141 4.4208 5.1225 5.1298 5.5164 5.5194 7.1643 7.1667 7.9472 7.9500 8.3373 8.3417 9.1246 9.1261 9.7866 9.7956 10.1663 10.1751 10.9912 11.0027 13.0656 13.0744 13.6765 13.6831 13.9809 13.9896 15.8193 15.8244 16.7266 16.7311 18.6588 18.6632 19.8747 19.8786 21.0458 21.0491 k = 0.3831 0.3142 0.1510 ( 2468 PWs) bands (ev): -11.2704 -11.2695 -10.2802 -10.2781 -9.6855 -9.6822 -5.8002 -5.7995 -3.3724 -3.3717 -3.0114 -3.0103 -0.8065 -0.8037 0.8870 0.8889 1.4342 1.4370 2.7009 2.7072 3.5854 3.5897 4.4239 4.4308 5.1571 5.1649 5.5355 5.5386 7.1545 7.1571 7.9611 7.9642 8.3475 8.3521 9.1450 9.1467 9.8049 9.8141 10.1690 10.1773 11.0396 11.0509 13.0375 13.0465 13.6795 13.6865 13.9757 13.9844 15.8057 15.8110 16.7168 16.7215 18.6410 18.6454 19.8565 19.8603 21.0403 21.0435 k = 0.3766 0.3089 0.1485 ( 2471 PWs) bands (ev): -11.2998 -11.2990 -10.2941 -10.2920 -9.6845 -9.6812 -5.8008 -5.8001 -3.3941 -3.3934 -3.0059 -3.0048 -0.7569 -0.7541 0.8949 0.8969 1.4518 1.4547 2.7211 2.7275 3.5596 3.5641 4.4335 4.4405 5.1915 5.1996 5.5537 5.5569 7.1460 7.1489 7.9760 7.9794 8.3593 8.3641 9.1652 9.1670 9.8201 9.8296 10.1775 10.1852 11.0879 11.0992 13.0082 13.0173 13.6825 13.6900 13.9704 13.9791 15.7908 15.7963 16.7063 16.7112 18.6224 18.6269 19.8387 19.8424 21.0338 21.0369 k = 0.3701 0.3036 0.1459 ( 2473 PWs) bands (ev): -11.3309 -11.3301 -10.3078 -10.3057 -9.6833 -9.6800 -5.8016 -5.8008 -3.4167 -3.4159 -3.0000 -2.9988 -0.7057 -0.7027 0.9036 0.9057 1.4703 1.4735 2.7423 2.7489 3.5342 3.5388 4.4428 4.4499 5.2254 5.2338 5.5710 5.5743 7.1390 7.1422 7.9920 7.9957 8.3729 8.3778 9.1851 9.1871 9.8314 9.8412 10.1924 10.1994 11.1361 11.1473 12.9779 12.9872 13.6855 13.6935 13.9652 13.9739 15.7745 15.7801 16.6951 16.7002 18.6032 18.6078 19.8213 19.8250 21.0268 21.0297 k = 0.3636 0.2983 0.1433 ( 2468 PWs) bands (ev): -11.3637 -11.3628 -10.3213 -10.3193 -9.6819 -9.6785 -5.8026 -5.8018 -3.4400 -3.4392 -2.9936 -2.9924 -0.6527 -0.6497 0.9130 0.9153 1.4899 1.4932 2.7644 2.7711 3.5094 3.5141 4.4519 4.4591 5.2585 5.2673 5.5872 5.5906 7.1335 7.1370 8.0090 8.0131 8.3884 8.3934 9.2046 9.2067 9.8388 9.8488 10.2138 10.2201 11.1841 11.1952 12.9467 12.9560 13.6881 13.6966 13.9603 13.9689 15.7568 15.7626 16.6833 16.6886 18.5833 18.5879 19.8045 19.8082 21.0194 21.0222 k = 0.3571 0.2929 0.1408 ( 2468 PWs) bands (ev): -11.3980 -11.3971 -10.3347 -10.3327 -9.6802 -9.6767 -5.8038 -5.8029 -3.4641 -3.4633 -2.9868 -2.9855 -0.5983 -0.5952 0.9232 0.9256 1.5105 1.5139 2.7870 2.7938 3.4853 3.4902 4.4607 4.4679 5.2906 5.2998 5.6024 5.6059 7.1294 7.1333 8.0271 8.0315 8.4058 8.4109 9.2235 9.2258 9.8429 9.8530 10.2411 10.2468 11.2317 11.2428 12.9147 12.9240 13.6903 13.6993 13.9558 13.9642 15.7377 15.7437 16.6709 16.6764 18.5627 18.5674 19.7882 19.7919 21.0117 21.0144 k = 0.3506 0.2876 0.1382 ( 2465 PWs) bands (ev): -11.4337 -11.4328 -10.3480 -10.3460 -9.6781 -9.6746 -5.8052 -5.8043 -3.4889 -3.4880 -2.9795 -2.9782 -0.5424 -0.5392 0.9342 0.9367 1.5320 1.5356 2.8099 2.8167 3.4623 3.4674 4.4692 4.4765 5.3215 5.3311 5.6165 5.6201 7.1269 7.1310 8.0461 8.0508 8.4253 8.4305 9.2417 9.2440 9.8450 9.8550 10.2733 10.2784 11.2790 11.2900 12.8819 12.8912 13.6916 13.7012 13.9518 13.9601 15.7172 15.7233 16.6579 16.6636 18.5414 18.5462 19.7726 19.7763 21.0042 21.0067 k = 0.3442 0.2823 0.1357 ( 2466 PWs) bands (ev): -11.4707 -11.4698 -10.3611 -10.3592 -9.6756 -9.6721 -5.8068 -5.8059 -3.5141 -3.5132 -2.9718 -2.9705 -0.4852 -0.4820 0.9460 0.9487 1.5545 1.5582 2.8326 2.8394 3.4408 3.4460 4.4775 4.4849 5.3511 5.3610 5.6297 5.6332 7.1256 7.1301 8.0659 8.0709 8.4470 8.4522 9.2587 9.2611 9.8464 9.8562 10.3093 10.3139 11.3258 11.3367 12.8485 12.8578 13.6919 13.7020 13.9486 13.9567 15.6952 15.7015 16.6443 16.6503 18.5193 18.5241 19.7576 19.7613 20.9970 20.9994 k = 0.3377 0.2770 0.1331 ( 2469 PWs) bands (ev): -11.5090 -11.5081 -10.3742 -10.3724 -9.6726 -9.6692 -5.8087 -5.8077 -3.5399 -3.5389 -2.9637 -2.9623 -0.4269 -0.4235 0.9586 0.9614 1.5779 1.5818 2.8546 2.8614 