Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:13:34 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./H4C2NO2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 112 64 18 3213 1392 215 Max 113 65 19 3215 1415 217 Sum 4037 2315 661 115701 50499 7765 bravais-lattice index = 14 lattice parameter (alat) = 12.6395 a.u. unit-cell volume = 1158.2478 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 4 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.639535 celldm(2)= 1.000000 celldm(3)= 0.625247 celldm(4)= 0.200949 celldm(5)= 0.200949 celldm(6)= -0.241143 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.241143 0.970490 0.000000 ) a(3) = ( 0.125643 0.160683 0.591041 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.248476 -0.280131 ) b(2) = ( 0.000000 1.030408 -0.280131 ) b(3) = ( 0.000000 0.000000 1.691931 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 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. # 4 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 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) H 1.00 1.00790 H( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 295 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 2) = ( 0.0123154 0.0157500 -0.0056649), wk = 0.0033898 k( 3) = ( 0.0246308 0.0315000 -0.0113299), wk = 0.0033898 k( 4) = ( 0.0369463 0.0472500 -0.0169948), wk = 0.0033898 k( 5) = ( 0.0492617 0.0630000 -0.0226597), wk = 0.0033898 k( 6) = ( 0.0615771 0.0787499 -0.0283247), wk = 0.0033898 k( 7) = ( 0.0738925 0.0944999 -0.0339896), wk = 0.0033898 k( 8) = ( 0.0862080 0.1102499 -0.0396546), wk = 0.0033898 k( 9) = ( 0.0985234 0.1259999 -0.0453195), wk = 0.0033898 k( 10) = ( 0.1108388 0.1417499 -0.0509844), wk = 0.0033898 k( 11) = ( 0.1231542 0.1574999 -0.0566494), wk = 0.0033898 k( 12) = ( 0.1354696 0.1732499 -0.0623143), wk = 0.0033898 k( 13) = ( 0.1477851 0.1889999 -0.0679792), wk = 0.0033898 k( 14) = ( 0.1601005 0.2047499 -0.0736442), wk = 0.0033898 k( 15) = ( 0.1724159 0.2204999 -0.0793091), wk = 0.0033898 k( 16) = ( 0.1847313 0.2362498 -0.0849740), wk = 0.0033898 k( 17) = ( 0.1970467 0.2519998 -0.0906390), wk = 0.0033898 k( 18) = ( 0.2093622 0.2677498 -0.0963039), wk = 0.0033898 k( 19) = ( 0.2216776 0.2834998 -0.1019689), wk = 0.0033898 k( 20) = ( 0.2339930 0.2992498 -0.1076338), wk = 0.0033898 k( 21) = ( 0.2463084 0.3149998 -0.1132987), wk = 0.0033898 k( 22) = ( 0.2586239 0.3307498 -0.1189637), wk = 0.0033898 k( 23) = ( 0.2709393 0.3464998 -0.1246286), wk = 0.0033898 k( 24) = ( 0.2832547 0.3622498 -0.1302935), wk = 0.0033898 k( 25) = ( 0.2955701 0.3779998 -0.1359585), wk = 0.0033898 k( 26) = ( 0.3078856 0.3937497 -0.1416234), wk = 0.0033898 k( 27) = ( 0.3202010 0.4094997 -0.1472883), wk = 0.0033898 k( 28) = ( 0.3325164 0.4252497 -0.1529533), wk = 0.0033898 k( 29) = ( 0.3448318 0.4409997 -0.1586182), wk = 0.0033898 k( 30) = ( 0.3571472 0.4567497 -0.1642832), wk = 0.0033898 k( 31) = ( 0.3694627 0.4724997 -0.1699481), wk = 0.0033898 k( 32) = ( 0.3817781 0.4882497 -0.1756130), wk = 0.0033898 k( 33) = ( 0.3940935 0.5039997 -0.1812780), wk = 0.0033898 k( 34) = ( 0.3940935 0.5039997 -0.1812780), wk = 0.0033898 k( 35) = ( 0.3982494 0.5093145 -0.1617283), wk = 0.0033898 k( 36) = ( 0.4024052 0.5146294 -0.1421787), wk = 0.0033898 k( 37) = ( 0.4065610 0.5199442 -0.1226291), wk = 0.0033898 k( 38) = ( 0.4107169 0.5252591 -0.1030794), wk = 0.0033898 k( 39) = ( 0.4148727 0.5305739 -0.0835298), wk = 0.0033898 k( 40) = ( 0.4190286 0.5358887 -0.0639802), wk = 0.0033898 k( 41) = ( 0.4231844 0.5412036 -0.0444305), wk = 0.0033898 k( 42) = ( 0.4273403 0.5465184 -0.0248809), wk = 0.0033898 k( 43) = ( 0.4314961 0.5518333 -0.0053312), wk = 0.0033898 k( 44) = ( 0.4356520 0.5571481 0.0142184), wk = 0.0033898 k( 45) = ( 0.4398078 0.5624630 0.0337680), wk = 0.0033898 k( 46) = ( 0.4439637 0.5677778 0.0533177), wk = 0.0033898 k( 47) = ( 0.4481195 0.5730926 0.0728673), wk = 0.0033898 k( 48) = ( 0.4522754 0.5784075 0.0924169), wk = 0.0033898 k( 49) = ( 0.4564312 0.5837223 0.1119666), wk = 0.0033898 k( 50) = ( 0.4605871 0.5890372 0.1315162), wk = 0.0033898 k( 51) = ( 0.4647429 0.5943520 0.1510659), wk = 0.0033898 k( 52) = ( 0.4688987 0.5996669 0.1706155), wk = 0.0033898 k( 53) = ( 0.4730546 0.6049817 0.1901651), wk = 0.0033898 k( 54) = ( 0.4772104 0.6102966 0.2097148), wk = 0.0033898 k( 55) = ( 0.4813663 0.6156114 0.2292644), wk = 0.0033898 k( 56) = ( 0.4855221 0.6209263 0.2488140), wk = 0.0033898 k( 57) = ( 0.4896780 0.6262411 0.2683637), wk = 0.0033898 k( 58) = ( 0.4938338 0.6315559 0.2879133), wk = 0.0033898 k( 59) = ( 0.4979897 0.6368708 0.3074629), wk = 0.0033898 k( 60) = ( 0.5021455 0.6421856 0.3270126), wk = 0.0033898 k( 61) = ( 0.5063014 0.6475005 0.3465622), wk = 0.0033898 k( 62) = ( 0.5104572 0.6528153 0.3661118), wk = 0.0033898 k( 63) = ( 0.5146131 0.6581301 0.3856615), wk = 0.0033898 k( 64) = ( 0.5187689 0.6634450 0.4052111), wk = 0.0033898 k( 65) = ( 0.5229248 0.6687598 0.4247607), wk = 0.0033898 k( 66) = ( 0.5270806 0.6740747 0.4443104), wk = 0.0033898 k( 67) = ( 0.5312364 0.6793895 0.4638600), wk = 0.0033898 k( 68) = ( 0.5353923 0.6847044 0.4834097), wk = 0.0033898 k( 69) = ( 0.5353923 0.6847044 0.4834097), wk = 0.0033898 k( 70) = ( 0.5283138 0.6756519 0.4998947), wk = 0.0033898 k( 71) = ( 0.5212354 0.6665993 0.5163797), wk = 0.0033898 k( 72) = ( 0.5141569 0.6575468 0.5328647), wk = 0.0033898 k( 73) = ( 0.5070785 0.6484943 0.5493497), wk = 0.0033898 k( 74) = ( 0.5000000 0.6394417 0.5658347), wk = 0.0033898 k( 75) = ( 0.5000000 0.6394417 0.5658347), wk = 0.0033898 k( 76) = ( 0.5144239 0.6281632 0.5658347), wk = 0.0033898 k( 77) = ( 0.5288478 0.6168847 0.5658347), wk = 0.0033898 k( 78) = ( 0.5432717 0.6056062 0.5658347), wk = 0.0033898 k( 79) = ( 0.5576956 0.5943277 0.5658347), wk = 0.0033898 k( 80) = ( 0.5721195 0.5830492 0.5658347), wk = 0.0033898 k( 81) = ( 0.5865434 0.5717707 0.5658347), wk = 0.0033898 k( 82) = ( 0.4134566 -0.3232950 0.8459656), wk = 0.0033898 k( 83) = ( 0.3969184 -0.3103632 0.8459656), wk = 0.0033898 k( 84) = ( 0.3803801 -0.2974314 0.8459656), wk = 0.0033898 k( 85) = ( 0.3638418 -0.2844996 0.8459656), wk = 0.0033898 k( 86) = ( 0.3473036 -0.2715678 0.8459656), wk = 0.0033898 k( 87) = ( 0.3307653 -0.2586360 0.8459656), wk = 0.0033898 k( 88) = ( 0.3142270 -0.2457042 0.8459656), wk = 0.0033898 k( 89) = ( 0.2976888 -0.2327724 0.8459656), wk = 0.0033898 k( 90) = ( 0.2811505 -0.2198406 0.8459656), wk = 0.0033898 k( 91) = ( 0.2646122 -0.2069088 0.8459656), wk = 0.0033898 k( 92) = ( 0.2480740 -0.1939770 0.8459656), wk = 0.0033898 k( 93) = ( 0.2315357 -0.1810452 0.8459656), wk = 0.0033898 k( 94) = ( 0.2149974 -0.1681134 0.8459656), wk = 0.0033898 k( 95) = ( 0.1984592 -0.1551816 0.8459656), wk = 0.0033898 k( 96) = ( 0.1819209 -0.1422498 0.8459656), wk = 0.0033898 k( 97) = ( 0.1653826 -0.1293180 0.8459656), wk = 0.0033898 k( 98) = ( 0.1488444 -0.1163862 0.8459656), wk = 0.0033898 k( 99) = ( 0.1323061 -0.1034544 0.8459656), wk = 0.0033898 k( 100) = ( 0.1157679 -0.0905226 0.8459656), wk = 0.0033898 k( 101) = ( 0.0992296 -0.0775908 0.8459656), wk = 0.0033898 k( 102) = ( 0.0826913 -0.0646590 0.8459656), wk = 0.0033898 k( 103) = ( 0.0661531 -0.0517272 0.8459656), wk = 0.0033898 k( 104) = ( 0.0496148 -0.0387954 0.8459656), wk = 0.0033898 k( 105) = ( 0.0330765 -0.0258636 0.8459656), wk = 0.0033898 k( 106) = ( 0.0165383 -0.0129318 0.8459656), wk = 0.0033898 k( 107) = ( 0.0000000 0.0000000 0.8459656), wk = 0.0033898 k( 108) = ( 0.0000000 0.0000000 0.8459656), wk = 0.0033898 k( 109) = ( 0.0126397 0.0161648 0.8459656), wk = 0.0033898 k( 110) = ( 0.0252795 0.0323295 0.8459656), wk = 0.0033898 k( 111) = ( 0.0379192 0.0484943 0.8459656), wk = 0.0033898 k( 112) = ( 0.0505589 0.0646590 0.8459656), wk = 0.0033898 k( 113) = ( 0.0631987 0.0808237 0.8459656), wk = 0.0033898 k( 114) = ( 0.0758384 0.0969885 0.8459656), wk = 0.0033898 k( 115) = ( 0.0884782 0.1131532 0.8459656), wk = 0.0033898 k( 116) = ( 0.1011179 0.1293180 0.8459656), wk = 0.0033898 k( 117) = ( 0.1137576 0.1454827 0.8459656), wk = 0.0033898 k( 118) = ( 0.1263974 0.1616475 0.8459656), wk = 0.0033898 k( 119) = ( 0.1390371 0.1778122 0.8459656), wk = 0.0033898 k( 120) = ( 0.1516768 0.1939770 0.8459656), wk = 0.0033898 k( 121) = ( 0.1643166 0.2101417 0.8459656), wk = 0.0033898 k( 122) = ( 0.1769563 0.2263065 0.8459656), wk = 0.0033898 k( 123) = ( 0.1895960 0.2424712 0.8459656), wk = 0.0033898 k( 124) = ( 0.2022358 0.2586360 0.8459656), wk = 0.0033898 k( 125) = ( 0.2148755 0.2748007 0.8459656), wk = 0.0033898 k( 126) = ( 0.2275152 0.2909655 0.8459656), wk = 0.0033898 k( 127) = ( 0.2401550 0.3071302 0.8459656), wk = 0.0033898 k( 128) = ( 0.2527947 0.3232950 0.8459656), wk = 0.0033898 k( 129) = ( 0.2527947 0.3232950 0.8459656), wk = 0.0033898 k( 130) = ( 0.2639428 0.3375521 0.8355600), wk = 0.0033898 k( 131) = ( 0.2750908 0.3518091 0.8251544), wk = 0.0033898 k( 132) = ( 0.2862389 0.3660662 0.8147489), wk = 0.0033898 k( 133) = ( 0.2973869 0.3803232 0.8043433), wk = 0.0033898 k( 134) = ( 0.3085350 0.3945803 0.7939377), wk = 0.0033898 k( 135) = ( 0.3196830 0.4088374 0.7835322), wk = 0.0033898 k( 136) = ( 0.3308311 0.4230944 0.7731266), wk = 0.0033898 k( 137) = ( 0.3419791 0.4373515 0.7627210), wk = 0.0033898 k( 138) = ( 0.3531272 0.4516085 0.7523155), wk = 0.0033898 k( 139) = ( 0.3642752 0.4658656 0.7419099), wk = 0.0033898 k( 140) = ( 0.3754233 0.4801226 0.7315043), wk = 0.0033898 k( 141) = ( 0.3865713 0.4943797 0.7210988), wk = 0.0033898 k( 142) = ( 0.3977194 0.5086368 0.7106932), wk = 0.0033898 k( 143) = ( 0.4088674 0.5228938 0.7002876), wk = 0.0033898 k( 144) = ( 0.4200155 0.5371509 0.6898821), wk = 0.0033898 k( 145) = ( 0.4311636 0.5514079 0.6794765), wk = 0.0033898 k( 146) = ( 0.4423116 0.5656650 0.6690709), wk = 0.0033898 k( 147) = ( 0.4534596 0.5799221 0.6586653), wk = 0.0033898 k( 148) = ( 0.4646077 0.5941791 0.6482598), wk = 0.0033898 k( 149) = ( 0.7472053 -0.0748193 0.5658347), wk = 0.0033898 k( 150) = ( 0.7430494 -0.0801341 0.5462851), wk = 0.0033898 k( 151) = ( 0.7388936 -0.0854490 0.5267354), wk = 0.0033898 k( 152) = ( 0.7347377 -0.0907638 0.5071858), wk = 0.0033898 k( 153) = ( 0.7305819 -0.0960786 0.4876362), wk = 0.0033898 k( 154) = ( 0.7264261 -0.1013935 0.4680865), wk = 0.0033898 k( 155) = ( 0.7222702 -0.1067083 0.4485369), wk = 0.0033898 k( 156) = ( 0.7181144 -0.1120232 0.4289873), wk = 0.0033898 k( 157) = ( 0.7139585 -0.1173380 0.4094376), wk = 0.0033898 k( 158) = ( 0.7098027 -0.1226529 0.3898880), wk = 0.0033898 k( 159) = ( 0.7056468 -0.1279677 0.3703384), wk = 0.0033898 k( 160) = ( 0.7014910 -0.1332826 0.3507887), wk = 0.0033898 k( 161) = ( 0.6973351 -0.1385974 0.3312391), wk = 0.0033898 k( 162) = ( 0.6931793 -0.1439122 0.3116895), wk = 0.0033898 k( 163) = ( 0.6890234 -0.1492271 0.2921398), wk = 0.0033898 k( 164) = ( 0.6848676 -0.1545419 0.2725902), wk = 0.0033898 k( 165) = ( 0.6807117 -0.1598568 0.2530405), wk = 0.0033898 k( 166) = ( 0.6765559 -0.1651716 0.2334909), wk = 0.0033898 k( 167) = ( 0.6724000 -0.1704865 0.2139413), wk = 0.0033898 k( 168) = ( 0.6682442 -0.1758013 0.1943916), wk = 0.0033898 k( 169) = ( 0.6640883 -0.1811161 0.1748420), wk = 0.0033898 k( 170) = ( 0.6599325 -0.1864310 0.1552924), wk = 0.0033898 k( 171) = ( 0.6557767 -0.1917458 0.1357427), wk = 0.0033898 k( 172) = ( 0.6516208 -0.1970607 0.1161931), wk = 0.0033898 k( 173) = ( 0.6474650 -0.2023755 0.0966435), wk = 0.0033898 k( 174) = ( 0.6433091 -0.2076904 0.0770938), wk = 0.0033898 k( 175) = ( 0.6391533 -0.2130052 0.0575442), wk = 0.0033898 k( 176) = ( 0.6349974 -0.2183201 0.0379945), wk = 0.0033898 k( 177) = ( 0.6308416 -0.2236349 0.0184449), wk = 0.0033898 k( 178) = ( 0.6266857 -0.2289497 -0.0011047), wk = 0.0033898 k( 179) = ( 0.6225299 -0.2342646 -0.0206544), wk = 0.0033898 k( 180) = ( 0.6183740 -0.2395794 -0.0402040), wk = 0.0033898 k( 181) = ( 0.6142182 -0.2448943 -0.0597536), wk = 0.0033898 k( 182) = ( 0.6100623 -0.2502091 -0.0793033), wk = 0.0033898 k( 183) = ( 0.6059065 -0.2555240 -0.0988529), wk = 0.0033898 k( 184) = ( 0.6059065 -0.2555240 -0.0988529), wk = 0.0033898 k( 185) = ( 0.5953158 -0.2690682 -0.0889676), wk = 0.0033898 k( 186) = ( 0.5847252 -0.2826124 -0.0790823), wk = 0.0033898 k( 187) = ( 0.5741346 -0.2961566 -0.0691970), wk = 0.0033898 k( 188) = ( 0.5635439 -0.3097008 -0.0593117), wk = 0.0033898 k( 189) = ( 0.5529532 -0.3232450 -0.0494265), wk = 0.0033898 k( 190) = ( 0.5423626 -0.3367892 -0.0395412), wk = 0.0033898 k( 191) = ( 0.5317719 -0.3503334 -0.0296559), wk = 0.0033898 k( 192) = ( 0.5211813 -0.3638776 -0.0197706), wk = 0.0033898 k( 193) = ( 0.5105907 -0.3774218 -0.0098853), wk = 0.0033898 k( 194) = ( 0.5000000 -0.3909660 0.0000000), wk = 0.0033898 k( 195) = ( 0.5000000 -0.3909660 0.0000000), wk = 0.0033898 k( 196) = ( 0.4833333 -0.3779338 0.0000000), wk = 0.0033898 k( 197) = ( 0.4666667 -0.3649016 -0.0000000), wk = 0.0033898 k( 198) = ( 0.4500000 -0.3518694 0.0000000), wk = 0.0033898 k( 199) = ( 0.4333333 -0.3388372 -0.0000000), wk = 0.0033898 k( 200) = ( 0.4166667 -0.3258050 0.0000000), wk = 0.0033898 k( 201) = ( 0.4000000 -0.3127728 -0.0000000), wk = 0.0033898 k( 202) = ( 0.3833333 -0.2997406 0.0000000), wk = 0.0033898 k( 203) = ( 0.3666667 -0.2867084 -0.0000000), wk = 0.0033898 k( 204) = ( 0.3500000 -0.2736762 0.0000000), wk = 0.0033898 k( 205) = ( 0.3333333 -0.2606440 -0.0000000), wk = 0.0033898 k( 206) = ( 0.3166667 -0.2476118 0.0000000), wk = 0.0033898 k( 207) = ( 0.3000000 -0.2345796 -0.0000000), wk = 0.0033898 k( 208) = ( 0.2833333 -0.2215474 0.0000000), wk = 0.0033898 k( 209) = ( 0.2666667 -0.2085152 -0.0000000), wk = 0.0033898 k( 210) = ( 0.2500000 -0.1954830 0.0000000), wk = 0.0033898 k( 211) = ( 0.2333333 -0.1824508 0.0000000), wk = 0.0033898 k( 212) = ( 0.2166667 -0.1694186 -0.0000000), wk = 0.0033898 k( 213) = ( 0.2000000 -0.1563864 -0.0000000), wk = 0.0033898 k( 214) = ( 0.1833333 -0.1433542 -0.0000000), wk = 0.0033898 k( 215) = ( 0.1666667 -0.1303220 -0.0000000), wk = 0.0033898 k( 216) = ( 0.1500000 -0.1172898 -0.0000000), wk = 0.0033898 k( 217) = ( 0.1333333 -0.1042576 -0.0000000), wk = 0.0033898 k( 218) = ( 0.1166667 -0.0912254 0.0000000), wk = 0.0033898 k( 219) = ( 0.1000000 -0.0781932 -0.0000000), wk = 0.0033898 k( 220) = ( 0.0833333 -0.0651610 -0.0000000), wk = 0.0033898 k( 221) = ( 0.0666667 -0.0521288 0.0000000), wk = 0.0033898 k( 222) = ( 0.0500000 -0.0390966 -0.0000000), wk = 0.0033898 k( 223) = ( 0.0333333 -0.0260644 -0.0000000), wk = 0.0033898 k( 224) = ( 0.0166667 -0.0130322 -0.0000000), wk = 0.0033898 k( 225) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 226) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 227) = ( 0.0192308 0.0047784 -0.0053871), wk = 0.0033898 k( 228) = ( 0.0384615 0.0095568 -0.0107743), wk = 0.0033898 k( 229) = ( 0.0576923 0.0143351 -0.0161614), wk = 0.0033898 k( 230) = ( 0.0769231 0.0191135 -0.0215485), wk = 0.0033898 k( 231) = ( 0.0961538 0.0238919 -0.0269357), wk = 0.0033898 k( 232) = ( 0.1153846 0.0286703 -0.0323228), wk = 0.0033898 k( 233) = ( 0.1346154 0.0334487 -0.0377099), wk = 0.0033898 k( 234) = ( 0.1538461 0.0382270 -0.0430971), wk = 0.0033898 k( 235) = ( 0.1730769 0.0430054 -0.0484842), wk = 0.0033898 k( 236) = ( 0.1923077 0.0477838 -0.0538713), wk = 0.0033898 k( 237) = ( 0.2115385 0.0525622 -0.0592585), wk = 0.0033898 k( 238) = ( 0.2307692 0.0573406 -0.0646456), wk = 0.0033898 k( 239) = ( 0.2500000 0.0621189 -0.0700327), wk = 0.0033898 k( 240) = ( 0.2692308 0.0668973 -0.0754198), wk = 0.0033898 k( 241) = ( 0.2884615 0.0716757 -0.0808070), wk = 0.0033898 k( 242) = ( 0.3076923 0.0764541 -0.0861941), wk = 0.0033898 k( 243) = ( 0.3269231 0.0812324 -0.0915812), wk = 0.0033898 k( 244) = ( 0.3461538 0.0860108 -0.0969684), wk = 0.0033898 k( 245) = ( 0.3653846 0.0907892 -0.1023555), wk = 0.0033898 k( 246) = ( 0.3846154 0.0955676 -0.1077426), wk = 0.0033898 k( 247) = ( 0.4038462 0.1003460 -0.1131298), wk = 0.0033898 k( 248) = ( 0.4230769 0.1051243 -0.1185169), wk = 0.0033898 k( 249) = ( 0.4423077 0.1099027 -0.1239040), wk = 0.0033898 k( 250) = ( 0.4615385 0.1146811 -0.1292912), wk = 0.0033898 k( 251) = ( 0.4807692 0.1194595 -0.1346783), wk = 0.0033898 k( 252) = ( 0.5000000 0.1242379 -0.1400654), wk = 0.0033898 k( 253) = ( 0.5000000 0.1242379 0.7059002), wk = 0.0033898 k( 254) = ( 0.4880952 0.1212798 0.6890930), wk = 0.0033898 k( 255) = ( 0.4761905 0.1183218 0.6722859), wk = 0.0033898 k( 256) = ( 0.4642857 0.1153637 0.6554787), wk = 0.0033898 k( 257) = ( 0.4523810 0.1124057 0.6386716), wk = 0.0033898 k( 258) = ( 0.4404762 0.1094476 0.6218644), wk = 0.0033898 k( 259) = ( 0.4285714 0.1064896 0.6050573), wk = 0.0033898 k( 260) = ( 0.4166667 0.1035316 0.5882501), wk = 0.0033898 k( 261) = ( 0.4047619 0.1005735 0.5714430), wk = 0.0033898 k( 262) = ( 0.3928571 0.0976155 0.5546358), wk = 0.0033898 k( 263) = ( 0.3809524 0.0946574 0.5378287), wk = 0.0033898 k( 264) = ( 0.3690476 0.0916994 0.5210215), wk = 0.0033898 k( 265) = ( 0.3571429 0.0887413 0.5042144), wk = 0.0033898 k( 266) = ( 0.3452381 0.0857833 0.4874073), wk = 0.0033898 k( 267) = ( 0.3333333 0.0828252 0.4706001), wk = 0.0033898 k( 268) = ( 0.3214286 0.0798672 0.4537930), wk = 0.0033898 k( 269) = ( 0.3095238 0.0769092 0.4369858), wk = 0.0033898 k( 270) = ( 0.2976190 0.0739511 0.4201787), wk = 0.0033898 k( 271) = ( 0.2857143 0.0709931 0.4033715), wk = 0.0033898 k( 272) = ( 0.2738095 0.0680350 0.3865644), wk = 0.0033898 k( 273) = ( 0.2619048 0.0650770 0.3697572), wk = 0.0033898 k( 274) = ( 0.2500000 0.0621189 0.3529501), wk = 0.0033898 k( 275) = ( 0.2380952 0.0591609 0.3361429), wk = 0.0033898 k( 276) = ( 0.2261905 0.0562028 0.3193358), wk = 0.0033898 k( 277) = ( 0.2142857 0.0532448 0.3025286), wk = 0.0033898 k( 278) = ( 0.2023810 0.0502868 0.2857215), wk = 0.0033898 k( 279) = ( 0.1904762 0.0473287 0.2689143), wk = 0.0033898 k( 280) = ( 0.1785714 0.0443707 0.2521072), wk = 0.0033898 k( 281) = ( 0.1666667 0.0414126 0.2353001), wk = 0.0033898 k( 282) = ( 0.1547619 0.0384546 0.2184929), wk = 0.0033898 k( 283) = ( 0.1428571 0.0354965 0.2016858), wk = 0.0033898 k( 284) = ( 0.1309524 0.0325385 0.1848786), wk = 0.0033898 k( 285) = ( 0.1190476 0.0295804 0.1680715), wk = 0.0033898 k( 286) = ( 0.1071429 0.0266224 0.1512643), wk = 0.0033898 k( 287) = ( 0.0952381 0.0236644 0.1344572), wk = 0.0033898 k( 288) = ( 0.0833333 0.0207063 0.1176500), wk = 0.0033898 k( 289) = ( 0.0714286 0.0177483 0.1008429), wk = 0.0033898 k( 290) = ( 0.0595238 0.0147902 0.0840357), wk = 0.0033898 k( 291) = ( 0.0476191 0.0118322 0.0672286), wk = 0.0033898 k( 292) = ( 0.0357143 0.0088741 0.0504214), wk = 0.0033898 k( 293) = ( 0.0238095 0.0059161 0.0336143), wk = 0.0033898 k( 294) = ( 0.0119048 0.0029580 0.0168071), wk = 0.0033898 k( 295) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 2) = ( 0.0123154 0.0123154 0.0007299), wk = 0.0033898 k( 3) = ( 0.0246308 0.0246308 0.0014598), wk = 0.0033898 k( 4) = ( 0.0369463 0.0369463 0.0021897), wk = 0.0033898 k( 5) = ( 0.0492617 0.0492617 0.0029196), wk = 0.0033898 k( 6) = ( 0.0615771 0.0615771 0.0036495), wk = 0.0033898 k( 7) = ( 0.0738925 0.0738925 0.0043793), wk = 0.0033898 k( 8) = ( 0.0862080 0.0862080 0.0051092), wk = 0.0033898 k( 9) = ( 0.0985234 0.0985234 0.0058391), wk = 0.0033898 k( 10) = ( 0.1108388 0.1108388 0.0065690), wk = 0.0033898 k( 11) = ( 0.1231542 0.1231542 0.0072989), wk = 0.0033898 k( 12) = ( 0.1354696 0.1354696 0.0080288), wk = 0.0033898 k( 13) = ( 0.1477851 0.1477851 0.0087587), wk = 0.0033898 k( 14) = ( 0.1601005 0.1601005 0.0094886), wk = 0.0033898 k( 15) = ( 0.1724159 0.1724159 0.0102185), wk = 0.0033898 k( 16) = ( 0.1847313 0.1847313 0.0109484), wk = 0.0033898 k( 17) = ( 0.1970467 0.1970468 0.0116782), wk = 0.0033898 k( 18) = ( 0.2093622 0.2093622 0.0124081), wk = 0.0033898 k( 19) = ( 0.2216776 0.2216776 0.0131380), wk = 0.0033898 k( 20) = ( 0.2339930 0.2339930 0.0138679), wk = 0.0033898 k( 21) = ( 0.2463084 0.2463084 0.0145978), wk = 0.0033898 k( 22) = ( 0.2586239 0.2586239 0.0153277), wk = 0.0033898 k( 23) = ( 0.2709393 0.2709393 0.0160576), wk = 0.0033898 k( 24) = ( 0.2832547 0.2832547 0.0167875), wk = 0.0033898 k( 25) = ( 0.2955701 0.2955701 0.0175174), wk = 0.0033898 k( 26) = ( 0.3078856 0.3078855 0.0182472), wk = 0.0033898 k( 27) = ( 0.3202010 0.3202010 0.0189771), wk = 0.0033898 k( 28) = ( 0.3325164 0.3325164 0.0197070), wk = 0.0033898 k( 29) = ( 0.3448318 0.3448318 0.0204369), wk = 0.0033898 k( 30) = ( 0.3571472 0.3571472 0.0211668), wk = 0.0033898 k( 31) = ( 0.3694627 0.3694627 0.0218967), wk = 0.0033898 k( 32) = ( 0.3817781 0.3817781 0.0226266), wk = 0.0033898 k( 33) = ( 0.3940935 0.3940935 0.0233565), wk = 0.0033898 k( 34) = ( 0.3940935 0.3940935 0.0233565), wk = 0.0033898 k( 35) = ( 0.3982494 0.3982494 0.0362873), wk = 0.0033898 k( 36) = ( 0.4024052 0.4024052 0.0492180), wk = 0.0033898 k( 37) = ( 0.4065610 0.4065610 0.0621488), wk = 0.0033898 k( 38) = ( 0.4107169 0.4107169 0.0750796), wk = 0.0033898 k( 39) = ( 0.4148727 0.4148727 0.0880104), wk = 0.0033898 k( 40) = ( 0.4190286 0.4190286 0.1009412), wk = 0.0033898 k( 41) = ( 0.4231844 0.4231844 0.1138720), wk = 0.0033898 k( 42) = ( 0.4273403 0.4273403 0.1268027), wk = 0.0033898 k( 43) = ( 0.4314961 0.4314961 0.1397335), wk = 0.0033898 k( 44) = ( 0.4356520 0.4356520 0.1526643), wk = 0.0033898 k( 45) = ( 0.4398078 0.4398078 0.1655951), wk = 0.0033898 k( 46) = ( 0.4439637 0.4439637 0.1785259), wk = 0.0033898 k( 47) = ( 0.4481195 0.4481195 0.1914567), wk = 0.0033898 k( 48) = ( 0.4522754 0.4522754 0.2043875), wk = 0.0033898 k( 49) = ( 0.4564312 0.4564312 0.2173183), wk = 0.0033898 k( 50) = ( 0.4605871 0.4605871 0.2302490), wk = 0.0033898 k( 51) = ( 0.4647429 0.4647429 0.2431798), wk = 0.0033898 k( 52) = ( 0.4688987 0.4688987 0.2561106), wk = 0.0033898 k( 53) = ( 0.4730546 0.4730546 0.2690414), wk = 0.0033898 k( 54) = ( 0.4772104 0.4772104 0.2819722), wk = 0.0033898 k( 55) = ( 0.4813663 0.4813663 0.2949029), wk = 0.0033898 k( 56) = ( 0.4855221 0.4855221 0.3078337), wk = 0.0033898 k( 57) = ( 0.4896780 0.4896780 0.3207645), wk = 0.0033898 k( 58) = ( 0.4938338 0.4938338 0.3336953), wk = 0.0033898 k( 59) = ( 0.4979897 0.4979897 0.3466261), wk = 0.0033898 k( 60) = ( 0.5021455 0.5021455 0.3595569), wk = 0.0033898 k( 61) = ( 0.5063014 0.5063014 0.3724877), wk = 0.0033898 k( 62) = ( 0.5104572 0.5104572 0.3854184), wk = 0.0033898 k( 63) = ( 0.5146131 0.5146131 0.3983492), wk = 0.0033898 k( 64) = ( 0.5187689 0.5187689 0.4112800), wk = 0.0033898 k( 65) = ( 0.5229248 0.5229248 0.4242108), wk = 0.0033898 k( 66) = ( 0.5270806 0.5270806 0.4371416), wk = 0.0033898 k( 67) = ( 0.5312364 0.5312365 0.4500724), wk = 0.0033898 k( 68) = ( 0.5353923 0.5353923 0.4630032), wk = 0.0033898 k( 69) = ( 0.5353923 0.5353923 0.4630032), wk = 0.0033898 k( 70) = ( 0.5283138 0.5283138 0.4704025), wk = 0.0033898 k( 71) = ( 0.5212354 0.5212354 0.4778019), wk = 0.0033898 k( 72) = ( 0.5141569 0.5141569 0.4852013), wk = 0.0033898 k( 73) = ( 0.5070785 0.5070785 0.4926006), wk = 0.0033898 k( 74) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033898 k( 75) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0033898 k( 76) = ( 0.5144239 0.4855761 0.5000000), wk = 0.0033898 k( 77) = ( 0.5288478 0.4711522 0.5000000), wk = 0.0033898 k( 78) = ( 0.5432717 0.4567283 0.5000000), wk = 0.0033898 k( 79) = ( 0.5576956 0.4423044 0.5000000), wk = 0.0033898 k( 80) = ( 0.5721195 0.4278805 0.5000000), wk = 0.0033898 k( 81) = ( 0.5865434 0.4134566 0.5000000), wk = 0.0033898 k( 82) = ( 0.4134566 -0.4134566 0.5000000), wk = 0.0033898 k( 83) = ( 0.3969184 -0.3969184 0.5000000), wk = 0.0033898 k( 84) = ( 0.3803801 -0.3803801 0.5000000), wk = 0.0033898 k( 85) = ( 0.3638418 -0.3638418 0.5000000), wk = 0.0033898 k( 86) = ( 0.3473036 -0.3473036 0.5000000), wk = 0.0033898 k( 87) = ( 0.3307653 -0.3307653 0.5000000), wk = 0.0033898 k( 88) = ( 0.3142270 -0.3142270 0.5000000), wk = 0.0033898 k( 89) = ( 0.2976888 -0.2976888 0.5000000), wk = 0.0033898 k( 90) = ( 0.2811505 -0.2811505 0.5000000), wk = 0.0033898 k( 91) = ( 0.2646122 -0.2646122 0.5000000), wk = 0.0033898 k( 92) = ( 0.2480740 -0.2480740 0.5000000), wk = 0.0033898 k( 93) = ( 0.2315357 -0.2315357 0.5000000), wk = 0.0033898 k( 94) = ( 0.2149974 -0.2149974 0.5000000), wk = 0.0033898 k( 95) = ( 0.1984592 -0.1984592 0.5000000), wk = 0.0033898 k( 96) = ( 0.1819209 -0.1819209 0.5000000), wk = 0.0033898 k( 97) = ( 0.1653826 -0.1653826 0.5000000), wk = 0.0033898 k( 98) = ( 0.1488444 -0.1488444 0.5000000), wk = 0.0033898 k( 99) = ( 0.1323061 -0.1323061 0.5000000), wk = 0.0033898 k( 100) = ( 0.1157679 -0.1157679 0.5000000), wk = 0.0033898 k( 101) = ( 0.0992296 -0.0992296 0.5000000), wk = 0.0033898 k( 102) = ( 0.0826913 -0.0826913 0.5000000), wk = 0.0033898 k( 103) = ( 0.0661531 -0.0661531 0.5000000), wk = 0.0033898 k( 104) = ( 0.0496148 -0.0496148 0.5000000), wk = 0.0033898 k( 105) = ( 0.0330765 -0.0330765 0.5000000), wk = 0.0033898 k( 106) = ( 0.0165383 -0.0165383 0.5000000), wk = 0.0033898 k( 107) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033898 k( 108) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033898 k( 109) = ( 0.0126397 0.0126397 0.5041855), wk = 0.0033898 k( 110) = ( 0.0252795 0.0252795 0.5083710), wk = 0.0033898 k( 111) = ( 0.0379192 0.0379192 0.5125565), wk = 0.0033898 k( 112) = ( 0.0505589 0.0505589 0.5167420), wk = 0.0033898 k( 113) = ( 0.0631987 0.0631987 0.5209274), wk = 0.0033898 k( 114) = ( 0.0758384 0.0758384 0.5251129), wk = 0.0033898 k( 115) = ( 0.0884782 0.0884782 0.5292984), wk = 0.0033898 k( 116) = ( 0.1011179 0.1011179 0.5334839), wk = 0.0033898 k( 117) = ( 0.1137576 0.1137576 0.5376694), wk = 0.0033898 k( 118) = ( 0.1263974 0.1263974 0.5418549), wk = 0.0033898 k( 119) = ( 0.1390371 0.1390371 0.5460404), wk = 0.0033898 k( 120) = ( 0.1516768 0.1516768 0.5502259), wk = 0.0033898 k( 121) = ( 0.1643166 0.1643166 0.5544114), wk = 0.0033898 k( 122) = ( 0.1769563 0.1769563 0.5585969), wk = 0.0033898 k( 123) = ( 0.1895960 0.1895960 0.5627823), wk = 0.0033898 k( 124) = ( 0.2022358 0.2022358 0.5669678), wk = 0.0033898 k( 125) = ( 0.2148755 0.2148755 0.5711533), wk = 0.0033898 k( 126) = ( 0.2275152 0.2275152 0.5753388), wk = 0.0033898 k( 127) = ( 0.2401550 0.2401550 0.5795243), wk = 0.0033898 k( 128) = ( 0.2527947 0.2527947 0.5837098), wk = 0.0033898 k( 129) = ( 0.2527947 0.2527947 0.5837098), wk = 0.0033898 k( 130) = ( 0.2639428 0.2639428 0.5812512), wk = 0.0033898 k( 131) = ( 0.2750908 0.2750908 0.5787926), wk = 0.0033898 k( 132) = ( 0.2862389 0.2862389 0.5763341), wk = 0.0033898 k( 133) = ( 0.2973869 0.2973869 0.5738755), wk = 0.0033898 k( 134) = ( 0.3085350 0.3085350 0.5714169), wk = 0.0033898 k( 135) = ( 0.3196830 0.3196830 0.5689583), wk = 0.0033898 k( 136) = ( 0.3308311 0.3308311 0.5664998), wk = 0.0033898 k( 137) = ( 0.3419791 0.3419791 0.5640412), wk = 0.0033898 k( 138) = ( 0.3531272 0.3531272 0.5615826), wk = 0.0033898 k( 139) = ( 0.3642752 0.3642752 0.5591240), wk = 0.0033898 k( 140) = ( 0.3754233 0.3754233 0.5566655), wk = 0.0033898 k( 141) = ( 0.3865713 0.3865713 0.5542069), wk = 0.0033898 k( 142) = ( 0.3977194 0.3977194 0.5517483), wk = 0.0033898 k( 143) = ( 0.4088674 0.4088674 0.5492897), wk = 0.0033898 k( 144) = ( 0.4200155 0.4200155 0.5468312), wk = 0.0033898 k( 145) = ( 0.4311636 0.4311636 0.5443726), wk = 0.0033898 k( 146) = ( 0.4423116 0.4423116 0.5419140), wk = 0.0033898 k( 147) = ( 0.4534596 0.4534596 0.5394554), wk = 0.0033898 k( 148) = ( 0.4646077 0.4646077 0.5369968), wk = 0.0033898 k( 149) = ( 0.7472053 -0.2527947 0.4162902), wk = 0.0033898 k( 150) = ( 0.7430494 -0.2569506 0.4033594), wk = 0.0033898 k( 151) = ( 0.7388936 -0.2611064 0.3904286), wk = 0.0033898 k( 152) = ( 0.7347377 -0.2652622 0.3774979), wk = 0.0033898 k( 153) = ( 0.7305819 -0.2694181 0.3645671), wk = 0.0033898 k( 154) = ( 0.7264261 -0.2735740 0.3516363), wk = 0.0033898 k( 155) = ( 0.7222702 -0.2777298 0.3387055), wk = 0.0033898 k( 156) = ( 0.7181144 -0.2818856 0.3257747), wk = 0.0033898 k( 157) = ( 0.7139585 -0.2860415 0.3128439), wk = 0.0033898 k( 158) = ( 0.7098027 -0.2901973 0.2999132), wk = 0.0033898 k( 159) = ( 0.7056468 -0.2943532 0.2869824), wk = 0.0033898 k( 160) = ( 0.7014910 -0.2985090 0.2740516), wk = 0.0033898 k( 161) = ( 0.6973351 -0.3026649 0.2611208), wk = 0.0033898 k( 162) = ( 0.6931793 -0.3068207 0.2481900), wk = 0.0033898 k( 163) = ( 0.6890234 -0.3109766 0.2352592), wk = 0.0033898 k( 164) = ( 0.6848676 -0.3151324 0.2223284), wk = 0.0033898 k( 165) = ( 0.6807117 -0.3192883 0.2093977), wk = 0.0033898 k( 166) = ( 0.6765559 -0.3234441 0.1964669), wk = 0.0033898 k( 167) = ( 0.6724000 -0.3276000 0.1835361), wk = 0.0033898 k( 168) = ( 0.6682442 -0.3317558 0.1706053), wk = 0.0033898 k( 169) = ( 0.6640883 -0.3359117 0.1576745), wk = 0.0033898 k( 170) = ( 0.6599325 -0.3400675 0.1447437), wk = 0.0033898 k( 171) = ( 0.6557767 -0.3442233 0.1318129), wk = 0.0033898 k( 172) = ( 0.6516208 -0.3483792 0.1188822), wk = 0.0033898 k( 173) = ( 0.6474650 -0.3525350 0.1059514), wk = 0.0033898 k( 174) = ( 0.6433091 -0.3566909 0.0930206), wk = 0.0033898 k( 175) = ( 0.6391533 -0.3608467 0.0800898), wk = 0.0033898 k( 176) = ( 0.6349974 -0.3650026 0.0671590), wk = 0.0033898 k( 177) = ( 0.6308416 -0.3691584 0.0542282), wk = 0.0033898 k( 178) = ( 0.6266857 -0.3733143 0.0412975), wk = 0.0033898 k( 179) = ( 0.6225299 -0.3774701 0.0283667), wk = 0.0033898 k( 180) = ( 0.6183740 -0.3816260 0.0154359), wk = 0.0033898 k( 181) = ( 0.6142182 -0.3857818 0.0025051), wk = 0.0033898 k( 182) = ( 0.6100623 -0.3899377 -0.0104257), wk = 0.0033898 k( 183) = ( 0.6059065 -0.3940935 -0.0233565), wk = 0.0033898 k( 184) = ( 0.6059065 -0.3940935 -0.0233565), wk = 0.0033898 k( 185) = ( 0.5953158 -0.4046842 -0.0210208), wk = 0.0033898 k( 186) = ( 0.5847252 -0.4152748 -0.0186852), wk = 0.0033898 k( 187) = ( 0.5741346 -0.4258655 -0.0163495), wk = 0.0033898 k( 188) = ( 0.5635439 -0.4364561 -0.0140139), wk = 0.0033898 k( 189) = ( 0.5529532 -0.4470467 -0.0116782), wk = 0.0033898 k( 190) = ( 0.5423626 -0.4576374 -0.0093426), wk = 0.0033898 k( 191) = ( 0.5317719 -0.4682281 -0.0070069), wk = 0.0033898 k( 192) = ( 0.5211813 -0.4788187 -0.0046713), wk = 0.0033898 k( 193) = ( 0.5105907 -0.4894094 -0.0023356), wk = 0.0033898 k( 194) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0033898 k( 195) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0033898 k( 196) = ( 0.4833333 -0.4833333 0.0000000), wk = 0.0033898 k( 197) = ( 0.4666667 -0.4666667 0.0000000), wk = 0.0033898 k( 198) = ( 0.4500000 -0.4500000 0.0000000), wk = 0.0033898 k( 199) = ( 0.4333333 -0.4333333 0.0000000), wk = 0.0033898 k( 200) = ( 0.4166667 -0.4166667 0.0000000), wk = 0.0033898 k( 201) = ( 0.4000000 -0.4000000 0.0000000), wk = 0.0033898 k( 202) = ( 0.3833333 -0.3833333 0.0000000), wk = 0.0033898 k( 203) = ( 0.3666667 -0.3666667 0.0000000), wk = 0.0033898 k( 204) = ( 0.3500000 -0.3500000 0.0000000), wk = 0.0033898 k( 205) = ( 0.3333333 -0.3333333 0.0000000), wk = 0.0033898 k( 206) = ( 0.3166667 -0.3166667 0.0000000), wk = 0.0033898 k( 207) = ( 0.3000000 -0.3000000 0.0000000), wk = 0.0033898 k( 208) = ( 0.2833333 -0.2833333 0.0000000), wk = 0.0033898 k( 209) = ( 0.2666667 -0.2666667 0.0000000), wk = 0.0033898 k( 210) = ( 0.2500000 -0.2500000 0.0000000), wk = 0.0033898 k( 211) = ( 0.2333333 -0.2333333 0.0000000), wk = 0.0033898 k( 212) = ( 0.2166667 -0.2166667 0.0000000), wk = 0.0033898 k( 213) = ( 0.2000000 -0.2000000 0.0000000), wk = 0.0033898 k( 214) = ( 0.1833333 -0.1833333 0.0000000), wk = 0.0033898 k( 215) = ( 0.1666667 -0.1666667 0.0000000), wk = 0.0033898 k( 216) = ( 0.1500000 -0.1500000 0.0000000), wk = 0.0033898 k( 217) = ( 0.1333333 -0.1333333 0.0000000), wk = 0.0033898 k( 218) = ( 0.1166667 -0.1166667 0.0000000), wk = 0.0033898 k( 219) = ( 0.1000000 -0.1000000 0.0000000), wk = 0.0033898 k( 220) = ( 0.0833333 -0.0833333 0.0000000), wk = 0.0033898 k( 221) = ( 0.0666667 -0.0666667 0.0000000), wk = 0.0033898 k( 222) = ( 0.0500000 -0.0500000 