3.4211 3.4264 4.4855 4.4930 5.3791 5.3893 5.6419 5.6454 7.1256 7.1303 8.0864 8.0917 8.4708 8.4762 9.2741 9.2765 9.8485 9.8580 10.3480 10.3522 11.3722 11.3829 12.8145 12.8238 13.6910 13.7016 13.9462 13.9541 15.6719 15.6782 16.6303 16.6363 18.4964 18.5012 19.7434 19.7472 20.9905 20.9928 k = 0.3312 0.2716 0.1305 ( 2468 PWs) bands (ev): -11.5484 -11.5475 -10.3873 -10.3855 -9.6692 -9.6658 -5.8108 -5.8098 -3.5660 -3.5650 -2.9551 -2.9537 -0.3674 -0.3640 0.9721 0.9750 1.6022 1.6063 2.8752 2.8819 3.4038 3.4092 4.4935 4.5009 5.4055 5.4158 5.6535 5.6568 7.1266 7.1316 8.1075 8.1131 8.4970 8.5023 9.2875 9.2900 9.8527 9.8618 10.3886 10.3925 11.4180 11.4285 12.7801 12.7893 13.6886 13.6996 13.9448 13.9525 15.6471 15.6535 16.6157 16.6220 18.4727 18.4775 19.7301 19.7341 20.9849 20.9871 k = 0.3247 0.2663 0.1280 ( 2473 PWs) bands (ev): -11.5888 -11.5878 -10.4005 -10.3987 -9.6653 -9.6618 -5.8132 -5.8121 -3.5924 -3.5914 -2.9461 -2.9447 -0.3070 -0.3035 0.9863 0.9894 1.6273 1.6316 2.8938 2.9003 3.3895 3.3949 4.5014 4.5088 5.4299 5.4404 5.6644 5.6676 7.1284 7.1336 8.1291 8.1349 8.5253 8.5307 9.2984 9.3010 9.8600 9.8685 10.4305 10.4340 11.4631 11.4736 12.7454 12.7544 13.6845 13.6959 13.9445 13.9520 15.6209 15.6274 16.6007 16.6071 18.4479 18.4527 19.7178 19.7219 20.9805 20.9825 k = 0.3182 0.2610 0.1254 ( 2472 PWs) bands (ev): -11.6300 -11.6291 -10.4137 -10.4120 -9.6608 -9.6574 -5.8159 -5.8148 -3.6191 -3.6180 -2.9367 -2.9353 -0.2456 -0.2422 1.0014 1.0045 1.6533 1.6577 2.9096 2.9158 3.3790 3.3843 4.5093 4.5167 5.4523 5.4630 5.6751 5.6780 7.1308 7.1361 8.1510 8.1570 8.5559 8.5612 9.3067 9.3093 9.8712 9.8790 10.4731 10.4765 11.5077 11.5180 12.7103 12.7192 13.6787 13.6904 13.9453 13.9524 15.5934 15.5999 16.5852 16.5917 18.4222 18.4270 19.7066 19.7109 20.9774 20.9795 k = 0.3117 0.2557 0.1229 ( 2472 PWs) bands (ev): -11.6720 -11.6711 -10.4270 -10.4253 -9.6558 -9.6523 -5.8188 -5.8177 -3.6459 -3.6448 -2.9268 -2.9254 -0.1835 -0.1800 1.0171 1.0204 1.6800 1.6847 2.9218 2.9275 3.3728 3.3779 4.5173 4.5246 5.4727 5.4834 5.6856 5.6882 7.1335 7.1390 8.1730 8.1792 8.5886 8.5938 9.3121 9.3148 9.8869 9.8940 10.5162 10.5193 11.5517 11.5618 12.6751 12.6838 13.6712 13.6830 13.9470 13.9539 15.5645 15.5711 16.5693 16.5760 18.3955 18.4003 19.6967 19.7012 20.9760 20.9780 k = 0.3052 0.2503 0.1203 ( 2468 PWs) bands (ev): -11.7146 -11.7137 -10.4405 -10.4388 -9.6501 -9.6467 -5.8221 -5.8210 -3.6727 -3.6716 -2.9166 -2.9151 -0.1208 -0.1172 1.0336 1.0370 1.7075 1.7123 2.9298 2.9349 3.3716 3.3765 4.5254 4.5328 5.4908 5.5015 5.6962 5.6985 7.1362 7.1418 8.1951 8.2015 8.6232 8.6284 9.3147 9.3176 9.9073 9.9136 10.5594 10.5623 11.5950 11.6049 12.6397 12.6483 13.6619 13.6738 13.9497 13.9562 15.5343 15.5409 16.5531 16.5598 18.3677 18.3725 19.6883 19.6929 20.9763 20.9782 k = 0.2987 0.2450 0.1178 ( 2469 PWs) bands (ev): -11.7577 -11.7569 -10.4541 -10.4525 -9.6439 -9.6405 -5.8257 -5.8246 -3.6995 -3.6984 -2.9058 -2.9043 -0.0574 -0.0538 1.0506 1.0541 1.7356 1.7406 2.9332 2.9376 3.3756 3.3801 4.5339 4.5412 5.5068 5.5173 5.7069 5.7091 7.1386 7.1443 8.2171 8.2235 8.6597 8.6648 9.3148 9.3180 9.9324 9.9379 10.6026 10.6053 11.6376 11.6473 12.6044 12.6128 13.6509 13.6628 13.9531 13.9593 15.5028 15.5095 16.5363 16.5431 18.3387 18.3436 19.6814 19.6863 20.9783 20.9802 k = 0.2922 0.2397 0.1152 ( 2467 PWs) bands (ev): -11.8013 -11.8004 -10.4679 -10.4664 -9.6371 -9.6337 -5.8297 -5.8285 -3.7262 -3.7250 -2.8947 -2.8932 0.0064 0.0100 1.0682 1.0719 1.7643 1.7694 2.9322 2.9358 3.3844 3.3887 4.5428 4.5500 5.5208 5.5310 5.7178 5.7201 7.1405 7.1463 8.2388 8.2453 8.6978 8.7028 9.3130 9.3163 9.9618 9.9667 10.6456 10.6481 11.6795 11.6891 12.5691 12.5773 13.6383 13.6502 13.9570 13.9629 15.4701 15.4767 16.5192 16.5261 18.3087 18.3137 19.6764 19.6814 20.9819 20.9837 k = 0.2857 0.2343 0.1126 ( 2466 PWs) bands (ev): -11.8451 -11.8443 -10.4819 -10.4804 -9.6297 -9.6264 -5.8339 -5.8327 -3.7527 -3.7515 -2.8831 -2.8816 0.0705 0.0741 1.0863 1.0901 1.7934 1.7988 2.9271 2.9299 3.3977 3.4018 4.5522 4.5592 5.5328 5.5428 5.7290 5.7315 7.1417 7.1475 8.2601 8.2666 8.7372 8.7422 9.3097 9.3132 9.9953 9.9995 10.6883 10.6907 11.7208 11.7302 12.5340 12.5419 13.6242 13.6360 13.9613 13.9670 15.4361 15.4427 16.5016 16.5086 18.2777 18.2826 19.6733 19.6785 20.9866 20.9884 k = 0.2792 0.2290 0.1101 ( 2465 PWs) bands (ev): -11.8892 -11.8883 -10.4962 -10.4947 -9.6218 -9.6184 -5.8386 -5.8373 -3.7789 -3.7777 -2.8711 -2.8696 0.1348 0.1385 1.1048 1.1087 1.8229 1.8285 2.9187 2.9207 3.4146 3.4187 4.5622 4.5690 5.5430 5.5527 5.7404 5.7435 7.1419 7.1477 8.2808 8.2873 8.7777 8.7828 9.3056 9.3092 10.0323 10.0359 10.7308 10.7330 11.7614 11.7705 12.4992 12.5068 13.6088 13.6204 13.9659 13.9712 15.4010 15.4075 16.4836 16.4906 18.2455 18.2505 19.6723 19.6777 20.9917 20.9936 k = 0.2727 0.2237 0.1075 ( 2463 PWs) bands (ev): -11.9333 -11.9325 -10.5106 -10.5092 -9.6133 -9.6100 -5.8435 -5.8423 -3.8047 -3.8035 -2.8587 -2.8571 0.1993 0.2029 1.1236 1.1276 1.8527 1.8584 2.9077 2.9092 3.4342 3.4384 4.5728 4.5795 5.5519 5.5613 5.7521 5.7557 7.1409 7.1467 8.3007 8.3072 8.8190 8.8241 9.3014 9.3051 10.0723 10.0753 10.7730 10.7751 11.8013 11.8102 12.4647 12.4721 13.5920 13.6035 13.9704 13.9756 15.3646 15.3710 16.4652 16.4721 18.2126 18.2176 19.6736 19.6792 20.9963 20.9982 k = 0.2662 0.2184 0.1050 ( 2465 PWs) bands (ev): -11.9775 -11.9767 -10.5252 -10.5239 -9.6042 -9.6009 -5.8489 -5.8476 -3.8301 -3.8289 -2.8458 -2.8443 0.2636 0.2672 1.1427 1.1468 1.8825 1.8885 2.8951 2.8963 3.4557 3.4602 4.5842 4.5907 5.5596 5.5687 5.7639 5.7681 7.1385 7.1443 8.3197 8.3262 8.8607 8.8660 9.2977 9.3014 10.1148 10.1174 10.8149 10.8168 11.8405 11.8493 12.4309 12.4379 13.5741 13.5853 13.9749 13.9799 15.3271 15.3335 16.4462 16.4532 18.1788 18.1838 19.6774 19.6831 20.9986 21.0005 k = 0.2597 0.2130 0.1024 ( 2463 PWs) bands (ev): -12.0215 -12.0208 -10.5400 -10.5387 -9.5947 -9.5914 -5.8545 -5.8532 -3.8550 -3.8537 -2.8326 -2.8311 0.3277 0.3314 1.1619 1.1662 1.9123 1.9185 2.8815 2.8828 3.4783 3.4832 4.5964 4.6027 5.5665 5.5753 5.7757 5.7806 7.1347 7.1404 8.3375 8.3440 8.9023 8.9079 9.2952 9.2989 10.1592 10.1614 10.8566 10.8583 11.8791 11.8876 12.3977 12.4045 13.5550 13.5661 13.9792 13.9840 15.2886 15.2948 16.4268 16.4337 18.1443 18.1494 19.6838 19.6896 20.9967 20.9986 k = 0.2532 0.2077 0.0998 ( 2462 PWs) bands (ev): -12.0654 -12.0647 -10.5550 -10.5538 -9.5846 -9.5814 -5.8606 -5.8593 -3.8793 -3.8780 -2.8191 -2.8176 0.3914 0.3950 1.1814 1.1857 1.9418 1.9482 2.8679 2.8694 3.5015 3.5068 4.6094 4.6155 5.5728 5.5814 5.7876 5.7930 7.1294 7.1350 8.3540 8.3604 8.9432 8.9493 9.2946 9.2984 10.2050 10.2071 10.8979 10.8995 11.9169 11.9252 12.3656 12.3719 13.5350 13.5458 13.9832 13.9878 15.2490 15.2551 16.4068 16.4137 18.1094 18.1145 19.6929 19.6988 20.9884 20.9902 k = 0.2468 0.2024 0.0973 ( 2460 PWs) bands (ev): -12.1090 -12.1083 -10.5701 -10.5689 -9.5742 -9.5710 -5.8670 -5.8656 -3.9029 -3.9016 -2.8052 -2.8037 0.4545 0.4580 1.2010 1.2054 1.9708 1.9773 2.8550 2.8569 3.5247 3.5304 4.6233 4.6291 5.5788 5.5872 5.7994 5.8053 7.1225 7.1280 8.3689 8.3754 8.9828 8.9896 9.2967 9.3008 10.2517 10.2538 10.9389 10.9405 11.9538 11.9618 12.3347 12.3407 13.5140 13.5246 13.9869 13.9914 15.2085 15.2144 16.3863 16.3931 18.0742 18.0793 19.7047 19.7107 20.9720 20.9737 k = 0.2403 0.1971 0.0947 ( 2461 PWs) bands (ev): -12.1523 -12.1516 -10.5854 -10.5842 -9.5633 -9.5601 -5.8737 -5.8724 -3.9259 -3.9246 -2.7909 -2.7894 0.5166 0.5201 1.2207 1.2252 1.9990 2.0057 2.8435 2.8458 3.5474 3.5536 4.6380 4.6437 5.5848 5.5929 5.8111 5.8174 7.1139 7.1194 8.3821 8.3886 9.0202 9.0277 9.3025 9.3071 10.2988 10.3012 10.9795 10.9811 11.9894 11.9971 12.3059 12.3113 13.4922 13.5025 13.9901 13.9945 15.1670 15.1727 16.3652 16.3720 18.0388 18.0440 19.7194 19.7255 20.9470 20.9486 k = 0.2338 0.1917 0.0922 ( 2460 PWs) bands (ev): -12.1952 -12.1945 -10.6007 -10.5996 -9.5520 -9.5489 -5.8808 -5.8795 -3.9480 -3.9467 -2.7764 -2.7749 0.5775 0.5809 1.2408 1.2453 2.0261 