0.0000000), wk = 0.0033898 k( 223) = ( 0.0333333 -0.0333333 0.0000000), wk = 0.0033898 k( 224) = ( 0.0166667 -0.0166667 0.0000000), wk = 0.0033898 k( 225) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 226) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 k( 227) = ( 0.0192308 0.0000000 0.0000000), wk = 0.0033898 k( 228) = ( 0.0384615 0.0000000 0.0000000), wk = 0.0033898 k( 229) = ( 0.0576923 0.0000000 0.0000000), wk = 0.0033898 k( 230) = ( 0.0769231 0.0000000 0.0000000), wk = 0.0033898 k( 231) = ( 0.0961538 0.0000000 0.0000000), wk = 0.0033898 k( 232) = ( 0.1153846 0.0000000 0.0000000), wk = 0.0033898 k( 233) = ( 0.1346154 0.0000000 0.0000000), wk = 0.0033898 k( 234) = ( 0.1538461 0.0000000 0.0000000), wk = 0.0033898 k( 235) = ( 0.1730769 0.0000000 0.0000000), wk = 0.0033898 k( 236) = ( 0.1923077 0.0000000 0.0000000), wk = 0.0033898 k( 237) = ( 0.2115385 -0.0000000 0.0000000), wk = 0.0033898 k( 238) = ( 0.2307692 -0.0000000 0.0000000), wk = 0.0033898 k( 239) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0033898 k( 240) = ( 0.2692308 0.0000000 0.0000000), wk = 0.0033898 k( 241) = ( 0.2884615 -0.0000000 0.0000000), wk = 0.0033898 k( 242) = ( 0.3076923 0.0000000 0.0000000), wk = 0.0033898 k( 243) = ( 0.3269231 -0.0000000 0.0000000), wk = 0.0033898 k( 244) = ( 0.3461538 0.0000000 0.0000000), wk = 0.0033898 k( 245) = ( 0.3653846 -0.0000000 0.0000000), wk = 0.0033898 k( 246) = ( 0.3846154 0.0000000 0.0000000), wk = 0.0033898 k( 247) = ( 0.4038462 0.0000000 0.0000000), wk = 0.0033898 k( 248) = ( 0.4230769 -0.0000000 0.0000000), wk = 0.0033898 k( 249) = ( 0.4423077 0.0000000 -0.0000000), wk = 0.0033898 k( 250) = ( 0.4615385 -0.0000000 0.0000000), wk = 0.0033898 k( 251) = ( 0.4807692 0.0000000 -0.0000000), wk = 0.0033898 k( 252) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0033898 k( 253) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0033898 k( 254) = ( 0.4880952 -0.0000000 0.4880952), wk = 0.0033898 k( 255) = ( 0.4761905 0.0000000 0.4761905), wk = 0.0033898 k( 256) = ( 0.4642857 0.0000000 0.4642857), wk = 0.0033898 k( 257) = ( 0.4523810 0.0000000 0.4523810), wk = 0.0033898 k( 258) = ( 0.4404762 0.0000000 0.4404762), wk = 0.0033898 k( 259) = ( 0.4285714 0.0000000 0.4285714), wk = 0.0033898 k( 260) = ( 0.4166667 0.0000000 0.4166667), wk = 0.0033898 k( 261) = ( 0.4047619 0.0000000 0.4047619), wk = 0.0033898 k( 262) = ( 0.3928571 0.0000000 0.3928571), wk = 0.0033898 k( 263) = ( 0.3809524 0.0000000 0.3809524), wk = 0.0033898 k( 264) = ( 0.3690476 0.0000000 0.3690476), wk = 0.0033898 k( 265) = ( 0.3571429 0.0000000 0.3571429), wk = 0.0033898 k( 266) = ( 0.3452381 -0.0000000 0.3452381), wk = 0.0033898 k( 267) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0033898 k( 268) = ( 0.3214286 -0.0000000 0.3214286), wk = 0.0033898 k( 269) = ( 0.3095238 -0.0000000 0.3095238), wk = 0.0033898 k( 270) = ( 0.2976190 0.0000000 0.2976190), wk = 0.0033898 k( 271) = ( 0.2857143 0.0000000 0.2857143), wk = 0.0033898 k( 272) = ( 0.2738095 -0.0000000 0.2738095), wk = 0.0033898 k( 273) = ( 0.2619048 -0.0000000 0.2619048), wk = 0.0033898 k( 274) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0033898 k( 275) = ( 0.2380952 0.0000000 0.2380952), wk = 0.0033898 k( 276) = ( 0.2261905 0.0000000 0.2261905), wk = 0.0033898 k( 277) = ( 0.2142857 -0.0000000 0.2142857), wk = 0.0033898 k( 278) = ( 0.2023810 0.0000000 0.2023810), wk = 0.0033898 k( 279) = ( 0.1904762 0.0000000 0.1904762), wk = 0.0033898 k( 280) = ( 0.1785714 0.0000000 0.1785714), wk = 0.0033898 k( 281) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0033898 k( 282) = ( 0.1547619 0.0000000 0.1547619), wk = 0.0033898 k( 283) = ( 0.1428571 -0.0000000 0.1428571), wk = 0.0033898 k( 284) = ( 0.1309524 -0.0000000 0.1309524), wk = 0.0033898 k( 285) = ( 0.1190476 0.0000000 0.1190476), wk = 0.0033898 k( 286) = ( 0.1071429 0.0000000 0.1071429), wk = 0.0033898 k( 287) = ( 0.0952381 -0.0000000 0.0952381), wk = 0.0033898 k( 288) = ( 0.0833333 -0.0000000 0.0833333), wk = 0.0033898 k( 289) = ( 0.0714286 -0.0000000 0.0714286), wk = 0.0033898 k( 290) = ( 0.0595238 0.0000000 0.0595238), wk = 0.0033898 k( 291) = ( 0.0476191 -0.0000000 0.0476191), wk = 0.0033898 k( 292) = ( 0.0357143 -0.0000000 0.0357143), wk = 0.0033898 k( 293) = ( 0.0238095 0.0000000 0.0238095), wk = 0.0033898 k( 294) = ( 0.0119048 0.0000000 0.0119048), wk = 0.0033898 k( 295) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033898 Dense grid: 115701 G-vectors FFT dimensions: ( 75, 75, 45) Smooth grid: 50499 G-vectors FFT dimensions: ( 60, 60, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.37 Mb ( 348, 70) NL pseudopotentials 0.41 Mb ( 174, 156) Each V/rho on FFT grid 0.17 Mb ( 11250) Each G-vector array 0.02 Mb ( 3214) G-vector shells 0.02 Mb ( 3106) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.49 Mb ( 348, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.33 Mb ( 156, 2, 70) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./H4C2NO2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.0 secs Computing kpt #: 2 total cpu time spent up to now is 4.9 secs Computing kpt #: 3 total cpu time spent up to now is 5.9 secs Computing kpt #: 4 total cpu time spent up to now is 6.8 secs Computing kpt #: 5 total cpu time spent up to now is 7.8 secs Computing kpt #: 6 total cpu time spent up to now is 8.7 secs Computing kpt #: 7 total cpu time spent up to now is 9.7 secs Computing kpt #: 8 total cpu time spent up to now is 10.7 secs Computing kpt #: 9 total cpu time spent up to now is 11.6 secs Computing kpt #: 10 total cpu time spent up to now is 12.6 secs Computing kpt #: 11 total cpu time spent up to now is 13.6 secs Computing kpt #: 12 total cpu time spent up to now is 14.5 secs Computing kpt #: 13 total cpu time spent up to now is 15.5 secs Computing kpt #: 14 total cpu time spent up to now is 16.4 secs Computing kpt #: 15 total cpu time spent up to now is 17.3 secs Computing kpt #: 16 total cpu time spent up to now is 18.2 secs Computing kpt #: 17 total cpu time spent up to now is 19.1 secs Computing kpt #: 18 total cpu time spent up to now is 20.0 secs Computing kpt #: 19 total cpu time spent up to now is 20.9 secs Computing kpt #: 20 total cpu time spent up to now is 21.8 secs Computing kpt #: 21 total cpu time spent up to now is 22.6 secs Computing kpt #: 22 total cpu time spent up to now is 23.3 secs Computing kpt #: 23 total cpu time spent up to now is 24.1 secs Computing kpt #: 24 total cpu time spent up to now is 24.9 secs Computing kpt #: 25 total cpu time spent up to now is 25.7 secs Computing kpt #: 26 total cpu time spent up to now is 26.4 secs Computing kpt #: 27 total cpu time spent up to now is 27.2 secs Computing kpt #: 28 total cpu time spent up to now is 27.9 secs Computing kpt #: 29 total cpu time spent up to now is 28.7 secs Computing kpt #: 30 total cpu time spent up to now is 29.4 secs Computing kpt #: 31 total cpu time spent up to now is 30.1 secs Computing kpt #: 32 total cpu time spent up to now is 30.9 secs Computing kpt #: 33 total cpu time spent up to now is 31.6 secs Computing kpt #: 34 total cpu time spent up to now is 32.4 secs Computing kpt #: 35 total cpu time spent up to now is 33.1 secs Computing kpt #: 36 total cpu time spent up to now is 33.8 secs Computing kpt #: 37 total cpu time spent up to now is 34.6 secs Computing kpt #: 38 total cpu time spent up to now is 35.3 secs Computing kpt #: 39 total cpu time spent up to now is 36.0 secs Computing kpt #: 40 total cpu time spent up to now is 36.8 secs Computing kpt #: 41 total cpu time spent up to now is 37.5 secs Computing kpt #: 42 total cpu time spent up to now is 38.3 secs Computing kpt #: 43 total cpu time spent up to now is 39.0 secs Computing kpt #: 44 total cpu time spent up to now is 39.8 secs Computing kpt #: 45 total cpu time spent up to now is 40.5 secs Computing kpt #: 46 total cpu time spent up to now is 41.3 secs Computing kpt #: 47 total cpu time spent up to now is 42.1 secs Computing kpt #: 48 total cpu time spent up to now is 42.9 secs Computing kpt #: 49 total cpu time spent up to now is 43.7 secs Computing kpt #: 50 total cpu time spent up to now is 44.5 secs Computing kpt #: 51 total cpu time spent up to now is 45.3 secs Computing kpt #: 52 total cpu time spent up to now is 46.1 secs Computing kpt #: 53 total cpu time spent up to now is 46.9 secs Computing kpt #: 54 total cpu time spent up to now is 47.7 secs Computing kpt #: 55 total cpu time spent up to now is 48.6 secs Computing kpt #: 56 total cpu time spent up to now is 49.4 secs Computing kpt #: 57 total cpu time spent up to now is 50.2 secs Computing kpt #: 58 total cpu time spent up to now is 51.0 secs Computing kpt #: 59 total cpu time spent up to now is 51.9 secs Computing kpt #: 60 total cpu time spent up to now is 52.7 secs Computing kpt #: 61 total cpu time spent up to now is 53.5 secs Computing kpt #: 62 total cpu time spent up to now is 54.3 secs Computing kpt #: 63 total cpu time spent up to now is 55.2 secs Computing kpt #: 64 total cpu time spent up to now is 56.1 secs Computing kpt #: 65 total cpu time spent up to now is 57.0 secs Computing kpt #: 66 total cpu time spent up to now is 57.9 secs Computing kpt #: 67 total cpu time spent up to now is 58.8 secs Computing kpt #: 68 total cpu time spent up to now is 59.7 secs Computing kpt #: 69 total cpu time spent up to now is 60.6 secs Computing kpt #: 70 total cpu time spent up to now is 61.5 secs Computing kpt #: 71 total cpu time spent up to now is 62.4 secs Computing kpt #: 72 total cpu time spent up to now is 63.8 secs Computing kpt #: 73 total cpu time spent up to now is 64.9 secs Computing kpt #: 74 total cpu time spent up to now is 65.9 secs Computing kpt #: 75 total cpu time spent up to now is 66.9 secs Computing kpt #: 76 total cpu time spent up to now is 68.1 secs Computing kpt #: 77 total cpu time spent up to now is 70.3 secs Computing kpt #: 78 total cpu time spent up to now is 71.2 secs Computing kpt #: 79 total cpu time spent up to now is 72.2 secs Computing kpt #: 80 total cpu time spent up to now is 73.1 secs Computing kpt #: 81 total cpu time spent up to now is 74.0 secs Computing kpt #: 82 total cpu time spent up to now is 74.9 secs Computing kpt #: 83 total cpu time spent up to now is 75.8 secs Computing kpt #: 84 total cpu time spent up to now is 76.7 secs Computing kpt #: 85 total cpu time spent up to now is 77.7 secs Computing kpt #: 86 total cpu time spent up to now is 78.6 secs Computing kpt #: 87 total cpu time spent up to now is 79.5 secs Computing kpt #: 88 total cpu time spent up to now is 80.4 secs Computing kpt #: 89 total cpu time spent up to now is 81.4 secs Computing kpt #: 90 total cpu time spent up to now is 82.3 secs Computing kpt #: 91 total cpu time spent up to now is 83.3 secs Computing kpt #: 92 total cpu time spent up to now is 84.4 secs Computing kpt #: 93 total cpu time spent up to now is 85.4 secs Computing kpt #: 94 total cpu time spent up to now is 86.7 secs Computing kpt #: 95 total cpu time spent up to now is 88.2 secs Computing kpt #: 96 total cpu time spent up to now is 89.9 secs Computing kpt #: 97 total cpu time spent up to now is 91.7 secs Computing kpt #: 98 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 94.0 secs Computing kpt #: 99 total cpu time spent up to now is 95.3 secs Computing kpt #: 100 total cpu time spent up to now is 96.5 secs Computing kpt #: 101 total cpu time spent up to now is 97.8 secs Computing kpt #: 102 total cpu time spent up to now is 98.8 secs Computing kpt #: 103 total cpu time spent up to now is 99.7 secs Computing kpt #: 104 total cpu time spent up to now is 100.9 secs Computing kpt #: 105 total cpu time spent up to now is 101.8 secs Computing kpt #: 106 total cpu time spent up to now is 102.7 secs Computing kpt #: 107 total cpu time spent up to now is 103.7 secs Computing kpt #: 108 total cpu time spent up to now is 104.6 secs Computing kpt #: 109 total cpu time spent up to now is 105.9 secs Computing kpt #: 110 total cpu time spent up to now is 107.2 secs Computing kpt #: 111 total cpu time spent up to now is 108.6 secs Computing kpt #: 112 total cpu time spent up to now is 109.9 secs Computing kpt #: 113 total cpu time spent up to now is 111.2 secs Computing kpt #: 114 total cpu time spent up to now is 112.4 secs Computing kpt #: 115 total cpu time spent up to now is 113.6 secs Computing kpt #: 116 total cpu time spent up to now is 114.9 secs Computing kpt #: 117 total cpu time spent up to now is 116.1 secs Computing kpt #: 118 total cpu time spent up to now is 117.1 secs Computing kpt #: 119 total cpu time spent up to now is 118.3 secs Computing kpt #: 120 total cpu time spent up to now is 119.5 secs Computing kpt #: 121 total cpu time spent up to now is 120.6 secs Computing kpt #: 122 total cpu time spent up to now is 121.8 secs Computing kpt #: 123 total cpu time spent up to now is 123.4 secs Computing kpt #: 124 total cpu time spent up to now is 124.4 secs Computing kpt #: 125 total cpu time spent up to now is 125.6 secs Computing kpt #: 126 total cpu time spent up to now is 126.7 secs Computing kpt #: 127 total cpu time spent up to now is 127.7 secs Computing kpt #: 128 total cpu time spent up to now is 128.8 secs Computing kpt #: 129 total cpu time spent up to now is 129.8 secs Computing kpt #: 130 total cpu time spent up to now is 130.8 secs Computing kpt #: 131 total cpu time spent up to now is 131.8 secs Computing kpt #: 132 total cpu time spent up to now is 132.7 secs Computing kpt #: 133 total cpu time spent up to now is 133.7 secs Computing kpt #: 134 total cpu time spent up to now is 134.6 secs Computing kpt #: 135 total cpu time spent up to now is 135.5 secs Computing kpt #: 136 total cpu time spent up to now is 136.4 secs Computing kpt #: 137 total cpu time spent up to now is 137.3 secs Computing kpt #: 138 total cpu time spent up to now is 138.2 secs Computing kpt #: 139 total cpu time spent up to now is 139.1 secs Computing kpt #: 140 total cpu time spent up to now is 140.0 secs Computing kpt #: 141 total cpu time spent up to now is 140.9 secs Computing kpt #: 142 total cpu time spent up to now is 141.8 secs Computing kpt #: 143 total cpu time spent up to now is 142.7 secs Computing kpt #: 144 total cpu time spent up to now is 143.6 secs Computing kpt #: 145 total cpu time spent up to now is 144.5 secs Computing kpt #: 146 total cpu time spent up to now is 145.4 secs Computing kpt #: 147 total cpu time spent up to now is 146.3 secs Computing kpt #: 148 total cpu time spent up to now is 147.2 secs Computing kpt #: 149 total cpu time spent up to now is 148.2 secs Computing kpt #: 150 total cpu time spent up to now is 149.2 secs Computing kpt #: 151 total cpu time spent up to now is 150.2 secs Computing kpt #: 152 total cpu time spent up to now is 151.1 secs Computing kpt #: 153 total cpu time spent up to now is 152.0 secs Computing kpt #: 154 total cpu time spent up to now is 152.9 secs Computing kpt #: 155 total cpu time spent up to now is 153.8 secs Computing kpt #: 156 total cpu time spent up to now is 154.7 secs Computing kpt #: 157 total cpu time spent up to now is 155.5 secs Computing kpt #: 158 total cpu time spent up to now is 156.3 secs Computing kpt #: 159 total cpu time spent up to now is 157.1 secs Computing kpt #: 160 total cpu time spent up to now is 157.9 secs Computing kpt #: 161 total cpu time spent up to now is 158.7 secs Computing kpt #: 162 total cpu time spent up to now is 159.4 secs Computing kpt #: 163 total cpu time spent up to now is 160.2 secs Computing kpt #: 164 total cpu time spent up to now is 161.0 secs Computing kpt #: 165 total cpu time spent up to now is 161.8 secs Computing kpt #: 166 total cpu time spent up to now is 162.5 secs Computing kpt #: 167 total cpu time spent up to now is 163.3 secs Computing kpt #: 168 total cpu time spent up to now is 164.0 secs