2.0331 2.8341 2.8368 3.5694 3.5760 4.6536 4.6591 5.5908 5.5988 5.8226 5.8294 7.1038 7.1091 8.3933 8.3999 9.0543 9.0627 9.3131 9.3184 10.3460 10.3486 11.0198 11.0214 12.0230 12.0303 12.2800 12.2848 13.4696 13.4797 13.9928 13.9971 15.1248 15.1302 16.3437 16.3503 18.0036 18.0088 19.7370 19.7430 20.9141 20.9156 k = 0.2273 0.1864 0.0896 ( 2457 PWs) bands (ev): -12.2376 -12.2369 -10.6162 -10.6151 -9.5405 -9.5374 -5.8882 -5.8869 -3.9693 -3.9680 -2.7616 -2.7602 0.6368 0.6402 1.2612 1.2658 2.0518 2.0590 2.8274 2.8304 3.5902 3.5973 4.6698 4.6753 5.5972 5.6049 5.8341 5.8412 7.0921 7.0974 8.4026 8.4092 9.0844 9.0935 9.3297 9.3356 10.3927 10.3957 11.0597 11.0613 12.0526 12.0595 12.2591 12.2633 13.4463 13.4561 13.9950 13.9993 15.0819 15.0870 16.3216 16.3282 17.9686 17.9738 19.7575 19.7635 20.8744 20.8760 k = 0.2208 0.1811 0.0870 ( 2457 PWs) bands (ev): -12.2794 -12.2788 -10.6316 -10.6306 -9.5286 -9.5256 -5.8959 -5.8946 -3.9898 -3.9885 -2.7466 -2.7452 0.6941 0.6973 1.2822 1.2869 2.0759 2.0833 2.8240 2.8272 3.6098 3.6173 4.6867 4.6922 5.6039 5.6114 5.8455 5.8529 7.0790 7.0841 8.4096 8.4163 9.1100 9.1195 9.3528 9.3592 10.4386 10.4420 11.0989 11.1007 12.0747 12.0814 12.2468 12.2509 13.4223 13.4319 13.9966 14.0009 15.0384 15.0431 16.2991 16.3055 17.9341 17.9392 19.7807 19.7867 20.8295 20.8311 k = 0.2143 0.1758 0.0845 ( 2458 PWs) bands (ev): -12.3206 -12.3201 -10.6471 -10.6461 -9.5166 -9.5136 -5.9040 -5.9026 -4.0093 -4.0080 -2.7314 -2.7300 0.7488 0.7517 1.3043 1.3089 2.0980 2.1056 2.8242 2.8278 3.6279 3.6359 4.7041 4.7097 5.6110 5.6184 5.8568 5.8645 7.0644 7.0695 8.4145 8.4212 9.1313 9.1408 9.3822 9.3887 10.4833 10.4870 11.1375 11.1394 12.0843 12.0910 12.2479 12.2530 13.3978 13.4072 13.9976 14.0019 14.9944 14.9988 16.2762 16.2824 17.9001 17.9052 19.8067 19.8126 20.7806 20.7824 k = 0.2078 0.1704 0.0819 ( 2456 PWs) bands (ev): -12.3612 -12.3606 -10.6625 -10.6616 -9.5043 -9.5014 -5.9122 -5.9109 -4.0279 -4.0266 -2.7160 -2.7147 0.8002 0.8030 1.3276 1.3322 2.1180 2.1258 2.8285 2.8324 3.6446 3.6530 4.7219 4.7277 5.6187 5.6259 5.8682 5.8761 7.0485 7.0536 8.4171 8.4239 9.1492 9.1584 9.4170 9.4234 10.5263 10.5305 11.1752 11.1773 12.0801 12.0870 12.2645 12.2707 13.3728 13.3819 13.9979 14.0023 14.9502 14.9542 16.2529 16.2589 17.8669 17.8720 19.8352 19.8409 20.7290 20.7309 k = 0.2013 0.1651 0.0794 ( 2460 PWs) bands (ev): -12.4010 -12.4005 -10.6779 -10.6770 -9.4919 -9.4890 -5.9208 -5.9195 -4.0456 -4.0443 -2.7006 -2.6992 0.8477 0.8503 1.3527 1.3574 2.1358 2.1437 2.8371 2.8413 3.6597 3.6685 4.7397 4.7458 5.6269 5.6339 5.8796 5.8877 7.0314 7.0364 8.4174 8.4243 9.1646 9.1733 9.4559 9.4620 10.5674 10.5720 11.2118 11.2141 12.0667 12.0735 12.2928 12.2996 13.3474 13.3563 13.9975 14.0020 14.9059 14.9095 16.2292 16.2351 17.8346 17.8396 19.8659 19.8715 20.6757 20.6778 k = 0.1948 0.1598 0.0768 ( 2460 PWs) bands (ev): -12.4400 -12.4395 -10.6931 -10.6923 -9.4794 -9.4766 -5.9295 -5.9282 -4.0622 -4.0610 -2.6850 -2.6837 0.8906 0.8929 1.3801 1.3848 2.1515 2.1595 2.8502 2.8546 3.6732 3.6825 4.7574 4.7638 5.6358 5.6424 5.8912 5.8995 7.0132 7.0182 8.4157 8.4226 9.1787 9.1868 9.4975 9.5034 10.6062 10.6113 11.2472 11.2497 12.0490 12.0554 12.3282 12.3351 13.3218 13.3303 13.9963 14.0009 14.8617 14.8650 16.2054 16.2111 17.8033 17.8082 19.8983 19.9036 20.6218 20.6241 k = 0.1883 0.1545 0.0742 ( 2458 PWs) bands (ev): -12.4782 -12.4777 -10.7082 -10.7074 -9.4668 -9.4641 -5.9385 -5.9372 -4.0779 -4.0767 -2.6694 -2.6681 0.9282 0.9304 1.4102 1.4150 2.1652 2.1733 2.8676 2.8722 3.6854 3.6949 4.7748 4.7816 5.6453 5.6516 5.9031 5.9115 6.9940 6.9990 8.4119 8.4189 9.1920 9.1995 9.5411 9.5466 10.6426 10.6480 11.2809 11.2836 12.0298 12.0359 12.3677 12.3747 13.2960 13.3043 13.9943 13.9990 14.8180 14.8208 16.1814 16.1869 17.7730 17.7778 19.9318 19.9367 20.5685 20.5712 k = 0.1818 0.1491 0.0717 ( 2460 PWs) bands (ev): -12.5155 -12.5150 -10.7232 -10.7224 -9.4543 -9.4516 -5.9476 -5.9463 -4.0926 -4.0914 -2.6538 -2.6525 0.9600 0.9622 1.4431 1.4481 2.1772 2.1854 2.8891 2.8938 3.6961 3.7060 4.7915 4.7987 5.6554 5.6614 5.9152 5.9238 6.9739 6.9790 8.4063 8.4134 9.2051 9.2120 9.5857 9.5909 10.6761 10.6819 11.3127 11.3157 12.0106 12.0165 12.4100 12.4170 13.2701 13.2781 13.9912 13.9962 14.7749 14.7773 16.1574 16.1627 17.7439 17.7486 19.9649 19.9693 20.5174 20.5207 k = 0.1753 0.1438 0.0691 ( 2459 PWs) bands (ev): -12.5518 -12.5514 -10.7380 -10.7372 -9.4417 -9.4392 -5.9568 -5.9555 -4.1063 -4.1051 -2.6383 -2.6370 0.9859 0.9882 1.4789 1.4842 2.1881 2.1963 2.9144 2.9192 3.7057 3.7158 4.8073 4.8148 5.6663 5.6718 5.9277 5.9364 6.9530 6.9582 8.3990 8.4062 9.2183 9.2247 9.6308 9.6358 10.7068 10.7129 11.3423 11.3455 11.9924 11.9980 12.4544 12.4613 13.2443 13.2521 13.9871 13.9923 14.7326 14.7348 16.1333 16.1384 17.7159 17.7205 19.9957 19.9994 20.4711 20.4751 k = 0.1688 0.1385 0.0666 ( 2458 PWs) bands (ev): -12.5872 -12.5868 -10.7525 -10.7518 -9.4293 -9.4268 -5.9660 -5.9648 -4.1191 -4.1179 -2.6228 -2.6216 1.0060 1.0085 1.5173 1.5229 2.1983 2.2063 2.9430 2.9479 3.7142 3.7245 4.8219 4.8297 5.6778 5.6829 5.9405 5.9495 6.9314 6.9368 8.3904 8.3976 9.2317 9.2376 9.6759 9.6807 10.7345 10.7408 11.3693 11.3726 11.9758 11.9812 12.5003 12.5072 13.2189 13.2263 13.9818 13.9873 14.6916 14.6937 16.1094 16.1143 17.6891 17.6936 20.0205 20.0232 20.4334 20.4383 k = 0.1623 0.1332 0.0640 ( 2462 PWs) bands (ev): -12.6216 -12.6212 -10.7667 -10.7660 -9.4170 -9.4145 -5.9754 -5.9742 -4.1309 -4.1298 -2.6075 -2.6064 1.0207 1.0234 1.5577 1.5637 2.2082 2.2161 2.9743 2.9793 3.7217 3.7323 4.8351 4.8432 5.6900 5.6945 5.9538 5.9631 6.9093 6.9148 8.3806 8.3878 9.2454 9.2510 9.7207 9.7253 10.7590 10.7655 11.3933 11.3967 11.9613 11.9665 12.5475 12.5544 13.1939 13.2011 13.9751 13.9809 14.6521 14.6542 16.0857 16.0903 17.6635 17.6679 20.0341 20.0357 20.4095 20.4156 k = 0.1558 0.1278 0.0614 ( 2462 PWs) bands (ev): -12.6549 -12.6545 -10.7806 -10.7800 -9.4048 -9.4024 -5.9847 -5.9835 -4.1418 -4.1407 -2.5924 -2.5913 1.0305 1.0333 1.5995 1.6059 2.2185 2.2262 3.0080 3.0129 3.7286 3.7392 4.8466 4.8548 5.7027 5.7067 5.9675 5.9771 6.8866 6.8924 8.3700 8.3772 9.2596 9.2647 9.7647 9.7693 10.7804 10.7871 11.4139 11.4175 11.9492 11.9542 12.5956 12.6025 13.1697 13.1766 13.9670 13.9731 14.6144 14.6168 16.0622 16.0666 17.6392 17.6433 20.0312 20.0322 20.4048 20.4121 k = 0.1494 0.1225 0.0589 ( 2457 PWs) bands (ev): -12.6870 -12.6867 -10.7942 -10.7936 -9.3929 -9.3906 -5.9940 -5.9929 -4.1518 -4.1507 -2.5775 -2.5764 1.0359 1.0390 1.6419 1.6487 2.2296 2.2371 3.0433 3.0482 3.7349 3.7457 4.8563 4.8646 5.7160 5.7194 5.9818 5.9917 6.8636 6.8697 8.3587 8.3659 9.2741 9.2788 9.8078 9.8122 10.7988 10.8054 11.4309 11.4345 11.9400 11.9448 12.6442 12.6510 13.1466 13.1531 13.9573 13.9637 14.5790 14.5818 16.0391 16.0433 17.6160 17.6200 20.0106 20.0119 20.4207 20.4288 k = 0.1429 0.1172 0.0563 ( 2455 PWs) bands (ev): -12.7181 -12.7178 -10.8075 -10.8069 -9.3811 -9.3789 -6.0032 -6.0021 -4.1609 -4.1598 -2.5629 -2.5618 1.0377 1.0409 1.6841 1.6912 2.2420 2.2493 3.0799 3.0847 3.7409 3.7517 4.8639 4.8724 5.7296 5.7324 5.9965 6.0068 6.8403 6.8468 8.3471 8.3542 9.2889 9.2934 9.8495 9.8539 10.8141 10.8207 11.4440 11.4476 11.9339 11.9384 12.6927 12.6996 13.1249 13.1311 13.9458 13.9525 14.5460 14.5494 16.0163 16.0203 17.5940 17.5978 19.9764 19.9780 20.4536 20.4621 k = 0.1364 0.1118 0.0538 ( 2453 PWs) bands (ev): -12.7480 -12.7477 -10.8203 -10.8198 -9.3697 -9.3676 -6.0123 -6.0112 -4.1692 -4.1681 -2.5485 -2.5475 1.0364 1.0396 1.7253 1.7328 2.2561 2.2631 3.1171 3.1219 3.7468 3.7576 4.8696 4.8780 5.7434 5.7457 6.0117 6.0224 6.8169 6.8238 8.3354 8.3425 9.3041 9.3082 9.8895 9.8939 10.8265 10.8330 11.4530 11.4565 11.9310 11.9353 12.7407 12.7475 13.1053 13.1111 13.9325 13.9396 14.5159 14.5198 15.9940 15.9978 17.5731 17.5768 19.9337 19.9354 20.4986 20.5071 k = 0.1299 0.1065 0.0512 ( 2456 PWs) bands (ev): -12.7767 -12.7764 -10.8328 -10.8323 -9.3586 -9.3565 -6.0212 -6.0202 -4.1767 -4.1757 -2.5346 -2.5336 1.0324 1.0357 1.7650 1.7727 2.2723 2.2789 3.1545 3.1592 3.7528 3.7636 4.8731 4.8815 5.7570 5.7591 6.0273 6.0385 6.7935 6.8008 8.3238 8.3307 9.3195 9.3234 9.9275 9.9320 10.8363 10.8427 11.4578 11.4612 11.9313 11.9353 12.7870 12.7939 13.0884 13.0938 13.9173 13.9247 14.4888 14.4931 15.9723 15.9758 17.5534 17.5568 19.8863 19.8880 20.5515 20.5600 k = 0.1234 0.1012 0.0486 ( 2454 PWs) bands (ev): -12.8042 -12.8039 -10.8448 -10.8443 -9.3478 -9.3458 -6.0299 -6.0289 -4.1834 -4.1825 -2.5210 -2.5201 1.0262 1.0295 1.8026 1.8104 2.2908 2.2970 3.1916 3.1961 3.7591 3.7699 4.8748 4.8830 5.7703 5.7723 6.0433 6.0550 6.7702 6.7781 8.3126 8.3194 9.3353 9.3389 9.9632 9.9677 10.8438 10.8498 11.4588 11.4620 11.9347 11.9385 12.8304 12.8372 13.0757 13.0805 13.9004 13.9080 14.4648 14.4696 15.9511 15.9545 17.5347 17.5380 19.8367 19.8383 20.6100 20.6185 k = 0.1169 0.0959 0.0461 ( 2452 PWs) bands (ev): -12.8304 -12.8301 -10.8563 -10.8558 -9.3374 -9.3355 -6.0384 -6.0375 -4.1895 -4.1886 -2.5078 -2.5069 1.0183 1.0215 1.8376 1.8456 2.3117 2.3175 3.2278 3.2322 3.7661 3.7767 4.8746 4.8827 5.7830 5.7852 6.0597 6.0718 6.7474 6.7557 8.3018 8.3084 9.3512 9.3547 9.9962 10.0008 10.8491 10.8548 11.4562 11.4592 11.9408 11.9443 12.8685 12.8752 13.0693 13.0734 13.8817 13.8895 14.4440 14.4492 15.9305 15.9337 17.5170 17.5202 19.7864 19.7879 20.6725 20.6808 k = 0.1104 0.0905 0.0435 ( 2454 PWs) bands (ev): -12.8553 -12.8550 -10.8673 -10.8669 -9.3274 -9.3256 -6.0466 -6.0457 -4.1949 -4.1940 -2.4951 -2.4943 1.0089 1.0120 1.8698 1.8777 2.3351 2.3404 3.2628 3.2669 3.7738 3.7842 4.8727 4.8806 5.7949 5.7974 6.0761 6.0887 6.7251 6.7340 8.2917 8.2981 9.3674 9.3707 10.0261 10.0308 10.8528 10.8581 11.4504 11.4532 11.9493 11.9525 12.8979 12.9042 13.0726 13.0756 13.8616 13.8695 14.4263 14.4317 15.9106 15.9136 17.5004 17.5034 19.7363 19.7378 20.7376 20.7459 k = 0.1039 0.0852 0.0410 ( 2452 PWs) bands (ev): -12.8789 -12.8787 -10.8778 -10.8774 -9.3179 -9.3162 -6.0545 -6.0536 -4.1996 -4.1988 -2.4829 -2.4822 0.9984 1.0014 1.8990 1.9069 2.3606 2.3655 3.2960 3.2999 3.7825 3.7927 4.8693 4.8771 5.8060 5.8088 6.0925 6.1055 6.7037 6.7131 8.2824 8.2886 9.3838 9.3870 10.0527 10.0575 10.8552 10.8601 11.4420 11.4446 11.9596 11.9626 12.9157 12.9214 13.0880 13.0900 13.8403 13.8483 14.4115 14.4171 15.8915 15.8943 17.4848 17.4876 19.6873 19.6887 20.8047 20.8128 k = 0.0974 0.0799 0.0384 ( 2451 PWs) bands (ev): -12.9012 -12.9010 -10.8878 -10.8875 -9.3088 -9.3072 -6.0620 -6.0612 -4.2039 -4.2031 -2.4713 -2.4706 0.9871 0.9900 1.9254 1.9331 2.3881 2.3924 3.3270 3.3306 3.7924 3.8023 4.8648 4.8723 5.8160 5.8191 6.1085 6.1219 6.6834 6.6934 8.2739 8.2799 9.4004 9.4035 10.0755 10.0805 10.8567 10.8611 11.4314 11.4338 11.9713 11.9740 12.9228 12.9279 13.1138 13.1158 13.8182 13.8262 14.3994 14.4051 15.8732 15.8758 17.4701 17.4727 19.6397 19.6410 20.8730 20.8810 k = 0.0909 0.0746 0.0358 ( 2454 PWs) bands (ev): -12.9222 -12.9220 -10.8972 -10.8969 -9.3002 -9.2987 -6.0692 -6.0685 -4.2076 -4.2069 -2.4602 -2.4595 0.9753 0.9780 1.9490 1.9564 2.4170 2.4208 3.3554 3.3588 3.8035 3.8131 4.8592 4.8665 5.8250 5.8282 6.1238 6.1375 6.6646 6.6750 8.2664 8.2720 9.4172 9.4201 10.0944 10.0994 10.8577 10.8616 11.4194 11.4215 11.9840 11.9865 12.9231 12.9277 13.1459 13.1485 13.7955 13.8035 14.3897 14.3954 15.8556 15.8581 17.4563 17.4587 19.5940 19.5952 20.9417 20.9496 k = 0.0844 0.0692 0.0333 ( 2455 PWs) bands (ev): -12.9418 -12.9416 -10.9061 -10.9058 -9.2921 -9.2907 -6.0760 -6.0753 -4.2108 -4.2101 -2.4497 -2.4491 0.9633 0.9658 1.9701 1.9771 2.4468 2.4501 3.3810 3.3841 3.8160 3.8252 4.8530 4.8600 5.8328 5.8361 6.1379 6.1519 6.6476 6.6584 8.2597 8.2651 9.4342 9.4370 10.1091 10.1142 10.8587 10.8621 11.4062 11.4082 11.9972 11.9994 12.9204 12.9245 13.1805 13.1839 13.7727 13.7807 14.3822 14.3879 15.8390 15.8413 17.4435 17.4457 19.5504 19.5516 21.0103 21.0181 k = 0.0779 0.0639 0.0307 ( 2450 PWs) bands (ev): -12.9600 -12.9598 -10.9144 -10.9141 -9.2845 -9.2832 -6.0824 -6.0817 -4.2136 -4.2130 -2.4399 -2.4393 0.9512 0.9536 1.9889 1.9955 2.4769 2.4797 3.4037 3.4065 3.8297 3.8384 4.8463 4.8531 5.8395 5.8428 6.1506 6.1646 6.6327 6.6439 8.2540 8.2591 9.4513 9.4540 10.1195 10.1247 10.8599 10.8628 11.3924 11.3942 12.0106 12.0126 12.9166 12.9204 13.2155 13.2194 13.7502 13.7582 14.3766 14.3821 15.8233 15.8255 17.4315 17.4336 19.5093 19.5104 21.0781 21.0858 k = 0.0714 0.0586 0.0282 ( 2450 PWs) bands (ev): -12.9768 -12.9766 -10.9220 -10.9218 -9.2774 -9.2762 -6.0883 -6.0877 -4.2160 -4.2155 -2.4307 -2.4302 0.9393 0.9415 2.0057 2.0118 2.5068 2.5091 3.4233 3.4259 3.8444 3.8527 4.8394 4.8459 5.8452 5.8484 6.1615 6.1754 6.6204 6.6316 8.2493 8.2540 9.4685 9.4711 10.1257 10.1309 10.8615 10.8640 11.3785 11.3800 12.0239 12.0256 12.9128 12.9163 13.2493 13.2537 13.7283 13.7364 14.3726 14.3778 15.8086 15.8106 17.4204 17.4223 19.4708 19.4718 21.1443 21.1518 k = 0.0649 0.0533 0.0256 ( 2451 PWs) bands (ev): -12.9922 -12.9921 -10.9291 -10.9288 -9.2709 -9.2698 -6.0937 -6.0932 -4.2181 -4.2176 -2.4222 -2.4217 0.9277 0.9298 2.0207 2.0263 2.5358 2.5377 3.4399 3.4423 3.8598 3.8676 4.8326 4.8387 5.8498 5.8529 6.1702 6.1838 6.6106 6.6217 8.2453 8.2497 9.4857 9.4882 10.1279 10.1330 10.8637 10.8657 11.3647 11.3661 12.0367 12.0383 12.9095 12.9127 13.2809 13.2859 13.7075 13.7157 14.3699 14.3749 15.7950 15.7968 17.4102 17.4119 19.4352 19.4361 21.2083 21.2156 k = 0.0584 0.0479 0.0230 ( 2453 PWs) bands (ev): -13.0062 -13.0060 -10.9355 -10.9352 -9.2650 -9.2640 -6.0987 -6.0982 -4.2198 -4.2194 -2.4145 -2.4140 0.9168 0.9186 2.0340 2.0391 2.5636 2.5651 3.4539 3.4560 3.8755 3.8827 4.8260 4.8317 5.8535 5.8564 6.1767 6.1897 6.6036 6.6142 8.2422 8.2462 9.5029 9.5052 10.1264 10.1314 10.8665 10.8681 11.3514 11.3526 12.0490 12.0503 12.9070 12.9099 13.3099 13.3154 13.6881 13.6964 14.3683 14.3729 15.7825 15.7841 17.4009 17.4024 19.4025 19.4033 21.2691 21.2762 k = 0.0519 0.0426 0.0205 ( 2449 PWs) bands (ev): -13.0187 -13.0186 -10.9412 -10.9410 -9.2597 -9.2588 -6.1032 -6.1028 -4.2213 -4.2209 -2.4074 -2.4070 0.9065 0.9082 2.0458 2.0503 2.5896 2.5908 3.4653 3.4673 3.8911 3.8977 4.8198 4.8251 5.8565 5.8591 6.1811 6.1932 6.5992 6.6091 8.2398 8.2434 9.5197 9.5220 10.1218 10.1266 10.8698 10.8711 11.3388 11.3399 12.0604 12.0616 12.9052 12.9079 13.3358 13.3418 13.6706 13.6789 14.3676 14.3718 15.7711 15.7725 17.3924 17.3938 19.3729 19.3737 21.3261 21.3329 k = 0.0455 0.0373 0.0179 ( 2452 PWs) bands (ev): -13.0298 -13.0297 -10.9463 -10.9462 -9.2550 -9.2542 -6.1072 -6.1068 -4.2225 -4.2222 -2.4012 -2.4008 0.8971 0.8986 2.0561 2.0601 2.6134 2.6144 3.4745 3.4764 3.9061 3.9120 4.8141 4.8190 5.8587 5.8611 6.1836 6.1945 6.5970 6.6061 8.2380 8.2412 9.5361 9.5382 10.1147 10.1192 10.8734 10.8745 11.3273 11.3282 12.0708 12.0718 12.9042 12.9066 13.3583 13.3646 13.6552 13.6635 14.3675 14.3713 15.7609 15.7622 17.3849 17.3861 19.3466 19.3472 21.3784 21.3848 k = 0.0390 0.0320 0.0154 ( 2450 PWs) bands (ev): -13.0394 -13.0393 -10.9508 -10.9506 -9.2508 -9.2502 -6.1107 -6.1104 -4.2235 -4.2232 -2.3957 -2.3954 0.8888 0.8900 2.0651 2.0686 2.6348 2.6355 3.4819 3.4836 3.9200 3.9253 4.8092 4.8135 5.8604 5.8625 6.1845 6.1941 6.5967 6.6047 8.2367 8.2395 9.5517 9.5536 10.1059 10.1100 10.8772 10.8780 11.3170 11.3177 12.0801 12.0810 12.9038 12.9058 13.3773 13.3836 13.6423 13.6504 14.3679 14.3712 15.7520 15.7531 17.3784 17.3794 19.3236 19.3241 21.4253 21.4311 k = 0.0325 0.0266 0.0128 ( 2445 PWs) bands (ev): -13.0476 -13.0475 -10.9545 -10.9544 -9.2473 -9.2468 -6.1136 -6.1133 -4.2243 -4.2241 -2.3910 -2.3908 0.8815 0.8825 2.0728 2.0757 2.6534 2.6539 3.4878 3.4892 3.9326 3.9370 4.8051 4.8088 5.8617 5.8635 6.1843 6.1924 6.5978 6.6045 8.2358 8.2382 9.5662 9.5680 10.0962 10.0998 10.8809 10.8815 11.3080 11.3086 12.0882 12.0889 12.9038 12.9056 13.3926 13.3988 13.6321 13.6397 14.3686 14.3714 15.7444 15.7453 17.3728 17.3737 19.3040 19.3045 21.4660 21.4711 k = 0.0260 0.0213 0.0102 ( 2445 PWs) bands (ev): -13.0542 -13.0542 -10.9576 -10.9575 -9.2444 -9.2440 -6.1160 -6.1158 -4.2249 -4.2247 -2.3872 -2.3870 0.8754 0.8762 2.0791 2.0814 2.6689 2.6693 3.4922 3.4934 3.9433 3.9470 4.8017 4.8048 5.8626 5.8640 6.1835 6.1900 6.5996 6.6050 8.2353 8.2372 9.5792 9.5807 10.0866 10.0896 10.8843 10.8847 11.3005 11.3009 12.0950 12.0955 12.9042 12.9056 13.4045 13.4102 13.6246 13.6313 14.3694 14.3717 15.7381 15.7388 17.3682 17.3689 19.2879 19.2883 21.5000 21.5043 k = 0.0195 0.0160 0.0077 ( 2437 PWs) bands (ev): -13.0594 -13.0594 -10.9600 -10.9600 -9.2422 -9.2418 -6.1179 -6.1177 -4.2254 -4.2252 -2.3842 -2.3840 0.8706 0.8713 2.0841 2.0859 2.6812 2.6815 3.4955 3.4964 3.9521 3.9549 4.7992 4.8016 5.8632 5.8643 6.1825 6.1874 6.6017 6.6058 8.2350 8.2365 9.5901 9.5913 10.0780 10.0804 10.8871 10.8875 11.2945 11.2949 12.1003 12.1007 12.9047 12.9058 13.4134 13.4180 13.6197 13.6251 14.3703 14.3721 15.7332 15.7337 17.3646 17.3652 19.2753 19.2756 21.5269 21.5303 k = 0.0130 0.0107 0.0051 ( 2434 PWs) bands (ev): -13.0631 -13.0631 -10.9617 -10.9617 -9.2405 -9.2403 -6.1192 -6.1191 -4.2257 -4.2256 -2.3820 -2.3819 0.8672 0.8676 2.0878 2.0889 2.6901 2.6903 3.4978 3.4985 3.9586 3.9605 4.7975 4.7991 5.8637 5.8645 6.1817 6.1850 6.6037 6.6065 8.2350 8.2359 9.5984 9.5993 10.0712 10.0729 10.8893 10.8896 11.2903 11.2905 12.1042 12.1045 12.9052 12.9060 13.4195 13.4228 13.6169 13.6208 14.3711 14.3723 15.7297 15.7301 17.3621 17.3624 19.2663 19.2665 21.5464 21.5487 k = 0.0065 0.0053 0.0026 ( 2435 PWs) bands (ev): -13.0654 -13.0654 -10.9628 -10.9628 -9.2395 -9.2394 -6.1200 -6.1200 -4.2259 -4.2258 -2.3807 -2.3806 0.8652 0.8654 2.0901 2.0907 2.6955 2.6956 3.4992 3.4995 3.9628 3.9637 4.7967 4.7975 5.8640 5.8644 6.1814 6.1831 6.6053 6.6067 8.2351 8.2355 9.6038 9.6042 10.0670 10.0679 10.8907 10.8908 11.2877 11.2878 12.1066 12.1067 12.9057 12.9060 13.4233 13.4250 13.6159 13.6179 14.3717 14.3723 15.7276 15.7278 17.3606 17.3608 19.2609 19.2610 21.5583 21.5595 k = 0.0000 0.0000 0.0000 ( 2433 PWs) bands (ev): -13.0661 -13.0661 -10.9631 -10.9631 -9.2391 -9.2391 -6.1203 -6.1203 -4.2259 -4.2259 -2.3802 -2.3802 0.8646 0.8646 2.0911 2.0911 2.6974 2.6974 3.4998 3.4998 3.9645 3.9645 4.7967 4.7967 5.8643 5.8643 6.1819 6.1819 6.6063 6.6063 8.2353 8.2353 9.6057 9.6057 10.0658 10.0658 10.8912 10.8912 11.2869 11.2869 12.1074 12.1074 12.9059 12.9059 13.4251 13.4251 13.6163 13.6163 14.3721 14.3721 15.7270 15.7270 17.3602 17.3602 19.2592 19.2592 21.5627 21.5627 Writing output data file Al2O3.save init_run : 1.96s CPU 10.54s WALL ( 1 calls) electrons : 967.27s CPU 977.20s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.53s CPU 2.19s WALL ( 1 calls) Called by electrons: c_bands : 967.24s CPU 976.95s WALL ( 1 calls) v_of_rho : 0.18s CPU 1.03s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.17s CPU 0.62s WALL ( 1 calls) newd : 0.21s CPU 0.45s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.13s WALL ( 397 calls) cegterg : 926.19s CPU 932.22s WALL ( 1105 calls) Called by sum_band: Called by *egterg: h_psi : 297.50s CPU 308.07s WALL ( 19289 calls) s_psi : 24.73s CPU 25.99s WALL ( 19289 calls) g_psi : 0.72s CPU 0.73s WALL ( 17787 calls) cdiaghg : 473.58s CPU 469.58s WALL ( 18184 calls) cegterg:over : 78.56s CPU 74.31s WALL ( 17787 calls) cegterg:upda : 12.37s CPU 17.48s WALL ( 17787 calls) cegterg:last : 10.99s CPU 12.04s WALL ( 2693 calls) Called by h_psi: h_psi:vloc : 223.78s CPU 233.46s WALL ( 19289 calls) h_psi:vnl : 73.49s CPU 73.87s WALL ( 19289 calls) add_vuspsi : 17.58s CPU 22.80s WALL ( 19289 calls) General routines calbec : 55.85s CPU 50.91s WALL ( 19289 calls) fft : 0.51s CPU 1.67s WALL ( 19 calls) ffts : 0.04s CPU 0.63s WALL ( 4 calls) fftw : 213.58s CPU 221.53s WALL ( 1919528 calls) interpolate : 0.05s CPU 0.64s WALL ( 4 calls) davcio : 0.03s CPU 1.62s WALL ( 794 calls) Parallel routines fft_scatter : 145.66s CPU 149.83s WALL ( 1919551 calls) PWSCF : 17m 0.76s CPU 18m17.98s WALL This run was terminated on: 0:58:16 20Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=