Computing kpt #: 169 total cpu time spent up to now is 164.8 secs Computing kpt #: 170 total cpu time spent up to now is 165.5 secs Computing kpt #: 171 total cpu time spent up to now is 166.3 secs Computing kpt #: 172 total cpu time spent up to now is 167.0 secs Computing kpt #: 173 total cpu time spent up to now is 167.7 secs Computing kpt #: 174 total cpu time spent up to now is 168.5 secs Computing kpt #: 175 total cpu time spent up to now is 169.2 secs Computing kpt #: 176 total cpu time spent up to now is 169.9 secs Computing kpt #: 177 total cpu time spent up to now is 170.7 secs Computing kpt #: 178 total cpu time spent up to now is 171.4 secs Computing kpt #: 179 total cpu time spent up to now is 172.1 secs Computing kpt #: 180 total cpu time spent up to now is 172.9 secs Computing kpt #: 181 total cpu time spent up to now is 173.6 secs Computing kpt #: 182 total cpu time spent up to now is 174.3 secs Computing kpt #: 183 total cpu time spent up to now is 175.1 secs Computing kpt #: 184 total cpu time spent up to now is 175.8 secs Computing kpt #: 185 total cpu time spent up to now is 176.5 secs Computing kpt #: 186 total cpu time spent up to now is 177.2 secs Computing kpt #: 187 total cpu time spent up to now is 181.6 secs Computing kpt #: 188 total cpu time spent up to now is 182.3 secs Computing kpt #: 189 total cpu time spent up to now is 183.0 secs Computing kpt #: 190 total cpu time spent up to now is 183.7 secs Computing kpt #: 191 total cpu time spent up to now is 184.5 secs Computing kpt #: 192 total cpu time spent up to now is 185.2 secs Computing kpt #: 193 total cpu time spent up to now is 185.9 secs Computing kpt #: 194 total cpu time spent up to now is 186.6 secs Computing kpt #: 195 total cpu time spent up to now is 187.3 secs Computing kpt #: 196 total cpu time spent up to now is 188.0 secs Computing kpt #: 197 total cpu time spent up to now is 188.8 secs Computing kpt #: 198 total cpu time spent up to now is 189.5 secs Computing kpt #: 199 total cpu time spent up to now is 190.2 secs Computing kpt #: 200 total cpu time spent up to now is 191.0 secs Computing kpt #: 201 total cpu time spent up to now is 191.8 secs Computing kpt #: 202 total cpu time spent up to now is 192.6 secs Computing kpt #: 203 total cpu time spent up to now is 193.4 secs Computing kpt #: 204 total cpu time spent up to now is 194.3 secs Computing kpt #: 205 total cpu time spent up to now is 195.2 secs Computing kpt #: 206 total cpu time spent up to now is 196.0 secs Computing kpt #: 207 total cpu time spent up to now is 196.9 secs Computing kpt #: 208 total cpu time spent up to now is 197.8 secs Computing kpt #: 209 total cpu time spent up to now is 198.7 secs Computing kpt #: 210 total cpu time spent up to now is 199.6 secs Computing kpt #: 211 total cpu time spent up to now is 200.5 secs Computing kpt #: 212 total cpu time spent up to now is 201.4 secs Computing kpt #: 213 total cpu time spent up to now is 202.4 secs Computing kpt #: 214 total cpu time spent up to now is 203.3 secs Computing kpt #: 215 total cpu time spent up to now is 204.2 secs Computing kpt #: 216 total cpu time spent up to now is 205.1 secs Computing kpt #: 217 total cpu time spent up to now is 206.0 secs Computing kpt #: 218 total cpu time spent up to now is 206.9 secs Computing kpt #: 219 total cpu time spent up to now is 207.8 secs Computing kpt #: 220 total cpu time spent up to now is 208.7 secs Computing kpt #: 221 total cpu time spent up to now is 209.6 secs Computing kpt #: 222 total cpu time spent up to now is 210.5 secs Computing kpt #: 223 total cpu time spent up to now is 211.5 secs Computing kpt #: 224 total cpu time spent up to now is 212.5 secs Computing kpt #: 225 total cpu time spent up to now is 213.5 secs Computing kpt #: 226 total cpu time spent up to now is 214.5 secs Computing kpt #: 227 total cpu time spent up to now is 215.5 secs Computing kpt #: 228 total cpu time spent up to now is 216.4 secs Computing kpt #: 229 total cpu time spent up to now is 217.4 secs Computing kpt #: 230 total cpu time spent up to now is 218.2 secs Computing kpt #: 231 total cpu time spent up to now is 219.1 secs Computing kpt #: 232 total cpu time spent up to now is 220.0 secs Computing kpt #: 233 total cpu time spent up to now is 220.9 secs Computing kpt #: 234 total cpu time spent up to now is 221.8 secs Computing kpt #: 235 total cpu time spent up to now is 222.7 secs Computing kpt #: 236 total cpu time spent up to now is 223.6 secs Computing kpt #: 237 total cpu time spent up to now is 224.5 secs Computing kpt #: 238 total cpu time spent up to now is 225.5 secs Computing kpt #: 239 total cpu time spent up to now is 226.4 secs Computing kpt #: 240 total cpu time spent up to now is 227.4 secs Computing kpt #: 241 total cpu time spent up to now is 228.3 secs Computing kpt #: 242 total cpu time spent up to now is 229.3 secs Computing kpt #: 243 total cpu time spent up to now is 230.3 secs Computing kpt #: 244 total cpu time spent up to now is 231.2 secs Computing kpt #: 245 total cpu time spent up to now is 232.1 secs Computing kpt #: 246 total cpu time spent up to now is 233.1 secs Computing kpt #: 247 total cpu time spent up to now is 234.0 secs Computing kpt #: 248 total cpu time spent up to now is 234.9 secs Computing kpt #: 249 total cpu time spent up to now is 235.9 secs Computing kpt #: 250 total cpu time spent up to now is 236.8 secs Computing kpt #: 251 total cpu time spent up to now is 237.8 secs Computing kpt #: 252 total cpu time spent up to now is 238.8 secs Computing kpt #: 253 total cpu time spent up to now is 239.9 secs Computing kpt #: 254 total cpu time spent up to now is 240.9 secs Computing kpt #: 255 total cpu time spent up to now is 241.9 secs Computing kpt #: 256 total cpu time spent up to now is 242.9 secs Computing kpt #: 257 total cpu time spent up to now is 243.9 secs Computing kpt #: 258 total cpu time spent up to now is 244.9 secs Computing kpt #: 259 total cpu time spent up to now is 245.9 secs Computing kpt #: 260 total cpu time spent up to now is 246.9 secs Computing kpt #: 261 total cpu time spent up to now is 248.0 secs Computing kpt #: 262 total cpu time spent up to now is 249.2 secs Computing kpt #: 263 total cpu time spent up to now is 250.5 secs Computing kpt #: 264 total cpu time spent up to now is 251.6 secs Computing kpt #: 265 total cpu time spent up to now is 252.8 secs Computing kpt #: 266 total cpu time spent up to now is 253.9 secs Computing kpt #: 267 total cpu time spent up to now is 254.9 secs Computing kpt #: 268 total cpu time spent up to now is 255.8 secs Computing kpt #: 269 total cpu time spent up to now is 256.8 secs Computing kpt #: 270 total cpu time spent up to now is 257.8 secs Computing kpt #: 271 total cpu time spent up to now is 258.8 secs Computing kpt #: 272 total cpu time spent up to now is 259.8 secs Computing kpt #: 273 total cpu time spent up to now is 260.7 secs Computing kpt #: 274 total cpu time spent up to now is 261.7 secs Computing kpt #: 275 total cpu time spent up to now is 262.7 secs Computing kpt #: 276 total cpu time spent up to now is 263.6 secs Computing kpt #: 277 total cpu time spent up to now is 264.6 secs Computing kpt #: 278 total cpu time spent up to now is 265.6 secs Computing kpt #: 279 total cpu time spent up to now is 266.5 secs Computing kpt #: 280 total cpu time spent up to now is 267.4 secs Computing kpt #: 281 total cpu time spent up to now is 268.4 secs Computing kpt #: 282 total cpu time spent up to now is 269.3 secs Computing kpt #: 283 total cpu time spent up to now is 270.3 secs Computing kpt #: 284 total cpu time spent up to now is 271.2 secs Computing kpt #: 285 total cpu time spent up to now is 272.1 secs Computing kpt #: 286 total cpu time spent up to now is 273.1 secs Computing kpt #: 287 total cpu time spent up to now is 274.0 secs Computing kpt #: 288 total cpu time spent up to now is 274.9 secs Computing kpt #: 289 total cpu time spent up to now is 275.9 secs Computing kpt #: 290 total cpu time spent up to now is 276.7 secs Computing kpt #: 291 total cpu time spent up to now is 277.6 secs Computing kpt #: 292 total cpu time spent up to now is 278.6 secs Computing kpt #: 293 total cpu time spent up to now is 279.5 secs Computing kpt #: 294 total cpu time spent up to now is 280.4 secs Computing kpt #: 295 total cpu time spent up to now is 281.3 secs ethr = 1.72E-08, avg # of iterations = 26.6 total cpu time spent up to now is 281.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6333 PWs) bands (ev): -20.4192 -20.4192 -20.3098 -20.3098 -19.0256 -19.0256 -18.9798 -18.9798 -18.0743 -18.0743 -18.0638 -18.0638 -12.8321 -12.8321 -9.6815 -9.6815 -8.2890 -8.2890 -8.2379 -8.2379 -8.2234 -8.2234 -8.0358 -8.0358 -7.8233 -7.8233 -7.7283 -7.7283 -7.6322 -7.6322 -5.4130 -5.4130 -5.2436 -5.2436 -4.5775 -4.5775 -4.2362 -4.2362 -4.2064 -4.2064 -4.1157 -4.1157 -1.3880 -1.3880 -1.0199 -1.0199 -0.5852 -0.5852 -0.5110 -0.5110 -0.4273 -0.4273 -0.3511 -0.3511 -0.2266 -0.2266 0.5615 0.5615 3.5572 3.5572 5.9767 5.9767 6.4425 6.4425 6.6292 6.6292 8.7170 8.7170 8.7449 8.7449 k = 0.0123 0.0157-0.0057 ( 6333 PWs) bands (ev): -20.4191 -20.4191 -20.3098 -20.3098 -19.0258 -19.0258 -18.9798 -18.9798 -18.0742 -18.0742 -18.0637 -18.0637 -12.8321 -12.8321 -9.6816 -9.6816 -8.2888 -8.2888 -8.2383 -8.2383 -8.2241 -8.2241 -8.0357 -8.0357 -7.8237 -7.8237 -7.7284 -7.7284 -7.6310 -7.6310 -5.4135 -5.4135 -5.2427 -5.2427 -4.5772 -4.5772 -4.2369 -4.2369 -4.2066 -4.2066 -4.1156 -4.1156 -1.3882 -1.3882 -1.0199 -1.0199 -0.5857 -0.5857 -0.5107 -0.5107 -0.4340 -0.4340 -0.3447 -0.3447 -0.2264 -0.2264 0.5618 0.5618 3.5580 3.5580 5.9780 5.9780 6.4412 6.4412 6.6283 6.6283 8.7171 8.7171 8.7436 8.7436 k = 0.0246 0.0315-0.0113 ( 6331 PWs) bands (ev): -20.4187 -20.4187 -20.3100 -20.3100 -19.0265 -19.0265 -18.9800 -18.9800 -18.0738 -18.0738 -18.0634 -18.0634 -12.8320 -12.8320 -9.6816 -9.6816 -8.2882 -8.2882 -8.2396 -8.2396 -8.2259 -8.2259 -8.0354 -8.0354 -7.8248 -7.8248 -7.7284 -7.7284 -7.6275 -7.6275 -5.4147 -5.4147 -5.2402 -5.2402 -4.5762 -4.5762 -4.2388 -4.2388 -4.2070 -4.2070 -4.1154 -4.1154 -1.3887 -1.3887 -1.0201 -1.0201 -0.5870 -0.5870 -0.5100 -0.5100 -0.4499 -0.4499 -0.3296 -0.3296 -0.2257 -0.2257 0.5628 0.5628 3.5604 3.5604 5.9821 5.9821 6.4374 6.4374 6.6256 6.6256 8.7173 8.7173 8.7393 8.7393 k = 0.0369 0.0472-0.0170 ( 6320 PWs) bands (ev): -20.4180 -20.4180 -20.3104 -20.3104 -19.0275 -19.0275 -18.9802 -18.9802 -18.0732 -18.0732 -18.0629 -18.0629 -12.8319 -12.8319 -9.6818 -9.6818 -8.2872 -8.2872 -8.2420 -8.2420 -8.2287 -8.2287 -8.0348 -8.0348 -7.8262 -7.8262 -7.7286 -7.7286 -7.6221 -7.6221 -5.4165 -5.4165 -5.2361 -5.2361 -4.5745 -4.5745 -4.2421 -4.2421 -4.2076 -4.2076 -4.1151 -4.1151 -1.3897 -1.3897 -1.0203 -1.0203 -0.5890 -0.5890 -0.5089 -0.5089 -0.4696 -0.4696 -0.3112 -0.3112 -0.2246 -0.2246 0.5643 0.5643 3.5644 3.5644 5.9888 5.9888 6.4312 6.4312 6.6213 6.6213 8.7174 8.7174 8.7306 8.7306 k = 0.0493 0.0630-0.0227 ( 6312 PWs) bands (ev): -20.4171 -20.4171 -20.3108 -20.3108 -19.0290 -19.0290 -18.9806 -18.9806 -18.0725 -18.0725 -18.0620 -18.0620 -12.8317 -12.8317 -9.6820 -9.6820 -8.2859 -8.2859 -8.2460 -8.2460 -8.2320 -8.2320 -8.0341 -8.0341 -7.8278 -7.8278 -7.7287 -7.7287 -7.6152 -7.6152 -5.4188 -5.4188 -5.2306 -5.2306 -4.5722 -4.5722 -4.2466 -4.2466 -4.2085 -4.2085 -4.1147 -4.1147 -1.3911 -1.3911 -1.0207 -1.0207 -0.5917 -0.5917 -0.5075 -0.5075 -0.4908 -0.4908 -0.2919 -0.2919 -0.2231 -0.2231 0.5665 0.5665 3.5699 3.5699 5.9981 5.9981 6.4228 6.4228 6.6153 6.6153 8.7151 8.7151 8.7174 8.7174 k = 0.0616 0.0787-0.0283 ( 6311 PWs) bands (ev): -20.4160 -20.4160 -20.3114 -20.3114 -19.0309 -19.0309 -18.9810 -18.9810 -18.0716 -18.0716 -18.0609 -18.0609 -12.8315 -12.8315 -9.6822 -9.6822 -8.2843 -8.2843 -8.2519 -8.2519 -8.2352 -8.2352 -8.0332 -8.0332 -7.8290 -7.8290 -7.7289 -7.7289 -7.6073 -7.6073 -5.4213 -5.4213 -5.2240 -5.2240 -4.5693 -4.5693 -4.2523 -4.2523 -4.2095 -4.2095 -4.1142 -4.1142 -1.3928 -1.3928 -1.0211 -1.0211 -0.5949 -0.5949 -0.5126 -0.5126 -0.5057 -0.5057 -0.2727 -0.2727 -0.2211 -0.2211 0.5691 0.5691 3.5768 3.5768 6.0100 6.0100 6.4123 6.4123 6.6079 6.6079 8.6907 8.6907 8.7168 8.7168 k = 0.0739 0.0945-0.0340 ( 6312 PWs) bands (ev): -20.4146 -20.4146 -20.3121 -20.3121 -19.0332 -19.0332 -18.9816 -18.9816 -18.0706 -18.0706 -18.0595 -18.0595 -12.8312 -12.8312 -9.6825 -9.6825 -8.2823 -8.2823 -8.2598 -8.2598 -8.2382 -8.2382 -8.0320 -8.0320 -7.8295 -7.8295 -7.7292 -7.7292 -7.5990 -7.5990 -5.4237 -5.4237 -5.2166 -5.2166 -4.5657 -4.5657 -4.2592 -4.2592 -4.2107 -4.2107 -4.1138 -4.1138 -1.3950 -1.3950 -1.0215 -1.0215 -0.5985 -0.5985 -0.5341 -0.5341 -0.5042 -0.5042 -0.2542 -0.2542 -0.2185 -0.2185 0.5722 0.5722 3.5850 3.5850 6.0245 6.0245 6.4002 6.4002 6.5992 6.5992 8.6564 8.6564 8.7155 8.7155 k = 0.0862 0.1102-0.0397 ( 6308 PWs) bands (ev): -20.4129 -20.4129 -20.3130 -20.3130 -19.0359 -19.0359 -18.9822 -18.9822 -18.0696 -18.0696 -18.0577 -18.0577 -12.8309 -12.8309 -9.6828 -9.6828 -8.2801 -8.2801 -8.2694 -8.2694 -8.2409 -8.2409 -8.0306 -8.0306 -7.8292 -7.8292 -7.7295 -7.7295 -7.5906 -7.5906 -5.4259 -5.4259 -5.2084 -5.2084 -4.5617 -4.5617 -4.2672 -4.2672 -4.2121 -4.2121 -4.1133 -4.1133 -1.3976 -1.3976 -1.0220 -1.0220 -0.6023 -0.6023 -0.5553 -0.5553 -0.5025 -0.5025 -0.2369 -0.2369 -0.2152 -0.2152 0.5756 0.5756 3.5943 3.5943 6.0415 6.0415 6.3868 6.3868 6.5895 6.5895 8.6130 8.6130 8.7130 8.7130 k = 0.0985 0.1260-0.0453 ( 6306 PWs) bands (ev): -20.4111 -20.4111 -20.3139 -20.3139 -19.0388 -19.0388 -18.9829 -18.9829 -18.0687 -18.0687 -18.0555 -18.0555 -12.8306 -12.8306 -9.6832 -9.6832 -8.2809 -8.2809 -8.2771 -8.2771 -8.2436 -8.2436 -8.0289 -8.0289 -7.8279 -7.8279 -7.7298 -7.7298 -7.5826 -7.5826 -5.4276 -5.4276 -5.1998 -5.1998 -4.5571 -4.5571 -4.2763 -4.2763 -4.2134 -4.2134 -4.1129 -4.1129 -1.4005 -1.4005 -1.0226 -1.0226 -0.6062 -0.6062 -0.5758 -0.5758 -0.5008 -0.5008 -0.2220 -0.2220 -0.2101 -0.2101 0.5793 0.5793 3.6045 3.6045 6.0609 6.0609 6.3725 6.3725 6.5790 6.5790 8.5626 8.5626 8.7091 8.7091 k = 0.1108 0.1417-0.0510 ( 6312 PWs) bands (ev): -20.4090 -20.4090 -20.3150 -20.3150 -19.0422 -19.0422 -18.9838 -18.9838 -18.0677 -18.0677 -18.0529 -18.0529 -12.8302 -12.8302 -9.6837 -9.6837 -8.2928 -8.2928 -8.2745 -8.2745 -8.2463 -8.2463 -8.0270 -8.0270 -7.8255 -7.8255 -7.7302 -7.7302 -7.5752 -7.5752 -5.4286 -5.4286 -5.1908 -5.1908 -4.5521 -4.5521 -4.2862 -4.2862 -4.2149 -4.2149 -4.1126 -4.1126 -1.4039 -1.4039 -1.0231 -1.0231 -0.6102 -0.6102 -0.5955 -0.5955 -0.4992 -0.4992 -0.2131 -0.2131 -0.1999 -0.1999 0.5832 0.5832 3.6154 3.6154 6.0824 6.0824 6.3580 6.3580 6.5679 6.5679 8.5073 8.5073 8.7033 8.7033 k = 0.1232 0.1575-0.0566 ( 6316 PWs) bands (ev): -20.4067 -20.4067 -20.3161 -20.3161 -19.0458 -19.0458 -18.9847 -18.9847 -18.0668 -18.0668 -18.0500 -18.0500 -12.8298 -12.8298 -9.6841 -9.6841 -8.3058 -8.3058 -8.2715 -8.2715 -8.2489 -8.2489 -8.0248 -8.0248 -7.8221 -7.8221 -7.7307 -7.7307 -7.5688 -7.5688 -5.4288 -5.4288 -5.1817 -5.1817 -4.5467 -4.5467 -4.2970 -4.2970 -4.2163 -4.2163 -4.1125 -4.1125 -1.4077 -1.4077 -1.0236 -1.0236 -0.6154 -0.6154 -0.6131 -0.6131 -0.4978 -0.4978 -0.2079 -0.2079 -0.1870 -0.1870 0.5871 0.5871 3.6268 3.6268 6.1057 6.1057 6.3438 6.3438 6.5565 6.5565 8.4491 8.4491 8.6953 8.6953 k = 0.1355 0.1732-0.0623 ( 6320 PWs) bands (ev): -20.4042 -20.4042 -20.3174 -20.3174 -19.0497 -19.0497 -18.9857 -18.9857 -18.0659 -18.0659 -18.0468 -18.0468 -12.8294 -12.8294 -9.6847 -9.6847 -8.3193 -8.3193 -8.2683 -8.2683 -8.2515 -8.2515 -8.0224 -8.0224 -7.8177 -7.8177 -7.7312 -7.7312 -7.5636 -7.5636 -5.4281 -5.4281 -5.1725 -5.1725 -4.5410 -4.5410 -4.3085 -4.3085 -4.2177 -4.2177 -4.1126 -4.1126 -1.4119 -1.4119 -1.0241 -1.0241 -0.6322 -0.6322 -0.6177 -0.6177 -0.4964 -0.4964 -0.2032 -0.2032 -0.1746 -0.1746 0.5910 0.5910 3.6385 3.6385 6.1302 6.1302 6.3311 6.3311 6.5451 6.5451 8.3894 8.3894 8.6848 8.6848 k = 0.1478 0.1890-0.0680 ( 6313 PWs) bands (ev): -20.4016 -20.4016 -20.3187 -20.3187 -19.0539 -19.0539 -18.9868 -18.9868 -18.0650 -18.0650 -18.0433 -18.0433 -12.8290 -12.8290 -9.6853 -9.6853 -8.3331 -8.3331 -8.2649 -8.2649 -8.2540 -8.2540 -8.0196 -8.0196 -7.8125 -7.8125 -7.7317 -7.7317 -7.5597 -7.5597 -5.4263 -5.4263 -5.1633 -5.1633 -4.5352 -4.5352 -4.3205 -4.3205 -4.2191 -4.2191 -4.1128 -4.1128 -1.4165 -1.4165 -1.0244 -1.0244 -0.6486 -0.6486 -0.6213 -0.6213 -0.4951 -0.4951 -0.1984 -0.1984 -0.1636 -0.1636 0.5946 0.5946 3.6502 3.6502 6.1547 6.1547 6.3213 6.3213 6.5338 6.5338 8.3290 8.3290 8.6715 8.6715 k = 0.1601 0.2047-0.0736 ( 6311 PWs) bands (ev): -20.3987 -20.3987 -20.3202 -20.3202 -19.0582 -19.0582 -18.9879 -18.9879 -18.0640 -18.0640 -18.0396 -18.0396 -12.8286 -12.8286 -9.6860 -9.6860 -8.3469 -8.3469 -8.2614 -8.2614 -8.2564 -8.2564 -8.0166 -8.0166 -7.8067 -7.8067 -7.7323 -7.7323 -7.5573 -7.5573 -5.4235 -5.4235 -5.1542 -5.1542 -4.5294 -4.5294 -4.3327 -4.3327 -4.2203 -4.2203 -4.1134 -4.1134 -1.4216 -1.4216 -1.0247 -1.0247 -0.6637 -0.6637 -0.6246 -0.6246 -0.4939 -0.4939 -0.1933 -0.1933 -0.1540 -0.1540 0.5980 0.5980 3.6617 3.6617 6.1771 6.1771 6.3170 6.3170 6.5231 6.5231 8.2688 8.2688 8.6553 8.6553 k = 0.1724 0.2205-0.0793 ( 6307 PWs) bands (ev): -20.3957 -20.3957 -20.3216 -20.3216 -19.0628 -19.0628 -18.9892 -18.9892 -18.0631 -18.0631 -18.0357 -18.0357 -12.8282 -12.8282 -9.6867 -9.6867 -8.3604 -8.3604 -8.2587 -8.2587 -8.2578 -8.2578 -8.0132 -8.0132 -7.8002 -7.8002 -7.7329 -7.7329 -7.5564 -7.5564 -5.4196 -5.4196 -5.1453 -5.1453 -4.5238 -4.5238 -4.3450 -4.3450 -4.2215 -4.2215 -4.1142 -4.1142 -1.4270 -1.4270 -1.0249 -1.0249 -0.6774 -0.6774 -0.6277 -0.6277 -0.4928 -0.4928 -0.1879 -0.1879 -0.1461 -0.1461 0.6009 0.6009 3.6727 3.6727 6.1938 6.1938 6.3220 6.3220 6.5130 6.5130 8.2092 8.2092 8.6361 8.6361 k = 0.1847 0.2362-0.0850 ( 6304 PWs) bands (ev): -20.3926 -20.3926 -20.3232 -20.3232 -19.0675 -19.0675 -18.9905 -18.9905 -18.0622 -18.0622 -18.0316 -18.0316 -12.8278 -12.8278 -9.6875 -9.6875 -8.3735 -8.3735 -8.2609 -8.2609 -8.2541 -8.2541 -8.0096 -8.0096 -7.7935 -7.7935 -7.7336 -7.7336 -7.5571 -7.5571 -5.4145 -5.4145 -5.1367 -5.1367 -4.5188 -4.5188 -4.3570 -4.3570 -4.2225 -4.2225 -4.1153 -4.1153 -1.4328 -1.4328 -1.0249 -1.0249 -0.6896 -0.6896 -0.6305 -0.6305 -0.4917 -0.4917 -0.1822 -0.1822 -0.1400 -0.1400 0.6033 0.6033 3.6829 3.6829 6.2022 6.2022 6.3391 6.3391 6.5039 6.5039 8.1505 8.1505 8.6138 8.6138 k = 0.1970 0.2520-0.0906 ( 6308 PWs) bands (ev): -20.3894 -20.3894 -20.3248 -20.3248 -19.0723 -19.0723 -18.9918 -18.9918 -18.0613 -18.0613 -18.0275 -18.0275 -12.8274 -12.8274 -9.6884 -9.6884 -8.3859 -8.3859 -8.2630 -8.2630 -8.2505 -8.2505 -8.0056 -8.0056 -7.7866 -7.7866 -7.7343 -7.7343 -7.5593 -7.5593 -5.4083 -5.4083 -5.1283 -5.1283 -4.5148 -4.5148 -4.3681 -4.3681 -4.2234 -4.2234 -4.1167 -4.1167 -1.4389 -1.4389 -1.0248 -1.0248 -0.7001 -0.7001 -0.6331 -0.6331 -0.4906 -0.4906 -0.1761 -0.1761 -0.1355 -0.1355 0.6051 0.6051 3.6922 3.6922 6.2038 6.2038 6.3673 6.3673 6.4960 6.4960 8.0932 8.0932 8.5886 8.5886 k = 0.2094 0.2677-0.0963 ( 6308 PWs) bands (ev): -20.3860 -20.3860 -20.3264 -20.3264 -19.0773 -19.0773 -18.9932 -18.9932 -18.0603 -18.0603 -18.0232 -18.0232 -12.8270 -12.8270 -9.6893 -9.6893 -8.3975 -8.3975 -8.2649 -8.2649 -8.2468 -8.2468 -8.0014 -8.0014 -7.7797 -7.7797 -7.7351 -7.7351 -7.5630 -7.5630 -5.4010 -5.4010 -5.1203 -5.1203 -4.5122 -4.5122 -4.3779 -4.3779 -4.2241 -4.2241 -4.1185 -4.1185 -1.4454 -1.4454 -1.0245 -1.0245 -0.7090 -0.7090 -0.6353 -0.6353 -0.4895 -0.4895 -0.1697 -0.1697 -0.1328 -0.1328 0.6061 0.6061 3.7003 3.7003 6.2020 6.2020 6.4033 6.4033 6.4894 6.4894 8.0374 8.0374 8.5604 8.5604 k = 0.2217 0.2835-0.1020 ( 6310 PWs) bands (ev): -20.3826 -20.3826 -20.3281 -20.3281 -19.0822 -19.0822 -18.9947 -18.9947 -18.0594 -18.0594 -18.0189 -18.0189 -12.8267 -12.8267 -9.6904 -9.6904 -8.4082 -8.4082 -8.2667 -8.2667 -8.2433 -8.2433 -7.9969 -7.9969 -7.7732 -7.7732 -7.7359 -7.7359 -7.5680 -7.5680 -5.3927 -5.3927 -5.1127 -5.1127 -4.5118 -4.5118 -4.3857 -4.3857 -4.2246 -4.2246 -4.1206 -4.1206 -1.4522 -1.4522 -1.0241 -1.0241 -0.7162 -0.7162 -0.6373 -0.6373 -0.4882 -0.4882 -0.1630 -0.1630 -0.1318 -0.1318 0.6062 0.6062 3.7070 3.7070 6.1995 6.1995 6.4446 6.4446 6.4843 6.4843 7.9832 7.9832 8.5295 8.5295 k = 0.2340 0.2992-0.1076 ( 6310 PWs) bands (ev): -20.3791 -20.3791 -20.3297 -20.3297 -19.0873 -19.0873 -18.9962 -18.9962 -18.0584 -18.0584 -18.0145 -18.0145 -12.8264 -12.8264 -9.6915 -9.6915 -8.4176 -8.4176 -8.2684 -8.2684 -8.2397 -8.2397 -7.9921 -7.9921 -7.7672 -7.7672 -7.7367 -7.7367 -7.5741 -7.5741 -5.3833 -5.3833 -5.1055 -5.1055 -4.5141 -4.5141 -4.3908 -4.3908 -4.2250 -4.2250 -4.1231 -4.1231 -1.4592 -1.4592 -1.0234 -1.0234 -0.7217 -0.7217 -0.6390 -0.6390 -0.4869 -0.4869 -0.1561 -0.1561 -0.1324 -0.1324 0.6055 0.6055 3.7122 3.7122 6.1977 6.1977 6.4808 6.4808 6.4897 6.4897 7.9309 7.9309 8.4960 8.4960 k = 0.2463 0.3150-0.1133 ( 6302 PWs) bands (ev): -20.3756 -20.3756 -20.3314 -20.3314 -19.0923 -19.0923 -18.9977 -18.9977 -18.0574 -18.0574 -18.0101 -18.0101 -12.8261 -12.8261 -9.6928 -9.6928 -8.4259 -8.4259 -8.2698 -8.2698 -8.2363 -8.2363 -7.9871 -7.9871 -7.7622 -7.7622 -7.7376 -7.7376 -7.5809 -7.5809 -5.3730 -5.3730 -5.0987 -5.0987 -4.5193 -4.5193 -4.3929 -4.3929 -4.2252 -4.2252 -4.1259 -4.1259 -1.4665 -1.4665 -1.0226 -1.0226 -0.7254 -0.7254 -0.6405 -0.6405 -0.4854 -0.4854 -0.1497 -0.1497 -0.1339 -0.1339 0.6038 0.6038 3.7158 3.7158 6.1976 6.1976 6.4791 6.4791 6.5378 6.5378 7.8805 7.8805 8.4603 8.4603 k = 0.2586 0.3307-0.1190 ( 6302 PWs) bands (ev): -20.3721 -20.3721 -20.3331 -20.3331 -19.0973 -19.0973 -18.9993 -18.9993 -18.0565 -18.0565 -18.0058 -18.0058 -12.8258 -12.8258 -9.6941 -9.6941 -8.4328 -8.4328 -8.2712 -8.2712 -8.2330 -8.2330 -7.9818 -7.9818 -7.7585 -7.7585 -7.7385 -7.7385 -7.5880 -7.5880 -5.3619 -5.3619 -5.0923 -5.0923 -4.5273 -4.5273 -4.3922 -4.3922 -4.2252 -4.2252 -4.1291 -4.1291 -1.4740 -1.4740 -1.0216 -1.0216 -0.7273 -0.7273 -0.6418 -0.6418 -0.4837 -0.4837 -0.1465 -0.1465 -0.1334 -0.1334 0.6010 0.6010 3.7177 3.7177 6.1995 6.1995 6.4793 6.4793 6.5884 6.5884 7.8321 7.8321 8.4225 8.4225 k = 0.2709 0.3465-0.1246 ( 6310 PWs) bands (ev): -20.3686 -20.3686 -20.3347 -20.3347 -19.1022 -19.1022 -19.0008 -19.0008 -18.0555 -18.0555 -18.0015 -18.0015 -12.8256 -12.8256 -9.6955 -9.6955 -8.4384 -8.4384 -8.2724 -8.2724 -8.2299 -8.2299 -7.9764 -7.9764 -7.7567 -7.7567 -7.7394 -7.7394 -7.5949 -7.5949 -5.3501 -5.3501 -5.0865 -5.0865 -4.5374 -4.5374 -4.3893 -4.3893 -4.2250 -4.2250 -4.1326 -4.1326 -1.4816 -1.4816 -1.0204 -1.0204 -0.7274 -0.7274 -0.6429 -0.6429 -0.4819 -0.4819 -0.1500 -0.1500 -0.1276 -0.1276 0.5972 0.5972 3.7180 3.7180 6.2036 6.2036 6.4814 6.4814 6.6411 6.6411 7.7859 7.7859 8.3830 8.3830 k = 0.2833 0.3622-0.1303 ( 6314 PWs) bands (ev): -20.3652 -20.3652 -20.3363 -20.3363 -19.1071 -19.1071 -19.0024 -19.0024 -18.0546 -18.0546 -17.9972 -17.9972 -12.8254 -12.8254 -9.6970 -9.6970 -8.4425 -8.4425 -8.2734 -8.2734 -8.2269 -8.2269 -7.9708 -7.9708 -7.7574 -7.7574 -7.7404 -7.7404 -7.6011 -7.6011 -5.3376 -5.3376 -5.0811 -5.0811 -4.5491 -4.5491 -4.3846 -4.3846 -4.2246 -4.2246 -4.1364 -4.1364 -1.4893 -1.4893 -1.0191 -1.0191 -0.7257 -0.7257 -0.6439 -0.6439 -0.4799 -0.4799 -0.1571 -0.1571 -0.1194 -0.1194 0.5923 0.5923 3.7166 3.7166 6.2100 6.2100 6.4854 6.4854 6.6957 6.6957 7.7418 7.7418 8.3419 8.3419 k = 0.2956 0.3780-0.1360 ( 6315 PWs) bands (ev): -20.3618 -20.3618 -20.3377 -20.3377 -19.1118 -19.1118 -19.0040 -19.0040 -18.0537 -18.0537 -17.9931 -17.9931 -12.8253 -12.8253 -9.6986 -9.6986 -8.4453 -8.4453 -8.2742 -8.2742 -8.2241 -8.2241 -7.9651 -7.9651 -7.7609 -7.7609 -7.7413 -7.7413 -7.6059 -7.6059 -5.3247 -5.3247 -5.0761 -5.0761 -4.5618 -4.5618 -4.3789 -4.3789 -4.2240 -4.2240 -4.1404 -4.1404 -1.4971 -1.4971 -1.0176 -1.0176 -0.7223 -0.7223 -0.6448 -0.6448 -0.4777 -0.4777 -0.1664 -0.1664 -0.1102 -0.1102 0.5863 0.5863 3.7137 3.7137 6.2187 6.2187 6.4913 6.4913 6.7518 6.7518 7.7001 7.7001 8.2997 8.2997 k = 0.3079 0.3937-0.1416 ( 6314 PWs) bands (ev): -20.3586 -20.3586 -20.3391 -20.3391 -19.1164 -19.1164 -19.0055 -19.0055 -18.0528 -18.0528 -17.9891 -17.9891 -12.8251 -12.8251 -9.7002 -9.7002 -8.4466 -8.4466 -8.2749 -8.2749 -8.2214 -8.2214 -7.9593 -7.9593 -7.7675 -7.7675 -7.7422 -7.7422 -7.6089 -7.6089 -5.3114 -5.3114 -5.0717 -5.0717 -4.5750 -4.5750 -4.3724 -4.3724 -4.2232 -4.2232 -4.1447 -4.1447 -1.5048 -1.5048 -1.0160 -1.0160 -0.7171 -0.7171 -0.6455 -0.6455 -0.4753 -0.4753 -0.1774 -0.1774 -0.1004 -0.1004 0.5793 0.5793 3.7093 3.7093 6.2296 6.2296 6.4990 6.4990 6.8090 6.8090 7.6607 7.6607 8.2565 8.2565 k = 0.3202 0.4095-0.1473 ( 6310 PWs) bands (ev): -20.3557 -20.3557 -20.3402 -20.3402 -19.1209 -19.1209 -19.0071 -19.0071 -18.0519 -18.0519 -17.9852 -17.9852 -12.8251 -12.8251 -9.7018 -9.7018 -8.4465 -8.4465 -8.2754 -8.2754 -8.2189 -8.2189 -7.9535 -7.9535 -7.7771 -7.7771 -7.7432 -7.7432 -7.6102 -7.6102 -5.2979 -5.2979 -5.0678 -5.0678 -4.5884 -4.5884 -4.3656 -4.3656 -4.2224 -4.2224 -4.1492 -4.1492 -1.5124 -1.5124 -1.0143 -1.0143 -0.7102 -0.7102 -0.6462 -0.6462 -0.4728 -0.4728 -0.1900 -0.1900 -0.0901 -0.0901 0.5712 0.5712 3.7037 3.7037 6.2424 6.2424 6.5086 6.5086 6.8672 6.8672 7.6238 7.6238 8.2128 8.2128 k = 0.3325 0.4252-0.1530 ( 6312 PWs) bands (ev): -20.3532 -20.3532 -20.3409 -20.3409 -19.1252 -19.1252 -19.0086 -19.0086 -18.0511 -18.0511 -17.9814 -17.9814 -12.8250 -12.8250 -9.7035 -9.7035 -8.4451 -8.4451 -8.2759 -8.2759 -8.2166 -8.2166 -7.9478 -7.9478 -7.7896 -7.7896 -7.7441 -7.7441 -7.6098 -7.6098 -5.2842 -5.2842 -5.0644 -5.0644 -4.6016 -4.6016 -4.3586 -4.3586 -4.2214 -4.2214 -4.1539 -4.1539 -1.5199 -1.5199 -1.0126 -1.0126 -0.7017 -0.7017 -0.6468 -0.6468 -0.4701 -0.4701 -0.2040 -0.2040 -0.0794 -0.0794 0.5623 0.5623 3.6970 3.6970 6.2568 6.2568 6.5198 6.5198 6.9257 6.9257 7.5896 7.5896 8.1689 8.1689 k = 0.3448 0.4410-0.1586 ( 6324 PWs) bands (ev): -20.3514 -20.3514 -20.3410 -20.3410 -19.1293 -19.1293 -19.0100 -19.0100 -18.0502 -18.0502 -17.9779 -17.9779 -12.8250 -12.8250 -9.7051 -9.7051 -8.4425 -8.4425 -8.2761 -8.2761 -8.2144 -8.2144 -7.9422 -7.9422 -7.8042 -7.8042 -7.7451 -7.7451 -7.6081 -7.6081 -5.2706 -5.2706 -5.0614 -5.0614 -4.6146 -4.6146 -4.3517 -4.3517 -4.2204 -4.2204 -4.1585 -4.1585 -1.5272 -1.5272 -1.0108 -1.0108 -0.6916 -0.6916 -0.6474 -0.6474 -0.4673 -0.4673 -0.2193 -0.2193 -0.0682 -0.0682 0.5525 0.5525 3.6894 3.6894 6.2726 6.2726 6.5324 6.5324 6.9841 6.9841 7.5584 7.5584 8.1250 8.1250 k = 0.3571 0.4567-0.1643 ( 6329 PWs) bands (ev): -20.3506 -20.3506 -20.3401 -20.3401 -19.1332 -19.1332 -19.0114 -19.0114 -18.0495 -18.0495 -17.9745 -17.9745 -12.8250 -12.8250 -9.7067 -9.7067 -8.4388 -8.4388 -8.2763 -8.2763 -8.2125 -8.2125 -7.9367 -7.9367 -7.8205 -7.8205 -7.7460 -7.7460 -7.6054 -7.6054 -5.2572 -5.2572 -5.0589 -5.0589 -4.6270 -4.6270 -4.3449 -4.3449 -4.2195 -4.2195 -4.1631 -4.1631 -1.5342 -1.5342 -1.0090 -1.0090 -0.6800 -0.6800 -0.6479 -0.6479 -0.4644 -0.4644 -0.2359 -0.2359 -0.0568 -0.0568 0.5419 0.5419 3.6812 3.6812 6.2895 6.2895 6.5464 6.5464 7.0417 7.0417 7.5304 7.5304 8.0816 8.0816 k = 0.3695 0.4725-0.1699 ( 6319 PWs) bands (ev): -20.3506 -20.3506 -20.3385 -20.3385 -19.1368 -19.1368 -19.0127 -19.0127 -18.0487 -18.0487 -17.9713 -17.9713 -12.8250 -12.8250 -9.7082 -9.7082 -8.4342 -8.4342 -8.2764 -8.2764 -8.2106 -8.2106 -7.9314 -7.9314 -7.8378 -7.8378 -7.7469 -7.7469 -7.6022 -7.6022 -5.2441 -5.2441 -5.0569 -5.0569 -4.6387 -4.6387 -4.3385 -4.3385 -4.2187 -4.2187 -4.1675 -4.1675 -1.5408 -1.5408 -1.0073 -1.0073 -0.6670 -0.6670 -0.6484 -0.6484 -0.4616 -0.4616 -0.2535 -0.2535 -0.0451 -0.0451 0.5308 0.5308 3.6726 3.6726 6.3070 6.3070 6.5613 6.5613 7.0975 7.0975 7.5064 7.5064 8.0392 8.0392 k = 0.3818 0.4882-0.1756 ( 6319 PWs) bands (ev): -20.3511 -20.3511 -20.3365 -20.3365 -19.1402 -19.1402 -19.0140 -19.0140 -18.0481 -18.0481 -17.9684 -17.9684 -12.8251 -12.8251 -9.7096 -9.7096 -8.4288 -8.4288 -8.2765 -8.2765 -8.2090 -8.2090 -7.9264 -7.9264 -7.8556 -7.8556 -7.7478 -7.7478 -7.5987 -7.5987 -5.2314 -5.2314 -5.0552 -5.0552 -4.6497 -4.6497 -4.3326 -4.3326 -4.2182 -4.2182 -4.1715 -4.1715 -1.5471 -1.5471 -1.0056 -1.0056 -0.6527 -0.6527 -0.6488 -0.6488 -0.4587 -0.4587 -0.2721 -0.2721 -0.0333 -0.0333 0.5193 0.5193 3.6638 3.6638 6.3249 6.3249 6.5769 6.5769 7.1501 7.1501 7.4873 7.4873 7.9980 7.9980 k = 0.3941 0.5040-0.1813 ( 6326 PWs) bands (ev): -20.3518 -20.3518 -20.3344 -20.3344 -19.1433 -19.1433 -19.0152 -19.0152 -18.0474 -18.0474 -17.9657 -17.9657 -12.8251 -12.8251 -9.7108 -9.7108 -8.4230 -8.4230 -8.2767 -8.2767 -8.2075 -8.2075 -7.9217 -7.9217 -7.8732 -7.8732 -7.7486 -7.7486 -7.5951 -7.5951 -5.2194 -5.2194 -5.0540 -5.0540 -4.6599 -4.6599 -4.3271 -4.3271 -4.2183 -4.2183 -4.1749 -4.1749 -1.5530 -1.5530 -1.0040 -1.0040 -0.6494 -0.6494 -0.6370 -0.6370 -0.4560 -0.4560 -0.2916 -0.2916 -0.0216 -0.0216 0.5076 0.5076 3.6551 3.6551 6.3426 6.3426 6.5928 6.5928 7.1970 7.1970 7.4751 7.4751 7.9587 7.9587 k = 0.3941 0.5040-0.1813 ( 6326 PWs) bands (ev): -20.3518 -20.3518 -20.3344 -20.3344 -19.1433 -19.1433 -19.0152 -19.0152 -18.0474 -18.0474 -17.9657 -17.9657 -12.8251 -12.8251 -9.7108 -9.7108 -8.4230 -8.4230 -8.2767 -8.2767 -8.2075 -8.2075 -7.9217 -7.9217 -7.8732 -7.8732 -7.7486 -7.7486 -7.5951 -7.5951 -5.2194 -5.2194 -5.0540 -5.0540 -4.6599 -4.6599 -4.3271 -4.3271 -4.2183 -4.2183 -4.1749 -4.1749 -1.5530 -1.5530 -1.0040 -1.0040 -0.6494 -0.6494 -0.6370 -0.6370 -0.4560 -0.4560 -0.2916 -0.2916 -0.0216 -0.0216 0.5076 0.5076 3.6551 3.6551 6.3426 6.3426 6.5928 6.5928 7.1970 7.1970 7.4751 7.4751 7.9587 7.9587 k = 0.3982 0.5093-0.1617 ( 6321 PWs) bands (ev): -20.3519 -20.3519 -20.3340 -20.3340 -19.1428 -19.1428 -19.0150 -19.0150 -18.0475 -18.0475 -17.9660 -17.9660 -12.8247 -12.8247 -9.7145 -9.7145 -8.4144 -8.4144 -8.2715 -8.2715 -8.2092 -8.2092 -7.9215 -7.9215 -7.8888 -7.8888 -7.7476 -7.7476 -7.5944 -7.5944 -5.2163 -5.2163 -5.0573 -5.0573 -4.6632 -4.6632 -4.3222 -4.3222 -4.2093 -4.2093 -4.1864 -4.1864 -1.5546 -1.5546 -1.0003 -1.0003 -0.6519 -0.6519 -0.6258 -0.6258 -0.4572 -0.4572 -0.3032 -0.3032 -0.0171 -0.0171 0.5038 0.5038 3.6587 3.6587 6.3481 6.3481 6.6042 6.6042 7.1861 7.1861 7.4895 7.4895 7.9538 7.9538 k = 0.4024 0.5146-0.1422 ( 6311 PWs) bands (ev): -20.3518 -20.3518 -20.3336 -20.3336 -19.1421 -19.1421 -19.0148 -19.0148 -18.0476 -18.0476 -17.9665 -17.9665 -12.8242 -12.8242 -9.7181 -9.7181 -8.4063 -8.4063 -8.2667 -8.2667 -8.2112 -8.2112 -7.9217 -7.9217 -7.9043 -7.9043 -7.7463 -7.7463 -7.5936 -7.5936 -5.2137 -5.2137 -5.0604 -5.0604 -4.6659 -4.6659 -4.3179 -4.3179 -4.2028 -4.2028 -4.1977 -4.1977 -1.5559 -1.5559 -0.9956 -0.9956 -0.6547 -0.6547 -0.6142 -0.6142 -0.4589 -0.4589 -0.3148 -0.3148 -0.0127 -0.0127 0.5001 0.5001 3.6643 3.6643 6.3542 6.3542 6.6150 6.6150 7.1779 7.1779 7.5062 7.5062 7.9519 7.9519 k = 0.4066 0.5199-0.1226 ( 6311 PWs) bands (ev): -20.3517 -20.3517 -20.3331 -20.3331 -19.1411 -19.1411 -19.0146 -19.0146 -18.0477 -18.0477 -17.9670 -17.9670 -12.8236 -12.8236 -9.7217 -9.7217 -8.3989 -8.3989 -8.2629 -8.2629 -8.2137 -8.2137 -7.9228 -7.9228 -7.9189 -7.9189 -7.7449 -7.7449 -7.5926 -7.5926 -5.2117 -5.2117 -5.0631 -5.0631 -4.6678 -4.6678 -4.3142 -4.3142 -4.2138 -4.2138 -4.1937 -4.1937 -1.5569 -1.5569 -0.9899 -0.9899 -0.6578 -0.6578 -0.6022 -0.6022 -0.4610 -0.4610 -0.3263 -0.3263 -0.0082 -0.0082 0.4967 0.4967 3.6722 3.6722 6.3609 6.3609 6.6253 6.6253 7.1723 7.1723 7.5250 7.5250 7.9532 7.9532 k = 0.4107 0.5253-0.1031 ( 6321 PWs) bands (ev): -20.3514 -20.3514 -20.3325 -20.3325 -19.1399 -19.1399 -19.0144 -19.0144 -18.0479 -18.0479 -17.9677 -17.9677 -12.8229 -12.8229 -9.7251 -9.7251 -8.3920 -8.3920 -8.2603 -8.2603 -8.2167 -8.2167 -7.9336 -7.9336 -7.9232 -7.9232 -7.7433 -7.7433 -7.5914 -7.5914 -5.2104 -5.2104 -5.0653 -5.0653 -4.6691 -4.6691 -4.3112 -4.3112 -4.2287 -4.2287 -4.1879 -4.1879 -1.5577 -1.5577 -0.9833 -0.9833 -0.6611 -0.6611 -0.5898 -0.5898 -0.4638 -0.4638 -0.3378 -0.3378 -0.0038 -0.0038 0.4936 0.4936 3.6821 3.6821 6.3681 6.3681 6.6347 6.6347 7.1694 7.1694 7.5459 7.5459 7.9579 7.9579 k = 0.4149 0.5306-0.0835 ( 6318 PWs) bands (ev): -20.3511 -20.3511 -20.3319 -20.3319 -19.1385 -19.1385 -19.0141 -19.0141 -18.0482 -18.0482 -17.9685 -17.9685 -12.8222 -12.8222 -9.7285 -9.7285 -8.3858 -8.3858 -8.2594 -8.2594 -8.2200 -8.2200 -7.9460 -7.9460 -7.9247 -7.9247 -7.7415 -7.7415 -7.5900 -7.5900 -5.2100 -5.2100 -5.0668 -5.0668 -4.6696 -4.6696 -4.3088 -4.3088 -4.2446 -4.2446 -4.1830 -4.1830 -1.5581 -1.5581 -0.9758 -0.9758 -0.6647 -0.6647 -0.5771 -0.5771 -0.4670 -0.4670 -0.3492 -0.3492 0.0006 0.0006 0.4907 0.4907 3.6940 3.6940 6.3758 6.3758 6.6431 6.6431 7.1691 7.1691 7.5687 7.5687 7.9661 7.9661 k = 0.4190 0.5359-0.0640 ( 6320 PWs) bands (ev): -20.3507 -20.3507 -20.3313 -20.3313 -19.1368 -19.1368 -19.0138 -19.0138 -18.0485 -18.0485 -17.9693 -17.9693 -12.8215 -12.8215 -9.7316 -9.7316 -8.3802 -8.3802 -8.2608 -8.2608 -8.2238 -8.2238 -7.9564 -7.9564 -7.9264 -7.9264 -7.7395 -7.7395 -7.5885 -7.5885 -5.2105 -5.2105 -5.0677 -5.0677 -4.6694 -4.6694 -4.3072 -4.3072 -4.2615 -4.2615 -4.1791 -4.1791 -1.5582 -1.5582 -0.9676 -0.9676 -0.6684 -0.6684 -0.5643 -0.5643 -0.4707 -0.4707 -0.3603 -0.3603 0.0049 0.0049 0.4882 0.4882 3.7079 3.7079 6.3839 6.3839 6.6504 6.6504 7.1714 7.1714 7.5935 7.5935 7.9779 7.9779 k = 0.4232 0.5412-0.0444 ( 6316 PWs) bands (ev): -20.3502 -20.3502 -20.3306 -20.3306 -19.1350 -19.1350 -19.0135 -19.0135 -18.0489 -18.0489 -17.9702 -17.9702 -12.8207 -12.8207 -9.7345 -9.7345 -8.3753 -8.3753 -8.2649 -8.2649 -8.2280 -8.2280 -7.9644 -7.9644 -7.9283 -7.9283 -7.7374 -7.7374 -7.5869 -7.5869 -5.2120 -5.2120 -5.0678 -5.0678 -4.6686 -4.6686 -4.3063 -4.3063 -4.2791 -4.2791 -4.1760 -4.1760 -1.5580 -1.5580 -0.9587 -0.9587 -0.6722 -0.6722 -0.5512 -0.5512 -0.4749 -0.4749 -0.3712 -0.3712 0.0091 0.0091 0.4859 0.4859 3.7236 3.7236 6.3925 6.3925 6.6565 6.6565 7.1763 7.1763 7.6199 7.6199 7.9933 7.9933 k = 0.4273 0.5465-0.0249 ( 6316 PWs) bands (ev): -20.3497 -20.3497 -20.3299 -20.3299 -19.1329 -19.1329 -19.0131 -19.0131 -18.0493 -18.0493 -17.9712 -17.9712 -12.8198 -12.8198 -9.7371 -9.7371 -8.3709 -8.3709 -8.2720 -8.2720 -8.2327 -8.2327 -7.9695 -7.9695 -7.9304 -7.9304 -7.7352 -7.7352 -7.5852 -7.5852 -5.2145 -5.2145 -5.0671 -5.0671 -4.6671 -4.6671 -4.3064 -4.3064 -4.2972 -4.2972 -4.1738 -4.1738 -1.5574 -1.5574 -0.9493 -0.9493 -0.6762 -0.6762 -0.5381 -0.5381 -0.4796 -0.4796 -0.3819 -0.3819 0.0133 0.0133 0.4840 0.4840 3.7411 3.7411 6.4015 6.4015 6.6613 6.6613 7.1835 7.1835 7.6480 7.6480 8.0124 8.0124 k = 0.4315 0.5518-0.0053 ( 6308 PWs) bands (ev): -20.3490 -20.3490 -20.3291 -20.3291 -19.1306 -19.1306 -19.0127 -19.0127 -18.0499 -18.0499 -17.9722 -17.9722 -12.8190 -12.8190 -9.7394 -9.7394 -8.3671 -8.3671 -8.2821 -8.2821 -8.2377 -8.2377 -7.9717 -7.9717 -7.9326 -7.9326 -7.7328 -7.7328 -7.5834 -7.5834 -5.2180 -5.2180 -5.0658 -5.0658 -4.6649 -4.6649 -4.3172 -4.3172 -4.3060 -4.3060 -4.1724 -4.1724 -1.5565 -1.5565 -0.9395 -0.9395 -0.6804 -0.6804 -0.5249 -0.5249 -0.4848 -0.4848 -0.3921 -0.3921 0.0174 0.0174 0.4824 0.4824 3.7603 3.7603 6.4108 6.4108 6.6648 6.6648 7.1932 7.1932 7.6776 7.6776 8.0351 8.0351 k = 0.4357 0.5571 0.0142 ( 6312 PWs) bands (ev): -20.3483 -20.3483 -20.3284 -20.3284 -19.1282 -19.1282 -19.0123 -19.0123 -18.0505 -18.0505 -17.9733 -17.9733 -12.8181 -12.8181 -9.7414 -9.7414 -8.3640 -8.3640 -8.2950 -8.2950 -8.2432 -8.2432 -7.9713 -7.9713 -7.9349 -7.9349 -7.7305 -7.7305 -7.5815 -7.5815 -5.2224 -5.2224 -5.0637 -5.0637 -4.6621 -4.6621 -4.3364 -4.3364 -4.3075 -4.3075 -4.1716 -4.1716 -1.5552 -1.5552 -0.9294 -0.9294 -0.6846 -0.6846 -0.5119 -0.5119 -0.4905 -0.4905 -0.4019 -0.4019 0.0213 0.0213 0.4811 0.4811 3.7809 3.7809 6.4205 6.4205 6.6669 6.6669 7.2052 7.2052 7.7083 7.7083 8.0613 8.0613 k = 0.4398 0.5625 0.0338 ( 6306 PWs) bands (ev): -20.3476 -20.3476 -20.3276 -20.3276 -19.1256 -19.1256 -19.0119 -19.0119 -18.0512 -18.0512 -17.9743 -17.9743 -12.8172 -12.8172 -9.7430 -9.7430 -8.3616 -8.3616 -8.3102 -8.3102 -8.2490 -8.2490 -7.9684 -7.9684 -7.9372 -7.9372 -7.7280 -7.7280 -7.5795 -7.5795 -5.2276 -5.2276 -5.0612 -5.0612 -4.6587 -4.6587 -4.3563 -4.3563 -4.3094 -4.3094 -4.1716 -4.1716 -1.5536 -1.5536 -0.9190 -0.9190 -0.6889 -0.6889 -0.4996 -0.4996 -0.4963 -0.4963 -0.4110 -0.4110 0.0252 0.0252 0.4802 0.4802 3.8029 3.8029 6.4305 6.4305 6.6677 6.6677 7.2195 7.2195 7.7402 7.7402 8.0910 8.0910 k = 0.4440 0.5678 0.0533 ( 6312 PWs) bands (ev): -20.3467 -20.3467 -20.3267 -20.3267 -19.1228 -19.1228 -19.0115 -19.0115 -18.0520 -18.0520 -17.9754 -17.9754 -12.8162 -12.8162 -9.7443 -9.7443 -8.3606 -8.3606 -8.3265 -8.3265 -8.2552 -8.2552 -7.9636 -7.9636 -7.9396 -7.9396 -7.7255 -7.7255 -7.5775 -7.5775 -5.2335 -5.2335 -5.0581 -5.0581 -4.6547 -4.6547 -4.3764 -4.3764 -4.3120 -4.3120 -4.1722 -4.1722 -1.5516 -1.5516 -0.9086 -0.9086 -0.6932 -0.6932 -0.5033 -0.5033 -0.4872 -0.4872 -0.4192 -0.4192 0.0288 0.0288 0.4797 0.4797 3.8261 3.8261 6.4407 6.4407 6.6672 6.6672 7.2360 7.2360 7.7729 7.7729 8.1241 8.1241 k = 0.4481 0.5731 0.0729 ( 6308 PWs) bands (ev): -20.3459 -20.3459 -20.3259 -20.3259 -19.1199 -19.1199 -19.0111 -19.0111 -18.0528 -18.0528 -17.9765 -17.9765 -12.8153 -12.8153 -9.7453 -9.7453 -8.3640 -8.3640 -8.3404 -8.3404 -8.2617 -8.2617 -7.9573 -7.9573 -7.9419 -7.9419 -7.7229 -7.7229 -7.5754 -7.5754 -5.2400 -5.2400 -5.0548 -5.0548 -4.6502 -4.6502 -4.3967 -4.3967 -4.3153 -4.3153 -4.1733 -4.1733 -1.5492 -1.5492 -0.8981 -0.8981 -0.6976 -0.6976 -0.5103 -0.5103 -0.4767 -0.4767 -0.4256 -0.4256 0.0324 0.0324 0.4795 0.4795 3.8504 3.8504 6.4511 6.4511 6.6655 6.6655 7.2547 7.2547 7.8062 7.8062 8.1602 8.1602 k = 0.4523 0.5784 0.0924 ( 6296 PWs) bands (ev): -20.3450 -20.3450 -20.3251 -20.3251 -19.1169 -19.1169 -19.0106 -19.0106 -18.0538 -18.0538 -17.9776 -17.9776 -12.8143 -12.8143 -9.7459 -9.7459 -8.3774 -8.3774 -8.3459 -8.3459 -8.2684 -8.2684 -7.9501 -7.9501 -7.9438 -7.9438 -7.7203 -7.7203 -7.5734 -7.5734 -5.2470 -5.2470 -5.0512 -5.0512 -4.6451 -4.6451 -4.4170 -4.4170 -4.3193 -4.3193 -4.1749 -4.1749 -1.5465 -1.5465 -0.8878 -0.8878 -0.7019 -0.7019 -0.5176 -0.5176 -0.4695 -0.4695 -0.4285 -0.4285 0.0357 0.0357 0.4796 0.4796 3.8756 3.8756 6.4618 6.4618 6.6628 6.6628 7.2754 7.2754 7.8397 7.8397 8.1993 8.1993 k = 0.4564 0.5837 0.1120 ( 6296 PWs) bands (ev): -20.3440 -20.3440 -20.3242 -20.3242 -19.1138 -19.1138 -19.0102 -19.0102 -18.0549 -18.0549 -17.9787 -17.9787 -12.8134 -12.8134 -9.7462 -9.7462 -8.3970 -8.3970 -8.3463 -8.3463 -8.2754 -8.2754 -7.9473 -7.9473 -7.9406 -7.9406 -7.7177 -7.7177 -7.5713 -7.5713 -5.2544 -5.2544 -5.0474 -5.0474 -4.6395 -4.6395 -4.4372 -4.4372 -4.3238 -4.3238 -4.1768 -4.1768 -1.5434 -1.5434 -0.8776 -0.8776 -0.7063 -0.7063 -0.5254 -0.5254 -0.4677 -0.4677 -0.4258 -0.4258 0.0388 0.0388 0.4801 0.4801 3.9016 3.9016 6.4725 6.4725 6.6591 6.6591 7.2982 7.2982 7.8732 7.8732 8.2411 8.2411 k = 0.4606 0.5890 0.1315 ( 6306 PWs) bands (ev): -20.3430 -20.3430 -20.3234 -20.3234 -19.1106 -19.1106 -19.0097 -19.0097 -18.0560 -18.0560 -17.9797 -17.9797 -12.8124 -12.8124 -9.7462 -9.7462 -8.4186 -8.4186 -8.3456 -8.3456 -8.2826 -8.2826 -7.9491 -7.9491 -7.9323 -7.9323 -7.7152 -7.7152 -7.5692 -7.5692 -5.2621 -5.2621 -5.0436 -5.0436 -4.6335 -4.6335 -4.4572 -4.4572 -4.3290 -4.3290 -4.1792 -4.1792 -1.5400 -1.5400 -0.8677 -0.8677 -0.7106 -0.7106 -0.5334 -0.5334 -0.4706 -0.4706 -0.4182 -0.4182 0.0417 0.0417 0.4809 0.4809 3.9280 3.9280 6.4833 6.4833 6.6545 6.6545 7.3229 7.3229 7.9064 7.9064 8.2854 8.2854 k = 0.4647 0.5944 0.1511 ( 6305 PWs) bands (ev): -20.3420 -20.3420 -20.3226 -20.3226 -19.1073 -19.1073 -19.0092 -19.0092 -18.0572 -18.0572 -17.9807 -17.9807 -12.8115 -12.8115 -9.7460 -9.7460 -8.4407 -8.4407 -8.3445 -8.3445 -8.2900 -8.2900 -7.9511 -7.9511 -7.9234 -7.9234 -7.7126 -7.7126 -7.5671 -7.5671 -5.2699 -5.2699 -5.0398 -5.0398 -4.6270 -4.6270 -4.4770 -4.4770 -4.3347 -4.3347 -4.1818 -4.1818 -1.5363 -1.5363 -0.8581 -0.8581 -0.7148 -0.7148 -0.5417 -0.5417 -0.4758 -0.4758 -0.4082 -0.4082 0.0444 0.0444 0.4820 0.4820 3.9549 3.9549 6.4941 6.4941 6.6492 6.6492 7.3496 7.3496 7.9389 7.9389 8.3318 8.3318 k = 0.4689 0.5997 0.1706 ( 6303 PWs) bands (ev): -20.3410 -20.3410 -20.3218 -20.3218 -19.1040 -19.1040 -19.0087 -19.0087 -18.0585 -18.0585 -17.9817 -17.9817 -12.8106 -12.8106 -9.7454 -9.7454 -8.4630 -8.4630 -8.3434 -8.3434 -8.2974 -8.2974 -7.9531 -7.9531 -7.9146 -7.9146 -7.7101 -7.7101 -7.5650 -7.5650 -5.2778 -5.2778 -5.0361 -5.0361 -4.6200 -4.6200 -4.4963 -4.4963 -4.3409 -4.3409 -4.1847 -4.1847 -1.5323 -1.5323 -0.8488 -0.8488 -0.7189 -0.7189 -0.5503 -0.5503 -0.4818 -0.4818 -0.3974 -0.3974 0.0469 0.0469 0.4833 0.4833 3.9819 3.9819 6.5048 6.5048 6.6433 6.6433 7.3780 7.3780 7.9703 7.9703 8.3803 8.3803 k = 0.4731 0.6050 0.1902 ( 6305 PWs) bands (ev): -20.3400 -20.3400 -20.3210 -20.3210 -19.1006 -19.1006 -19.0083 -19.0083 -18.0599 -18.0599 -17.9827 -17.9827 -12.8097 -12.8097 -9.7447 -9.7447 -8.4851 -8.4851 -8.3423 -8.3423 -8.3048 -8.3048 -7.9550 -7.9550 -7.9059 -7.9059 -7.7076 -7.7076 -7.5629 -7.5629 -5.2858 -5.2858 -5.0324 -5.0324 -4.6127 -4.6127 -4.5151 -4.5151 -4.3476 -4.3476 -4.1877 -4.1877 -1.5281 -1.5281 -0.8400 -0.8400 -0.7229 -0.7229 -0.5591 -0.5591 -0.4879 -0.4879 -0.3864 -0.3864 0.0491 0.0491 0.4849 0.4849 4.0089 4.0089 6.5154 6.5154 6.6371 6.6371 7.4083 7.4083 8.0003 8.0003 8.4304 8.4304 k = 0.4772 0.6103 0.2097 ( 6303 PWs) bands (ev): -20.3389 -20.3389 -20.3202 -20.3202 -19.0973 -19.0973 -19.0078 -19.0078 -18.0614 -18.0614 -17.9836 -17.9836 -12.8088 -12.8088 -9.7438 -9.7438 -8.5066 -8.5066 -8.3413 -8.3413 -8.3123 -8.3123 -7.9568 -7.9568 -7.8975 -7.8975 -7.7052 -7.7052 -7.5609 -7.5609 -5.2938 -5.2938 -5.0289 -5.0289 -4.6050 -4.6050 -4.5332 -4.5332 -4.3548 -4.3548 -4.1909 -4.1909 -1.5236 -1.5236 -0.8316 -0.8316 -0.7268 -0.7268 -0.5680 -0.5680 -0.4939 -0.4939 -0.3756 -0.3756 0.0510 0.0510 0.4868 0.4868 4.0357 4.0357 6.5258 6.5258 6.6305 6.6305 7.4401 7.4401 8.0285 8.0285 8.4818 8.4818 k = 0.4814 0.6156 0.2293 ( 6301 PWs) bands (ev): -20.3379 -20.3379 -20.3195 -20.3195 -19.0939 -19.0939 -19.0073 -19.0073 -18.0628 -18.0628 -17.9844 -17.9844 -12.8079 -12.8079 -9.7428 -9.7428 -8.5274 -8.5274 -8.3403 -8.3403 -8.3196 -8.3196 -7.9585 -7.9585 -7.8896 -7.8896 -7.7028 -7.7028 -7.5590 -7.5590 -5.3016 -5.3016 -5.0256 -5.0256 -4.5971 -4.5971 -4.5507 -4.5507 -4.3622 -4.3622 -4.1941 -4.1941 -1.5189 -1.5189 -0.8238 -0.8238 -0.7305 -0.7305 -0.5770 -0.5770 -0.4995 -0.4995 -0.3650 -0.3650 0.0527 0.0527 0.4888 0.4888 4.0621 4.0621 6.5360 6.5360 6.6237 6.6237 7.4735 7.4735 8.0545 8.0545 8.5344 8.5344 k = 0.4855 0.6209 0.2488 ( 6300 PWs) bands (ev): -20.3369 -20.3369 -20.3188 -20.3188 -19.0906 -19.0906 -19.0068 -19.0068 -18.0644 -18.0644 -17.9852 -17.9852 -12.8070 -12.8070 -9.7418 -9.7418 -8.5472 -8.5472 -8.3394 -8.3394 -8.3269 -8.3269 -7.9602 -7.9602 -7.8823 -7.8823 -7.7005 -7.7005 -7.5571 -7.5571 -5.3092 -5.3092 -5.0226 -5.0226 -4.5888 -4.5888 -4.5674 -4.5674 -4.3700 -4.3700 -4.1973 -4.1973 -1.5140 -1.5140 -0.8164 -0.8164 -0.7340 -0.7340 -0.5861 -0.5861 -0.5049 -0.5049 -0.3549 -0.3549 0.0541 0.0541 0.4910 0.4910 4.0879 4.0879 6.5457 6.5457 6.6169 6.6169 7.5084 7.5084 8.0780 8.0780 8.5878 8.5878 k = 0.4897 0.6262 0.2684 ( 6296 PWs) bands (ev): -20.3360 -20.3360 -20.3181 -20.3181 -19.0874 -19.0874 -19.0063 -19.0063 -18.0659 -18.0659 -17.9860 -17.9860 -12.8062 -12.8062 -9.7408 -9.7408 -8.5660 -8.5660 -8.3385 -8.3385 -8.3340 -8.3340 -7.9617 -7.9617 -7.8755 -7.8755 -7.6983 -7.6983 -7.5553 -7.5553 -5.3167 -5.3167 -5.0197 -5.0197 -4.5839 -4.5839 -4.5798 -4.5798 -4.3781 -4.3781 -4.2005 -4.2005 -1.5090 -1.5090 -0.8096 -0.8096 -0.7374 -0.7374 -0.5952 -0.5952 -0.5098 -0.5098 -0.3453 -0.3453 0.0552 0.0552 0.4934 0.4934 4.1131 4.1131 6.5551 6.5551 6.6102 6.6102 7.5445 7.5445 8.0986 8.0986 8.6417 8.6417 k = 0.4938 0.6316 0.2879 ( 6288 PWs) bands (ev): -20.3350 -20.3350 -20.3175 -20.3175 -19.0842 -19.0842 -19.0059 -19.0059 -18.0674 -18.0674 -17.9867 -17.9867 -12.8053 -12.8053 -9.7399 -9.7399 -8.5833 -8.5833 -8.3408 -8.3408 -8.3376 -8.3376 -7.9632 -7.9632 -7.8695 -7.8695 -7.6962 -7.6962 -7.5536 -7.5536 -5.3238 -5.3238 -5.0172 -5.0172 -4.5985 -4.5985 -4.5715 -4.5715 -4.3863 -4.3863 -4.2036 -4.2036 -1.5039 -1.5039 -0.8033 -0.8033 -0.7406 -0.7406 -0.6042 -0.6042 -0.5143 -0.5143 -0.3363 -0.3363 0.0560 0.0560 0.4959 0.4959 4.1373 4.1373 6.5640 6.5640 6.6037 6.6037 7.5818 7.5818 8.1160 8.1160 8.6958 8.6958 k = 0.4980 0.6369 0.3075 ( 6290 PWs) bands (ev): -20.3341 -20.3341 -20.3169 -20.3169 -19.0811 -19.0811 -19.0054 -19.0054 -18.0690 -18.0690 -17.9874 -17.9874 -12.8045 -12.8045 -9.7391 -9.7391 -8.5993 -8.5993 -8.3474 -8.3474 -8.3369 -8.3369 -7.9646 -7.9646 -7.8642 -7.8642 -7.6942 -7.6942 -7.5520 -7.5520 -5.3306 -5.3306 -5.0149 -5.0149 -4.6125 -4.6125 -4.5627 -4.5627 -4.3945 -4.3945 -4.2066 -4.2066 -1.4988 -1.4988 -0.7976 -0.7976 -0.7435 -0.7435 -0.6131 -0.6131 -0.5183 -0.5183 -0.3280 -0.3280 0.0565 0.0565 0.4984 0.4984 4.1605 4.1605 6.5723 6.5723 6.5974 6.5974 7.6200 7.6200 8.1299 8.1299 8.7498 8.7498 k = 0.5021 0.6422 0.3270 ( 6292 PWs) bands (ev): -20.3333 -20.3333 -20.3164 -20.3164 -19.0781 -19.0781 -19.0050 -19.0050 -18.0705 -18.0705 -17.9880 -17.9880 -12.8038 -12.8038 -9.7385 -9.7385 -8.6136 -8.6136 -8.3536 -8.3536 -8.3360 -8.3360 -7.9659 -7.9659 -7.8596 -7.8596 -7.6924 -7.6924 -7.5506 -7.5506 -5.3370 -5.3370 -5.0130 -5.0130 -4.6255 -4.6255 -4.5539 -4.5539 -4.4028 -4.4028 -4.2095 -4.2095 -1.4937 -1.4937 -0.7924 -0.7924 -0.7462 -0.7462 -0.6218 -0.6218 -0.5220 -0.5220 -0.3203 -0.3203 0.0568 0.0568 0.5011 0.5011 4.1825 4.1825 6.5800 6.5800 6.5915 6.5915 7.6589 7.6589 8.1401 8.1401 8.8034 8.8034 k = 0.5063 0.6475 0.3466 ( 6290 PWs) bands (ev): -20.3325 -20.3325 -20.3159 -20.3159 -19.0752 -19.0752 -19.0046 -19.0046 -18.0720 -18.0720 -17.9886 -17.9886 -12.8030 -12.8030 -9.7382 -9.7382 -8.6262 -8.6262 -8.3594 -8.3594 -8.3352 -8.3352 -7.9672 -7.9672 -7.8559 -7.8559 -7.6907 -7.6907 -7.5493 -7.5493 -5.3430 -5.3430 -5.0113 -5.0113 -4.6375 -4.6375 -4.5452 -4.5452 -4.4109 -4.4109 -4.2121 -4.2121 -1.4886 -1.4886 -0.7877 -0.7877 -0.7486 -0.7486 -0.6303 -0.6303 -0.5251 -0.5251 -0.3133 -0.3133 0.0568 0.0568 0.5037 0.5037 4.2031 4.2031 6.5861 6.5861 6.5869 6.5869 7.6983 7.6983 8.1463 8.1463 8.8563 8.8563 k = 0.5105 0.6528 0.3661 ( 6284 PWs) bands (ev): -20.3317 -20.3317 -20.3155 -20.3155 -19.0725 -19.0725 -19.0042 -19.0042 -18.0734 -18.0734 -17.9892 -17.9892 -12.8023 -12.8023 -9.7382 -9.7382 -8.6369 -8.6369 -8.3649 -8.3649 -8.3344 -8.3344 -7.9684 -7.9684 -7.8531 -7.8531 -7.6890 -7.6890 -7.5482 -7.5482 -5.3485 -5.3485 -5.0100 -5.0100 -4.6484 -4.6484 -4.5367 -4.5367 -4.4187 -4.4187 -4.2146 -4.2146 -1.4837 -1.4837 -0.7836 -0.7836 -0.7507 -0.7507 -0.6386 -0.6386 -0.5278 -0.5278 -0.3070 -0.3070 0.0565 0.0565 0.5063 0.5063 4.2223 4.2223 6.5812 6.5812 6.5931 6.5931 7.7379 7.7379 8.1485 8.1485 8.9081 8.9081 k = 0.5146 0.6581 0.3857 ( 6287 PWs) bands (ev): -20.3311 -20.3311 -20.3151 -20.3151 -19.0700 -19.0700 -19.0038 -19.0038 -18.0747 -18.0747 -17.9898 -17.9898 -12.8016 -12.8016 -9.7386 -9.7386 -8.6457 -8.6457 -8.3698 -8.3698 -8.3336 -8.3336 -7.9696 -7.9696 -7.8511 -7.8511 -7.6876 -7.6876 -7.5473 -7.5473 -5.3534 -5.3534 -5.0090 -5.0090 -4.6581 -4.6581 -4.5287 -4.5287 -4.4259 -4.4259 -4.2167 -4.2167 -1.4788 -1.4788 -0.7800 -0.7800 -0.7526 -0.7526 -0.6464 -0.6464 -0.5301 -0.5301 -0.3015 -0.3015 0.0559 0.0559 0.5089 0.5089 4.2400 4.2400 6.5769 6.5769 6.5984 6.5984 7.7773 7.7773 8.1465 8.1465 8.9585 8.9585 k = 0.5188 0.6634 0.4052 ( 6282 PWs) bands (ev): -20.3305 -20.3305 -20.3148 -20.3148 -19.0676 -19.0676 -19.0034 -19.0034 -18.0760 -18.0760 -17.9904 -17.9904 -12.8010 -12.8010 -9.7394 -9.7394 -8.6524 -8.6524 -8.3743 -8.3743 -8.3327 -8.3327 -7.9707 -7.9707 -7.8499 -7.8499 -7.6863 -7.6863 -7.5466 -7.5466 -5.3578 -5.3578 -5.0084 -5.0084 -4.6667 -4.6667 -4.5215 -4.5215 -4.4321 -4.4321 -4.2186 -4.2186 -1.4742 -1.4742 -0.7769 -0.7769 -0.7542 -0.7542 -0.6539 -0.6539 -0.5318 -0.5318 -0.2967 -0.2967 0.0550 0.0550 0.5115 0.5115 4.2560 4.2560 6.5732 6.5732 6.6028 6.6028 7.8161 7.8161 8.1402 8.1402 9.0069 9.0069 k = 0.5229 0.6688 0.4248 ( 6286 PWs) bands (ev): -20.3299 -20.3299 -20.3146 -20.3146 -19.0654 -19.0654 -19.0030 -19.0030 -18.0771 -18.0771 -17.9909 -17.9909 -12.8004 -12.8004 -9.7407 -9.7407 -8.6570 -8.6570 -8.3783 -8.3783 -8.3319 -8.3319 -7.9719 -7.9719 -7.8496 -7.8496 -7.6851 -7.6851 -7.5461 -7.5461 -5.3616 -5.3616 -5.0081 -5.0081 -4.6741 -4.6741 -4.5157 -4.5157 -4.4368 -4.4368 -4.2202 -4.2202 -1.4699 -1.4699 -0.7743 -0.7743 -0.7554 -0.7554 -0.6609 -0.6609 -0.5332 -0.5332 -0.2927 -0.2927 0.0539 0.0539 0.5139 0.5139 4.2703 4.2703 6.5703 6.5703 6.6062 6.6062 7.8538 7.8538 8.1299 8.1299 9.0531 9.0531 k = 0.5271 0.6741 0.4443 ( 6282 PWs) bands (ev): -20.3295 -20.3295 -20.3145 -20.3145 -19.0635 -19.0635 -19.0027 -19.0027 -18.0782 -18.0782 -17.9914 -17.9914 -12.7998 -12.7998 -9.7423 -9.7423 -8.6595 -8.6595 -8.3817 -8.3817 -8.3309 -8.3309 -7.9730 -7.9730 -7.8502 -7.8502 -7.6841 -7.6841 -7.5459 -7.5459 -5.3648 -5.3648 -5.0082 -5.0082 -4.6802 -4.6802 -4.5120 -4.5120 -4.4394 -4.4394 -4.2215 -4.2215 -1.4659 -1.4659 -0.7722 -0.7722 -0.7563 -0.7563 -0.6674 -0.6674 -0.5341 -0.5341 -0.2895 -0.2895 0.0525 0.0525 0.5163 0.5163 4.2828 4.2828 6.5681 6.5681 6.6085 6.6085 7.8894 7.8894 8.1160 8.1160 9.0965 9.0965 k = 0.5312 0.6794 0.4639 ( 6286 PWs) bands (ev): -20.3291 -20.3291 -20.3144 -20.3144 -19.0617 -19.0617 -19.0024 -19.0024 -18.0791 -18.0791 -17.9919 -17.9919 -12.7993 -12.7993 -9.7445 -9.7445 -8.6597 -8.6597 -8.3845 -8.3845 -8.3299 -8.3299 -7.9740 -7.9740 -7.8517 -7.8517 -7.6833 -7.6833 -7.5459 -7.5459 -5.3673 -5.3673 -5.0087 -5.0087 -4.6852 -4.6852 -4.5108 -4.5108 -4.4392 -4.4392 -4.2225 -4.2225 -1.4622 -1.4622 -0.7706 -0.7706 -0.7568 -0.7568 -0.6733 -0.6733 -0.5346 -0.5346 -0.2871 -0.2871 0.0508 0.0508 0.5185 0.5185 4.2934 4.2934 6.5666 6.5666 6.6098 6.6098 7.9216 7.9216 8.0997 8.0997 9.1363 9.1363 k = 0.5354 0.6847 0.4834 ( 6289 PWs) bands (ev): -20.3289 -20.3289 -20.3144 -20.3144 -19.0602 -19.0602 -19.0021 -19.0021 -18.0798 -18.0798 -17.9924 -17.9924 -12.7988 -12.7988 -9.7470 -9.7470 -8.6578 -8.6578 -8.3868 -8.3868 -8.3289 -8.3289 -7.9751 -7.9751 -7.8540 -7.8540 -7.6826 -7.6826 -7.5461 -7.5461 -5.3692 -5.3692 -5.0095 -5.0095 -4.6889 -4.6889 -4.5122 -4.5122 -4.4363 -4.4363 -4.2230 -4.2230 -1.4590 -1.4590 -0.7695 -0.7695 -0.7570 -0.7570 -0.6786 -0.6786 -0.5348 -0.5348 -0.2854 -0.2854 0.0489 0.0489 0.5207 0.5207 4.3020 4.3020 6.5658 6.5658 6.6101 6.6101 7.9469 7.9469 8.0841 8.0841 9.1720 9.1720 k = 0.5354 0.6847 0.4834 ( 6289 PWs) bands (ev): -20.3289 -20.3289 -20.3144 -20.3144 -19.0602 -19.0602 -19.0021 -19.0021 -18.0798 -18.0798 -17.9924 -17.9924 -12.7988 -12.7988 -9.7470 -9.7470 -8.6578 -8.6578 -8.3868 -8.3868 -8.3289 -8.3289 -7.9751 -7.9751 -7.8540 -7.8540 -7.6826 -7.6826 -7.5461 -7.5461 -5.3692 -5.3692 -5.0095 -5.0095 -4.6889 -4.6889 -4.5122 -4.5122 -4.4363 -4.4363 -4.2230 -4.2230 -1.4590 -1.4590 -0.7695 -0.7695 -0.7570 -0.7570 -0.6786 -0.6786 -0.5348 -0.5348 -0.2854 -0.2854 0.0489 0.0489 0.5207 0.5207 4.3020 4.3020 6.5658 6.5658 6.6101 6.6101 7.9469 7.9469 8.0841 8.0841 9.1720 9.1720 k = 0.5283 0.6757 0.4999 ( 6295 PWs) bands (ev): -20.3285 -20.3285 -20.3146 -20.3146 -19.0596 -19.0596 -19.0018 -19.0018 -18.0805 -18.0805 -17.9924 -17.9924 -12.7987 -12.7987 -9.7462 -9.7462 -8.6616 -8.6616 -8.3883 -8.3883 -8.3272 -8.3272 -7.9745 -7.9745 -7.8549 -7.8549 -7.6819 -7.6819 -7.5455 -7.5455 -5.3723 -5.3723 -5.0092 -5.0092 -4.6875 -4.6875 -4.5117 -4.5117 -4.4368 -4.4368 -4.2242 -4.2242 -1.4572 -1.4572 -0.7668 -0.7668 -0.7554 -0.7554 -0.6854 -0.6854 -0.5297 -0.5297 -0.2917 -0.2917 0.0523 0.0523 0.5192 0.5192 4.3043 4.3043 6.5679 6.5679 6.6118 6.6118 7.9512 7.9512 8.0756 8.0756 9.1956 9.1956 k = 0.5212 0.6666 0.5164 ( 6297 PWs) bands (ev): -20.3282 -20.3282 -20.3148 -20.3148 -19.0591 -19.0591 -19.0016 -19.0016 -18.0810 -18.0810 -17.9924 -17.9924 -12.7987 -12.7987 -9.7455 -9.7455 -8.6645 -8.6645 -8.3894 -8.3894 -8.3259 -8.3259 -7.9741 -7.9741 -7.8557 -7.8557 -7.6814 -7.6814 -7.5451 -7.5451 -5.3748 -5.3748 -5.0090 -5.0090 -4.6864 -4.6864 -4.5113 -4.5113 -4.4371 -4.4371 -4.2251 -4.2251 -1.4558 -1.4558 -0.7646 -0.7646 -0.7537 -0.7537 -0.6913 -0.6913 -0.5254 -0.5254 -0.2969 -0.2969 0.0550 0.0550 0.5180 0.5180 4.3060 4.3060 6.5695 6.5695 6.6131 6.6131 7.9552 7.9552 8.0682 8.0682 9.2156 9.2156 k = 0.5142 0.6575 0.5329 ( 6299 PWs) bands (ev): -20.3280 -20.3280 -20.3150 -20.3150 -19.0587 -19.0587 -19.0015 -19.0015 -18.0814 -18.0814 -17.9924 -17.9924 -12.7986 -12.7986 -9.7450 -9.7450 -8.6666 -8.6666 -8.3902 -8.3902 -8.3249 -8.3249 -7.9737 -7.9737 -7.8562 -7.8562 -7.6810 -7.6810 -7.5448 -7.5448 -5.3766 -5.3766 -5.0089 -5.0089 -4.6856 -4.6856 -4.5110 -4.5110 -4.4374 -4.4374 -4.2258 -4.2258 -1.4548 -1.4548 -0.7631 -0.7631 -0.7520 -0.7520 -0.6960 -0.6960 -0.5221 -0.5221 -0.3007 -0.3007 0.0569 0.0569 0.5172 0.5172 4.3073 4.3073 6.5707 6.5707 6.6140 6.6140 7.9586 7.9586 8.0623 8.0623 9.2309 9.2310 k = 0.5071 0.6485 0.5493 ( 6290 PWs) bands (ev): -20.3279 -20.3279 -20.3151 -20.3151 -19.0585 -19.0585 -19.0014 -19.0014 -18.0817 -18.0817 -17.9924 -17.9924 -12.7986 -12.7986 -9.7447 -9.7447 -8.6679 -8.6679 -8.3906 -8.3906 -8.3243 -8.3243 -7.9735 -7.9735 -7.8566 -7.8566 -7.6808 -7.6808 -7.5446 -7.5446 -5.3777 -5.3777 -5.0088 -5.0088 -4.6850 -4.6850 -4.5108 -4.5108 -4.4376 -4.4376 -4.2262 -4.2262 -1.4542 -1.4542 -0.7622 -0.7622 -0.7509 -0.7509 -0.6990 -0.6990 -0.5200 -0.5200 -0.3032 -0.3032 0.0581 0.0581 0.5167 0.5167 4.3080 4.3080 6.5714 6.5714 6.6145 6.6145 7.9608 7.9608 8.0586 8.0586 9.2407 9.2407 k = 0.5000 0.6394 0.5658 ( 6292 PWs) bands (ev): -20.3278 -20.3278 -20.3151 -20.3151 -19.0584 -19.0584 -19.0013 -19.0013 -18.0818 -18.0818 -17.9924 -17.9924 -12.7986 -12.7986 -9.7446 -9.7446 -8.6683 -8.6683 -8.3908 -8.3908 -8.3241 -8.3241 -7.9735 -7.9735 -7.8567 -7.8567 -7.6807 -7.6807 -7.5445 -7.5445 -5.3781 -5.3781 -5.0088 -5.0088 -4.6849 -4.6849 -4.5107 -4.5107 -4.4376 -4.4376 -4.2263 -4.2263 -1.4540 -1.4540 -0.7619 -0.7619 -0.7504 -0.7504 -0.7000 -0.7000 -0.5194 -0.5194 -0.3040 -0.3040 0.0585 0.0585 0.5165 0.5165 4.3083 4.3083 6.5716 6.5716 6.6147 6.6147 7.9616 7.9616 8.0573 8.0573 9.2440 9.2440 k = 0.5000 0.6394 0.5658 ( 6292 PWs) bands (ev): -20.3278 -20.3278 -20.3151 -20.3151 -19.0584 -19.0584 -19.0013 -19.0013 -18.0818 -18.0818 -17.9924 -17.9924 -12.7986 -12.7986 -9.7446 -9.7446 -8.6683 -8.6683 -8.3908 -8.3908 -8.3241 -8.3241 -7.9735 -7.9735 -7.8567 -7.8567 -7.6807 -7.6807 -7.5445 -7.5445 -5.3781 -5.3781 -5.0088 -5.0088 -4.6849 -4.6849 -4.5107 -4.5107 -4.4376 -4.4376 -4.2263 -4.2263 -1.4540 -1.4540 -0.7619 -0.7619 -0.7504 -0.7504 -0.7000 -0.7000 -0.5194 -0.5194 -0.3040 -0.3040 0.0585 0.0585 0.5165 0.5165 4.3083 4.3083 6.5716 6.5716 6.6147 6.6147 7.9616 7.9616 8.0573 8.0573 9.2440 9.2440 k = 0.5144 0.6282 0.5658 ( 6290 PWs) bands (ev): -20.3278 -20.3278 -20.3152 -20.3152 -19.0583 -19.0583 -19.0013 -19.0013 -18.0817 -18.0817 -17.9925 -17.9925 -12.7986 -12.7986 -9.7447 -9.7447 -8.6685 -8.6685 -8.3907 -8.3907 -8.3238 -8.3238 -7.9737 -7.9737 -7.8564 -7.8564 -7.6806 -7.6806 -7.5445 -7.5445 -5.3779 -5.3779 -5.0090 -5.0090 -4.6858 -4.6858 -4.5100 -4.5100 -4.4374 -4.4374 -4.2265 -4.2265 -1.4537 -1.4537 -0.7620 -0.7620 -0.7502 -0.7502 -0.6997 -0.6997 -0.5193 -0.5193 -0.3040 -0.3040 0.0577 0.0577 0.5165 0.5165 4.3083 4.3083 6.5708 6.5708 6.6151 6.6151 7.9625 7.9625 8.0589 8.0589 9.2407 9.2407 k = 0.5288 0.6169 0.5658 ( 6294 PWs) bands (ev): -20.3279 -20.3279 -20.3152 -20.3152 -19.0580 -19.0580 -19.0013 -19.0013 -18.0816 -18.0816 -17.9929 -17.9929 -12.7985 -12.7985 -9.7449 -9.7449 -8.6689 -8.6689 -8.3906 -8.3906 -8.3232 -8.3232 -7.9746 -7.9746 -7.8557 -7.8557 -7.6805 -7.6805 -7.5445 -7.5445 -5.3775 -5.3775 -5.0097 -5.0097 -4.6884 -4.6884 -4.5079 -4.5079 -4.4366 -4.4366 -4.2272 -4.2272 -1.4527 -1.4527 -0.7623 -0.7623 -0.7494 -0.7494 -0.6988 -0.6988 -0.5192 -0.5192 -0.3040 -0.3040 0.0555 0.0555 0.5166 0.5166 4.3082 4.3082 6.5687 6.5687 6.6161 6.6161 7.9649 7.9649 8.0636 8.0636 9.2314 9.2314 k = 0.5433 0.6056 0.5658 ( 6294 PWs) bands (ev): -20.3280 -20.3280 -20.3153 -20.3153 -19.0575 -19.0575 -19.0012 -19.0012 -18.0814 -18.0814 -17.9935 -17.9935 -12.7984 -12.7984 -9.7451 -9.7451 -8.6697 -8.6697 -8.3903 -8.3903 -8.3221 -8.3221 -7.9761 -7.9761 -7.8545 -7.8545 -7.6804 -7.6804 -7.5444 -7.5444 -5.3769 -5.3769 -5.0109 -5.0109 -4.6927 -4.6927 -4.5046 -4.5046 -4.4354 -4.4354 -4.2283 -4.2283 -1.4511 -1.4511 -0.7627 -0.7627 -0.7482 -0.7482 -0.6972 -0.6972 -0.5190 -0.5190 -0.3040 -0.3040 0.0519 0.0519 0.5169 0.5169 4.3082 4.3082 6.5653 6.5653 6.6175 6.6175 7.9690 7.9690 8.0714 8.0714 9.2173 9.2173 k = 0.5577 0.5943 0.5658 ( 6294 PWs) bands (ev): -20.3281 -20.3281 -20.3154 -20.3154 -19.0569 -19.0569 -19.0010 -19.0010 -18.0812 -18.0812 -17.9944 -17.9944 -12.7983 -12.7983 -9.7455 -9.7455 -8.6707 -8.6707 -8.3899 -8.3899 -8.3205 -8.3205 -7.9781 -7.9781 -7.8528 -7.8528 -7.6802 -7.6802 -7.5443 -7.5443 -5.3760 -5.3760 -5.0125 -5.0125 -4.6982 -4.6982 -4.5003 -4.5003 -4.4336 -4.4336 -4.2299 -4.2299 -1.4489 -1.4489 -0.7632 -0.7632 -0.7465 -0.7465 -0.6951 -0.6951 -0.5187 -0.5187 -0.3040 -0.3040 0.0468 0.0468 0.5172 0.5172 4.3081 4.3081 6.5610 6.5610 6.6191 6.6191 7.9746 7.9746 8.0821 8.0821 9.1999 9.1999 k = 0.5721 0.5830 0.5658 ( 6302 PWs) bands (ev): -20.3283 -20.3283 -20.3156 -20.3156 -19.0560 -19.0560 -19.0009 -19.0009 -18.0809 -18.0809 -17.9955 -17.9955 -12.7981 -12.7981 -9.7460 -9.7460 -8.6720 -8.6720 -8.3894 -8.3894 -8.3185 -8.3185 -7.9807 -7.9807 -7.8506 -7.8506 -7.6799 -7.6799 -7.5441 -7.5441 -5.3748 -5.3748 -5.0146 -5.0146 -4.7049 -4.7049 -4.4953 -4.4953 -4.4314 -4.4314 -4.2318 -4.2318 -1.4461 -1.4461 -0.7638 -0.7638 -0.7443 -0.7443 -0.6925 -0.6925 -0.5183 -0.5183 -0.3040 -0.3040 0.0403 0.0403 0.5176 0.5176 4.3080 4.3080 6.5561 6.5561 6.6205 6.6205 7.9817 7.9817 8.0955 8.0955 9.1808 9.1808 k = 0.5865 0.5718 0.5658 ( 6312 PWs) bands (ev): -20.3284 -20.3284 -20.3158 -20.3158 -19.0550 -19.0550 -19.0007 -19.0007 -18.0805 -18.0805 -17.9968 -17.9968 -12.7978 -12.7978 -9.7466 -9.7466 -8.6735 -8.6735 -8.3888 -8.3888 -8.3162 -8.3162 -7.9838 -7.9838 -7.8480 -7.8480 -7.6796 -7.6796 -7.5440 -7.5440 -5.3735 -5.3735 -5.0170 -5.0170 -4.7123 -4.7123 -4.4898 -4.4898 -4.4288 -4.4288 -4.2342 -4.2342 -1.4427 -1.4427 -0.7644 -0.7644 -0.7417 -0.7417 -0.6895 -0.6895 -0.5179 -0.5179 -0.3041 -0.3041 0.0326 0.0326 0.5181 0.5181 4.3079 4.3079 6.5508 6.5508 6.6217 6.6217 7.9901 7.9901 8.1115 8.1115 9.1612 9.1612 k = 0.4135-0.3233 0.8460 ( 6312 PWs) bands (ev): -20.3284 -20.3284 -20.3158 -20.3158 -19.0550 -19.0550 -19.0007 -19.0007 -18.0805 -18.0805 -17.9968 -17.9968 -12.7978 -12.7978 -9.7466 -9.7466 -8.6735 -8.6735 -8.3888 -8.3888 -8.3162 -8.3162 -7.9838 -7.9838 -7.8480 -7.8480 -7.6796 -7.6796 -7.5440 -7.5440 -5.3735 -5.3735 -5.0170 -5.0170 -4.7123 -4.7123 -4.4898 -4.4898 -4.4288 -4.4288 -4.2342 -4.2342 -1.4427 -1.4427 -0.7644 -0.7644 -0.7417 -0.7417 -0.6895 -0.6895 -0.5179 -0.5179 -0.3041 -0.3041 0.0326 0.0326 0.5181 0.5181 4.3079 4.3079 6.5508 6.5508 6.6217 6.6217 7.9901 7.9901 8.1115 8.1115 9.1612 9.1612 k = 0.3969-0.3104 0.8460 ( 6304 PWs) bands (ev): -20.3287 -20.3287 -20.3161 -20.3161 -19.0536 -19.0536 -19.0004 -19.0004 -18.0800 -18.0800 -17.9986 -17.9986 -12.7975 -12.7975 -9.7475 -9.7475 -8.6755 -8.6755 -8.3879 -8.3879 -8.3130 -8.3130 -7.9880 -7.9880 -7.8445 -7.8445 -7.6791 -7.6791 -7.5437 -7.5437 -5.3718 -5.3718 -5.0203 -5.0203 -4.7215 -4.7215 -4.4831 -4.4831 -4.4253 -4.4253 -4.2373 -4.2373 -1.4381 -1.4381 -0.7651 -0.7651 -0.7382 -0.7382 -0.6855 -0.6855 -0.5174 -0.5174 -0.3041 -0.3041 0.0222 0.0222 0.5188 0.5188 4.3077 4.3077 6.5442 6.5442 6.6226 6.6226 8.0011 8.0011 8.1325 8.1325 9.1395 9.1395 k = 0.3804-0.2974 0.8460 ( 6304 PWs) bands (ev): -20.3290 -20.3290 -20.3164 -20.3164 -19.0520 -19.0520 -19.0001 -19.0001 -18.0794 -18.0794 -18.0006 -18.0006 -12.7972 -12.7972 -9.7484 -9.7484 -8.6778 -8.6778 -8.3870 -8.3870 -8.3094 -8.3094 -7.9928 -7.9928 -7.8405 -7.8405 -7.6786 -7.6786 -7.5435 -7.5435 -5.3700 -5.3700 -5.0240 -5.0240 -4.7311 -4.7311 -4.4763 -4.4763 -4.4214 -4.4214 -4.2410 -4.2410 -1.4328 -1.4328 -0.7658 -0.7658 -0.7342 -0.7342 -0.6810 -0.6810 -0.5167 -0.5167 -0.3042 -0.3042 0.0103 0.0103 0.5196 0.5196 4.3075 4.3075 6.5374 6.5374 6.6230 6.6230 8.0134 8.0134 8.1558 8.1558 9.1199 9.1199 k = 0.3638-0.2845 0.8460 ( 6300 PWs) bands (ev): -20.3293 -20.3293 -20.3167 -20.3167 -19.0502 -19.0502 -18.9998 -18.9998 -18.0787 -18.0787 -18.0029 -18.0029 -12.7968 -12.7968 -9.7494 -9.7494 -8.6804 -8.6804 -8.3858 -8.3858 -8.3053 -8.3053 -7.9983 -7.9983 -7.8359 -7.8359 -7.6780 -7.6780 -7.5433 -7.5433 -5.3681 -5.3681 -5.0281 -5.0281 -4.7408 -4.7408 -4.4697 -4.4697 -4.4170 -4.4170 -4.2450 -4.2450 -1.4269 -1.4269 -0.7665 -0.7665 -0.7297 -0.7297 -0.6762 -0.6762 -0.5159 -0.5159 -0.3044 -0.3044 -0.0029 -0.0029 0.5205 0.5205 4.3073 4.3073 6.5304 6.5304 6.6228 6.6228 8.0267 8.0267 8.1808 8.1808 9.1036 9.1036 k = 0.3473-0.2716 0.8460 ( 6296 PWs) bands (ev): -20.3297 -20.3297 -20.3171 -20.3171 -19.0483 -19.0483 -18.9994 -18.9994 -18.0780 -18.0780 -18.0054 -18.0054 -12.7964 -12.7964 -9.7506 -9.7506 -8.6831 -8.6831 -8.3846 -8.3846 -8.3009 -8.3009 -8.0043 -8.0043 -7.8308 -7.8308 -7.6774 -7.6774 -7.5431 -7.5431 -5.3662 -5.3662 -5.0325 -5.0325 -4.7503 -4.7503 -4.4632 -4.4632 -4.4124 -4.4124 -4.2494 -4.2494 -1.4205 -1.4205 -0.7671 -0.7671 -0.7248 -0.7248 -0.6711 -0.6711 -0.5151 -0.5151 -0.3045 -0.3045 -0.0173 -0.0173 0.5216 0.5216 4.3070 4.3070 6.5231 6.5231 6.6220 6.6220 8.0405 8.0405 8.2067 8.2067 9.0915 9.0915 k = 0.3308-0.2586 0.8460 ( 6290 PWs) bands (ev): -20.3300 -20.3300 -20.3175 -20.3175 -19.0461 -19.0461 -18.9990 -18.9990 -18.0773 -18.0773 -18.0082 -18.0082 -12.7959 -12.7959 -9.7518 -9.7518 -8.6859 -8.6859 -8.3832 -8.3832 -8.2962 -8.2962 -8.0108 -8.0108 -7.8254 -7.8254 -7.6767 -7.6767 -7.5428 -7.5428 -5.3644 -5.3644 -5.0372 -5.0372 -4.7595 -4.7595 -4.4572 -4.4572 -4.4074 -4.4074 -4.2541 -4.2541 -1.4135 -1.4135 -0.7677 -0.7677 -0.7196 -0.7196 -0.6658 -0.6658 -0.5141 -0.5141 -0.3047 -0.3047 -0.0327 -0.0327 0.5229 0.5229 4.3068 4.3068 6.5158 6.5158 6.6208 6.6208 8.0545 8.0545 8.2328 8.2328 9.0847 9.0847 k = 0.3142-0.2457 0.8460 ( 6290 PWs) bands (ev): -20.3305 -20.3305 -20.3179 -20.3179 -19.0438 -19.0438 -18.9986 -18.9986 -18.0764 -18.0764 -18.0111 -18.0111 -12.7954 -12.7954 -9.7531 -9.7531 -8.6888 -8.6888 -8.3816 -8.3816 -8.2911 -8.2911 -8.0178 -8.0178 -7.8195 -7.8195 -7.6761 -7.6761 -7.5426 -7.5426 -5.3627 -5.3627 -5.0421 -5.0421 -4.7682 -4.7682 -4.4516 -4.4516 -4.4022 -4.4022 -4.2591 -4.2591 -1.4062 -1.4062 -0.7681 -0.7681 -0.7140 -0.7140 -0.6604 -0.6604 -0.5129 -0.5129 -0.3050 -0.3050 -0.0489 -0.0489 0.5243 0.5243 4.3064 4.3064 6.5083 6.5083 6.6190 6.6190 8.0683 8.0683 8.2580 8.2580 9.0839 9.0839 k = 0.2977-0.2328 0.8460 ( 6296 PWs) bands (ev): -20.3309 -20.3309 -20.3183 -20.3183 -19.0414 -19.0414 -18.9982 -18.9982 -18.0756 -18.0756 -18.0141 -18.0141 -12.7949 -12.7949 -9.7545 -9.7545 -8.6919 -8.6919 -8.3800 -8.3800 -8.2859 -8.2859 -8.0252 -8.0252 -7.8134 -7.8134 -7.6754 -7.6754 -7.5424 -7.5424 -5.3613 -5.3613 -5.0471 -5.0471 -4.7762 -4.7762 -4.4466 -4.4466 -4.3969 -4.3969 -4.2643 -4.2643 -1.3985 -1.3985 -0.7685 -0.7685 -0.7082 -0.7082 -0.6550 -0.6550 -0.5115 -0.5115 -0.3053 -0.3053 -0.0658 -0.0658 0.5258 0.5258 4.3061 4.3061 6.5008 6.5008 6.6170 6.6170 8.0812 8.0812 8.2816 8.2816 9.0897 9.0897 k = 0.2812-0.2198 0.8460 ( 6290 PWs) bands (ev): -20.3313 -20.3313 -20.3188 -20.3188 -19.0389 -19.0389 -18.9978 -18.9978 -18.0747 -18.0747 -18.0173 -18.0173 -12.7944 -12.7944 -9.7559 -9.7559 -8.6949 -8.6949 -8.3782 -8.3782 -8.2804 -8.2804 -8.0330 -8.0330 -7.8069 -7.8069 -7.6748 -7.6748 -7.5423 -7.5423 -5.3601 -5.3601 -5.0522 -5.0522 -4.7835 -4.7835 -4.4421 -4.4421 -4.3915 -4.3915 -4.2696 -4.2696 -1.3905 -1.3905 -0.7689 -0.7689 -0.7023 -0.7023 -0.6498 -0.6498 -0.5097 -0.5097 -0.3056 -0.3056 -0.0831 -0.0831 0.5274 0.5274 4.3057 4.3057 6.4930 6.4930 6.6147 6.6147 8.0930 8.0930 8.3029 8.3029 9.1027 9.1027 k = 0.2646-0.2069 0.8460 ( 6286 PWs) bands (ev): -20.3318 -20.3318 -20.3192 -20.3192 -19.0363 -19.0363 -18.9974 -18.9974 -18.0738 -18.0738 -18.0205 -18.0205 -12.7938 -12.7938 -9.7573 -9.7573 -8.6979 -8.6979 -8.3764 -8.3764 -8.2747 -8.2747 -8.0411 -8.0411 -7.8003 -7.8003 -7.6741 -7.6741 -7.5422 -7.5422 -5.3593 -5.3593 -5.0573 -5.0573 -4.7898 -4.7898 -4.4383 -4.4383 -4.3861 -4.3861 -4.2750 -4.2750 -1.3824 -1.3824 -0.7692 -0.7692 -0.6962 -0.6962 -0.6450 -0.6450 -0.5075 -0.5075 -0.3061 -0.3061 -0.1008 -0.1008 0.5292 0.5292 4.3053 4.3053 6.4852 6.4852 6.6123 6.6123 8.1033 8.1033 8.3212 8.3212 9.1229 9.1229 k = 0.2481-0.1940 0.8460 ( 6288 PWs) bands (ev): -20.3322 -20.3322 -20.3197 -20.3197 -19.0336 -19.0336 -18.9971 -18.9971 -18.0729 -18.0729 -18.0238 -18.0238 -12.7933 -12.7933 -9.7588 -9.7588 -8.7009 -8.7009 -8.3744 -8.3744 -8.2690 -8.2690 -8.0494 -8.0494 -7.7936 -7.7936 -7.6735 -7.6735 -7.5421 -7.5421 -5.3589 -5.3589 -5.0623 -5.0623 -4.7953 -4.7953 -4.4350 -4.4350 -4.3808 -4.3808 -4.2804 -4.2804 -1.3742 -1.3742 -0.7695 -0.7695 -0.6901 -0.6901 -0.6407 -0.6407 -0.5045 -0.5045 -0.3065 -0.3065 -0.1186 -0.1186 0.5311 0.5311 4.3048 4.3048 6.4771 6.4771 6.6099 6.6099 8.1115 8.1115 8.3364 8.3364 9.1499 9.1499 k = 0.2315-0.1810 0.8460 ( 6290 PWs) bands (ev): -20.3327 -20.3327 -20.3202 -20.3202 -19.0309 -19.0309 -18.9967 -18.9967 -18.0720 -18.0720 -18.0271 -18.0271 -12.7927 -12.7927 -9.7602 -9.7602 -8.7039 -8.7039 -8.3724 -8.3724 -8.2631 -8.2631 -8.0580 -8.0580 -7.7867 -7.7867 -7.6730 -7.6730 -7.5420 -7.5420 -5.3588 -5.3588 -5.0673 -5.0673 -4.7997 -4.7997 -4.4324 -4.4324 -4.3755 -4.3755 -4.2858 -4.2858 -1.3660 -1.3660 -0.7697 -0.7697 -0.6840 -0.6840 -0.6371 -0.6371 -0.5009 -0.5009 -0.3071 -0.3071 -0.1364 -0.1364 0.5330 0.5330 4.3044 4.3044 6.4690 6.4690 6.6075 6.6075 8.1175 8.1175 8.3485 8.3485 9.1829 9.1829 k = 0.2150-0.1681 0.8460 ( 6282 PWs) bands (ev): -20.3331 -20.3331 -20.3206 -20.3206 -19.0282 -19.0282 -18.9964 -18.9964 -18.0711 -18.0711 -18.0303 -18.0303 -12.7922 -12.7922 -9.7617 -9.7617 -8.7067 -8.7067 -8.3703 -8.3703 -8.2571 -8.2571 -8.0667 -8.0667 -7.7799 -7.7799 -7.6724 -7.6724 -7.5419 -7.5419 -5.3592 -5.3592 -5.0722 -5.0722 -4.8032 -4.8032 -4.4303 -4.4303 -4.3704 -4.3704 -4.2911 -4.2911 -1.3579 -1.3579 -0.7700 -0.7700 -0.6780 -0.6780 -0.6343 -0.6343 -0.4963 -0.4963 -0.3077 -0.3077 -0.1540 -0.1540 0.5351 0.5351 4.3039 4.3039 6.4607 6.4607 6.6054 6.6054 8.1212 8.1212 8.3576 8.3576 9.2204 9.2204 k = 0.1985-0.1552 0.8460 ( 6280 PWs) bands (ev): -20.3335 -20.3335 -20.3211 -20.3211 -19.0255 -19.0255 -18.9961 -18.9961 -18.0702 -18.0702 -18.0335 -18.0335 -12.7917 -12.7917 -9.7631 -9.7631 -8.7094 -8.7094 -8.3681 -8.3681 -8.2511 -8.2511 -8.0755 -8.0755 -7.7731 -7.7731 -7.6720 -7.6720 -7.5419 -7.5419 -5.3599 -5.3599 -5.0769 -5.0769 -4.8058 -4.8058 -4.4288 -4.4288 -4.3655 -4.3655 -4.2963 -4.2963 -1.3500 -1.3500 -0.7702 -0.7702 -0.6721 -0.6721 -0.6325 -0.6325 -0.4906 -0.4906 -0.3083 -0.3083 -0.1714 -0.1714 0.5371 0.5371 4.3034 4.3034 6.4525 6.4525 6.6034 6.6034 8.1226 8.1226 8.3642 8.3642 9.2598 9.2598 k = 0.1819-0.1422 0.8460 ( 6274 PWs) bands (ev): -20.3339 -20.3339 -20.3215 -20.3215 -19.0228 -19.0228 -18.9959 -18.9959 -18.0694 -18.0694 -18.0366 -18.0366 -12.7911 -12.7911 -9.7644 -9.7644 -8.7120 -8.7120 -8.3660 -8.3660 -8.2450 -8.2450 -8.0844 -8.0844 -7.7664 -7.7664 -7.6716 -7.6716 -7.5420 -7.5420 -5.3610 -5.3610 -5.0813 -5.0813 -4.8075 -4.8075 -4.4277 -4.4277 -4.3608 -4.3608 -4.3013 -4.3013 -1.3423 -1.3423 -0.7704 -0.7704 -0.6665 -0.6665 -0.6316 -0.6316 -0.4840 -0.4840 -0.3089 -0.3089 -0.1885 -0.1885 0.5392 0.5392 4.3029 4.3029 6.4443 6.4443 6.6018 6.6018 8.1217 8.1217 8.3686 8.3686 9.2974 9.2974 k = 0.1654-0.1293 0.8460 ( 6278 PWs) bands (ev): -20.3343 -20.3343 -20.3219 -20.3219 -19.0202 -19.0202 -18.9958 -18.9958 -18.0686 -18.0686 -18.0396 -18.0396 -12.7907 -12.7907 -9.7658 -9.7658 -8.7144 -8.7144 -8.3639 -8.3639 -8.2389 -8.2389 -8.0932 -8.0932 -7.7600 -7.7600 -7.6713 -7.6713 -7.5420 -7.5420 -5.3623 -5.3623 -5.0855 -5.0855 -4.8085 -4.8085 -4.4271 -4.4271 -4.3564 -4.3564 -4.3060 -4.3060 -1.3350 -1.3350 -0.7706 -0.7706 -0.6611 -0.6611 -0.6316 -0.6316 -0.4763 -0.4763 -0.3096 -0.3096 -0.2052 -0.2052 0.5413 0.5413 4.3025 4.3025 6.4362 6.4362 6.6004 6.6004 8.1190 8.1190 8.3714 8.3714 9.3280 9.3280 k = 0.1488-0.1164 0.8460 ( 6274 PWs) bands (ev): -20.3347 -20.3347 -20.3223 -20.3223 -19.0177 -19.0177 -18.9957 -18.9957 -18.0678 -18.0678 -18.0424 -18.0424 -12.7902 -12.7902 -9.7670 -9.7670 -8.7167 -8.7167 -8.3618 -8.3618 -8.2328 -8.2328 -8.1021 -8.1021 -7.7538 -7.7538 -7.6711 -7.6711 -7.5421 -7.5421 -5.3639 -5.3639 -5.0894 -5.0894 -4.8087 -4.8087 -4.4269 -4.4269 -4.3523 -4.3523 -4.3104 -4.3104 -1.3281 -1.3281 -0.7708 -0.7708 -0.6560 -0.6560 -0.6324 -0.6324 -0.4676 -0.4676 -0.3103 -0.3103 -0.2215 -0.2215 0.5433 0.5433 4.3020 4.3020 6.4284 6.4284 6.5992 6.5992 8.1147 8.1147 8.3729 8.3729 9.3470 9.3471 k = 0.1323-0.1035 0.8460 ( 6276 PWs) bands (ev): -20.3351 -20.3351 -20.3227 -20.3227 -19.0153 -19.0153 -18.9957 -18.9957 -18.0671 -18.0671 -18.0451 -18.0451 -12.7898 -12.7898 -9.7681 -9.7681 -8.7187 -8.7187 -8.3598 -8.3598 -8.2267 -8.2267 -8.1108 -8.1108 -7.7480 -7.7480 -7.6709 -7.6709 -7.5421 -7.5421 -5.3656 -5.3656 -5.0930 -5.0930 -4.8085 -4.8085 -4.4270 -4.4270 -4.3485 -4.3485 -4.3145 -4.3145 -1.3217 -1.3217 -0.7710 -0.7710 -0.6514 -0.6514 -0.6338 -0.6338 -0.4580 -0.4580 -0.3110 -0.3110 -0.2373 -0.2373 0.5452 0.5452 4.3015 4.3015 6.4209 6.4209 6.5983 6.5983 8.1093 8.1093 8.3734 8.3734 9.3543 9.3544 k = 0.1158-0.0905 0.8460 ( 6274 PWs) bands (ev): -20.3354 -20.3354 -20.3230 -20.3230 -19.0129 -19.0129 -18.9958 -18.9958 -18.0664 -18.0664 -18.0474 -18.0474 -12.7894 -12.7894 -9.7692 -9.7692 -8.7205 -8.7205 -8.3578 -8.3578 -8.2205 -8.2205 -8.1195 -8.1195 -7.7426 -7.7426 -7.6709 -7.6709 -7.5422 -7.5422 -5.3674 -5.3674 -5.0963 -5.0963 -4.8078 -4.8078 -4.4273 -4.4273 -4.3451 -4.3451 -4.3182 -4.3182 -1.3158 -1.3158 -0.7712 -0.7712 -0.6471 -0.6471 -0.6357 -0.6357 -0.4478 -0.4478 -0.3117 -0.3117 -0.2527 -0.2527 0.5470 0.5470 4.3011 4.3011 6.4140 6.4140 6.5977 6.5977 8.1032 8.1032 8.3734 8.3734 9.3540 9.3540 k = 0.0992-0.0776 0.8460 ( 6278 PWs) bands (ev): -20.3357 -20.3357 -20.3233 -20.3233 -19.0107 -19.0107 -18.9960 -18.9960 -18.0659 -18.0659 -18.0496 -18.0496 -12.7891 -12.7891 -9.7701 -9.7701 -8.7222 -8.7222 -8.3561 -8.3561 -8.2143 -8.2143 -8.1279 -8.1279 -7.7378 -7.7378 -7.6709 -7.6709 -7.5423 -7.5423 -5.3691 -5.3691 -5.0991 -5.0991 -4.8068 -4.8068 -4.4277 -4.4277 -4.3422 -4.3422 -4.3214 -4.3214 -1.3107 -1.3107 -0.7713 -0.7713 -0.6434 -0.6434 -0.6377 -0.6377 -0.4369 -0.4369 -0.3124 -0.3124 -0.2675 -0.2675 0.5487 0.5487 4.3007 4.3007 6.4078 6.4078 6.5972 6.5972 8.0969 8.0969 8.3729 8.3729 9.3494 9.3497 k = 0.0827-0.0647 0.8460 ( 6274 PWs) bands (ev): -20.3359 -20.3359 -20.3236 -20.3236 -19.0087 -19.0087 -18.9963 -18.9963 -18.0654 -18.0654 -18.0514 -18.0514 -12.7888 -12.7888 -9.7709 -9.7709 -8.7235 -8.7235 -8.3545 -8.3545 -8.2079 -8.2079 -8.1362 -8.1362 -7.7335 -7.7335 -7.6710 -7.6710 -7.5424 -7.5424 -5.3708 -5.3708 -5.1016 -5.1016 -4.8057 -4.8057 -4.4283 -4.4283 -4.3396 -4.3396 -4.3242 -4.3242 -1.3062 -1.3062 -0.7714 -0.7714 -0.6402 -0.6402 -0.6398 -0.6398 -0.4257 -0.4257 -0.3132 -0.3132 -0.2817 -0.2817 0.5501 0.5501 4.3004 4.3004 6.4022 6.4022 6.5969 6.5969 8.0908 8.0908 8.3723 8.3723 9.3439 9.3440 k = 0.0662-0.0517 0.8460 ( 6270 PWs) bands (ev): -20.3361 -20.3361 -20.3238 -20.3238 -19.0068 -19.0068 -18.9968 -18.9968 -18.0650 -18.0650 -18.0530 -18.0530 -12.7885 -12.7885 -9.7716 -9.7716 -8.7247 -8.7247 -8.3532 -8.3532 -8.2015 -8.2015 -8.1443 -8.1443 -7.7298 -7.7298 -7.6711 -7.6711 -7.5425 -7.5425 -5.3722 -5.3722 -5.1036 -5.1036 -4.8046 -4.8046 -4.4288 -4.4288 -4.3375 -4.3375 -4.3266 -4.3266 -1.3024 -1.3024 -0.7716 -0.7716 -0.6419 -0.6419 -0.6374 -0.6374 -0.4142 -0.4142 -0.3143 -0.3143 -0.2950 -0.2950 0.5514 0.5514 4.3001 4.3001 6.3975 6.3975 6.5967 6.5967 8.0853 8.0853 8.3715 8.3715 9.3382 9.3382 k = 0.0496-0.0388 0.8460 ( 6274 PWs) bands (ev): -20.3363 -20.3363 -20.3239 -20.3239 -19.0051 -19.0051 -18.9973 -18.9973 -18.0647 -18.0647 -18.0542 -18.0542 -12.7883 -12.7883 -9.7721 -9.7721 -8.7255 -8.7255 -8.3521 -8.3521 -8.1950 -8.1950 -8.1522 -8.1522 -7.7269 -7.7269 -7.6713 -7.6713 -7.5425 -7.5425 -5.3734 -5.3734 -5.1052 -5.1052 -4.8037 -4.8037 -4.4293 -4.4293 -4.3359 -4.3359 -4.3284 -4.3284 -1.2995 -1.2995 -0.7717 -0.7717 -0.6436 -0.6436 -0.6353 -0.6353 -0.4029 -0.4029 -0.3168 -0.3168 -0.3059 -0.3059 0.5523 0.5523 4.2998 4.2998 6.3938 6.3938 6.5966 6.5966 8.0806 8.0806 8.3709 8.3709 9.3332 9.3332 k = 0.0331-0.0259 0.8460 ( 6272 PWs) bands (ev): -20.3364 -20.3364 -20.3240 -20.3240 -19.0037 -19.0037 -18.9980 -18.9980 -18.0644 -18.0644 -18.0551 -18.0551 -12.7882 -12.7882 -9.7725 -9.7725 -8.7262 -8.7262 -8.3513 -8.3513 -8.1884 -8.1884 -8.1599 -8.1599 -7.7247 -7.7247 -7.6715 -7.6715 -7.5426 -7.5426 -5.3743 -5.3743 -5.1063 -5.1063 -4.8029 -4.8029 -4.4297 -4.4297 -4.3347 -4.3347 -4.3297 -4.3297 -1.2973 -1.2973 -0.7717 -0.7717 -0.6449 -0.6449 -0.6338 -0.6338 -0.3922 -0.3922 -0.3241 -0.3241 -0.3108 -0.3108 0.5531 0.5531 4.2997 4.2997 6.3911 6.3911 6.5965 6.5965 8.0771 8.0771 8.3703 8.3703 9.3295 9.3295 k = 0.0165-0.0129 0.8460 ( 6280 PWs) bands (ev): -20.3364 -20.3364 -20.3241 -20.3241 -19.0026 -19.0026 -18.9986 -18.9986 -18.0643 -18.0643 -18.0556 -18.0556 -12.7881 -12.7881 -9.7727 -9.7727 -8.7266 -8.7266 -8.3508 -8.3508 -8.1816 -8.1816 -8.1673 -8.1673 -7.7234 -7.7234 -7.6716 -7.6716 -7.5426 -7.5426 -5.3749 -5.3749 -5.1070 -5.1070 -4.8024 -4.8024 -4.4300 -4.4300 -4.3341 -4.3341 -4.3304 -4.3304 -1.2960 -1.2960 -0.7718 -0.7718 -0.6457 -0.6457 -0.6328 -0.6328 -0.3834 -0.3834 -0.3325 -0.3325 -0.3120 -0.3120 0.5535 0.5535 4.2996 4.2996 6.3894 6.3894 6.5965 6.5965 8.0750 8.0750 8.3700 8.3700 9.3271 9.3271 k = 0.0000 0.0000 0.8460 ( 6284 PWs) bands (ev): -20.3365 -20.3365 -20.3241 -20.3241 -19.0021 -19.0021 -18.9989 -18.9989 -18.0642 -18.0642 -18.0558 -18.0558 -12.7881 -12.7881 -9.7728 -9.7728 -8.7267 -8.7267 -8.3506 -8.3506 -8.1753 -8.1753 -8.1738 -8.1738 -7.7229 -7.7229 -7.6716 -7.6716 -7.5426 -7.5426 -5.3751 -5.3751 -5.1073 -5.1073 -4.8022 -4.8022 -4.4301 -4.4301 -4.3339 -4.3339 -4.3307 -4.3307 -1.2956 -1.2956 -0.7718 -0.7718 -0.6460 -0.6460 -0.6325 -0.6325 -0.3797 -0.3797 -0.3362 -0.3362 -0.3123 -0.3123 0.5536 0.5536 4.2995 4.2995 6.3888 6.3888 6.5964 6.5964 8.0742 8.0742 8.3699 8.3699 9.3263 9.3263 k = 0.0000 0.0000 0.8460 ( 6284 PWs) bands (ev): -20.3365 -20.3365 -20.3241 -20.3241 -19.0021 -19.0021 -18.9989 -18.9989 -18.0642 -18.0642 -18.0558 -18.0558 -12.7881 -12.7881 -9.7728 -9.7728 -8.7267 -8.7267 -8.3506 -8.3506 -8.1753 -8.1753 -8.1738 -8.1738 -7.7229 -7.7229 -7.6716 -7.6716 -7.5426 -7.5426 -5.3751 -5.3751 -5.1073 -5.1073 -4.8022 -4.8022 -4.4301 -4.4301 -4.3339 -4.3339 -4.3307 -4.3307 -1.2956 -1.2956 -0.7718 -0.7718 -0.6460 -0.6460 -0.6325 -0.6325 -0.3797 -0.3797 -0.3362 -0.3362 -0.3123 -0.3123 0.5536 0.5536 4.2995 4.2995 6.3888 6.3888 6.5964 6.5964 8.0742 8.0742 8.3699 8.3699 9.3263 9.3263 k = 0.0126 0.0162 0.8460 ( 6278 PWs) bands (ev): -20.3364 -20.3364 -20.3241 -20.3241 -19.0023 -19.0023 -18.9989 -18.9989 -18.0641 -18.0641 -18.0558 -18.0558 -12.7881 -12.7881 -9.7736 -9.7736 -8.7251 -8.7251 -8.3506 -8.3506 -8.1752 -8.1752 -8.1734 -8.1734 -7.7229 -7.7229 -7.6721 -7.6721 -7.5439 -7.5439 -5.3740 -5.3740 -5.1076 -5.1076 -4.8023 -4.8023 -4.4315 -4.4315 -4.3335 -4.3335 -4.3295 -4.3295 -1.2961 -1.2961 -0.7724 -0.7724 -0.6459 -0.6459 -0.6328 -0.6328 -0.3833 -0.3833 -0.3354 -0.3354 -0.3088 -0.3088 0.5539 0.5539 4.3000 4.3000 6.3889 6.3889 6.5961 6.5961 8.0731 8.0731 8.3707 8.3707 9.3164 9.3164 k = 0.0253 0.0323 0.8460 ( 6278 PWs) bands (ev): -20.3363 -20.3363 -20.3241 -20.3241 -19.0027 -19.0027 -18.9990 -18.9990 -18.0637 -18.0637 -18.0558 -18.0558 -12.7880 -12.7880 -9.7759 -9.7759 -8.7202 -8.7202 -8.3506 -8.3506 -8.1746 -8.1746 -8.1725 -8.1725 -7.7228 -7.7228 -7.6737 -7.6737 -7.5478 -7.5478 -5.3708 -5.3708 -5.1086 -5.1086 -4.8026 -4.8026 -4.4357 -4.4357 -4.3322 -4.3322 -4.3262 -4.3262 -1.2975 -1.2975 -0.7742 -0.7742 -0.6456 -0.6456 -0.6336 -0.6336 -0.3923 -0.3923 -0.3331 -0.3331 -0.2998 -0.2998 0.5545 0.5545 4.3012 4.3012 6.3892 6.3892 6.5950 6.5950 8.0699 8.0699 8.3731 8.3731 9.3017 9.3017 k = 0.0379 0.0485 0.8460 ( 6273 PWs) bands (ev): -20.3362 -20.3362 -20.3241 -20.3241 -19.0034 -19.0034 -18.9991 -18.9991 -18.0629 -18.0629 -18.0559 -18.0559 -12.7879 -12.7879 -9.7796 -9.7796 -8.7122 -8.7122 -8.3506 -8.3506 -8.1737 -8.1737 -8.1708 -8.1708 -7.7226 -7.7226 -7.6766 -7.6766 -7.5538 -7.5538 -5.3656 -5.3656 -5.1102 -5.1102 -4.8031 -4.8031 -4.4420 -4.4420 -4.3299 -4.3299 -4.3214 -4.3214 -1.2997 -1.2997 -0.7772 -0.7772 -0.6453 -0.6453 -0.6349 -0.6349 -0.4038 -0.4038 -0.3299 -0.3299 -0.2879 -0.2879 0.5556 0.5556 4.3033 4.3033 6.3897 6.3897 6.5932 6.5932 8.0648 8.0648 8.3768 8.3768 9.2864 9.2864 k = 0.0506 0.0647 0.8460 ( 6278 PWs) bands (ev): -20.3360 -20.3360 -20.3241 -20.3241 -19.0044 -19.0044 -18.9992 -18.9992 -18.0619 -18.0619 -18.0560 -18.0560 -12.7877 -12.7877 -9.7846 -9.7846 -8.7013 -8.7013 -8.3505 -8.3505 -8.1724 -8.1724 -8.1686 -8.1686 -7.7224 -7.7224 -7.6813 -7.6813 -7.5615 -7.5615 -5.3584 -5.3584 -5.1125 -5.1125 -4.8037 -4.8037 -4.4499 -4.4499 -4.3267 -4.3267 -4.3158 -4.3158 -1.3029 -1.3029 -0.7814 -0.7814 -0.6450 -0.6450 -0.6365 -0.6365 -0.4163 -0.4163 -0.3256 -0.3256 -0.2747 -0.2747 0.5571 0.5571 4.3061 4.3061 6.3903 6.3903 6.5907 6.5907 8.0580 8.0580 8.3817 8.3817 9.2708 9.2708 k = 0.0632 0.0808 0.8460 ( 6280 PWs) bands (ev): -20.3358 -20.3358 -20.3240 -20.3240 -19.0057 -19.0057 -18.9994 -18.9994 -18.0606 -18.0606 -18.0562 -18.0562 -12.7875 -12.7875 -9.7906 -9.7906 -8.6878 -8.6878 -8.3505 -8.3505 -8.1706 -8.1706 -8.1657 -8.1657 -7.7222 -7.7222 -7.6884 -7.6884 -7.5700 -7.5700 -5.3494 -5.3494 -5.1154 -5.1154 -4.8044 -4.8044 -4.4589 -4.4589 -4.3227 -4.3227 -4.3098 -4.3098 -1.3069 -1.3069 -0.7866 -0.7866 -0.6452 -0.6452 -0.6377 -0.6377 -0.4289 -0.4289 -0.3204 -0.3204 -0.2611 -0.2611 0.5589 0.5589 4.3096 4.3096 6.3911 6.3911 6.5876 6.5876 8.0500 8.0500 8.3873 8.3873 9.2553 9.2553 k = 0.0758 0.0970 0.8460 ( 6288 PWs) bands (ev): -20.3355 -20.3355 -20.3240 -20.3240 -19.0072 -19.0072 -18.9996 -18.9996 -18.0591 -18.0591 -18.0563 -18.0563 -12.7873 -12.7873 -9.7975 -9.7975 -8.6720 -8.6720 -8.3504 -8.3504 -8.1684 -8.1684 -8.1622 -8.1622 -7.7219 -7.7219 -7.6988 -7.6988 -7.5782 -7.5782 -5.3387 -5.3387 -5.1189 -5.1189 -4.8052 -4.8052 -4.4684 -4.4684 -4.3179 -4.3179 -4.3038 -4.3038 -1.3117 -1.3117 -0.7929 -0.7929 -0.6465 -0.6465 -0.6379 -0.6379 -0.4413 -0.4413 -0.3143 -0.3143 -0.2475 -0.2475 0.5612 0.5612 4.3136 4.3136 6.3921 6.3921 6.5839 6.5839 8.0410 8.0410 8.3935 8.3935 9.2401 9.2401 k = 0.0885 0.1132 0.8460 ( 6288 PWs) bands (ev): -20.3352 -20.3352 -20.3239 -20.3239 -19.0090 -19.0090 -18.9999 -18.9999 -18.0573 -18.0573 -18.0565 -18.0565 -12.7871 -12.7871 -9.8048 -9.8048 -8.6543 -8.6543 -8.3504 -8.3504 -8.1656 -8.1656 -8.1581 -8.1581 -7.7220 -7.7220 -7.7127 -7.7127 -7.5854 -7.5854 -5.3265 -5.3265 -5.1229 -5.1229 -4.8059 -4.8059 -4.4782 -4.4782 -4.3125 -4.3125 -4.2981 -4.2981 -1.3172 -1.3172 -0.8000 -0.8000 -0.6492 -0.6492 -0.6369 -0.6369 -0.4531 -0.4531 -0.3075 -0.3075 -0.2343 -0.2343 0.5637 0.5637 4.3181 4.3181 6.3932 6.3932 6.5795 6.5795 8.0315 8.0315 8.3998 8.3998 9.2255 9.2255 k = 0.1011 0.1293 0.8460 ( 6298 PWs) bands (ev): -20.3348 -20.3348 -20.3238 -20.3238 -19.0111 -19.0111 -19.0002 -19.0002 -18.0568 -18.0568 -18.0553 -18.0553 -12.7869 -12.7869 -9.8125 -9.8125 -8.6351 -8.6351 -8.3503 -8.3503 -8.1623 -8.1623 -8.1534 -8.1534 -7.7326 -7.7326 -7.7201 -7.7201 -7.5908 -7.5908 -5.3131 -5.3131 -5.1275 -5.1275 -4.8067 -4.8067 -4.4881 -4.4881 -4.3066 -4.3066 -4.2930 -4.2930 -1.3234 -1.3234 -0.8078 -0.8078 -0.6526 -0.6526 -0.6352 -0.6352 -0.4644 -0.4644 -0.3000 -0.3000 -0.2216 -0.2216 0.5665 0.5665 4.3229 4.3229 6.3946 6.3946 6.5747 6.5747 8.0217 8.0217 8.4061 8.4061 9.2117 9.2117 k = 0.1138 0.1455 0.8460 ( 6308 PWs) bands (ev): -20.3344 -20.3344 -20.3237 -20.3237 -19.0133 -19.0133 -19.0005 -19.0005 -18.0570 -18.0570 -18.0530 -18.0530 -12.7868 -12.7868 -9.8201 -9.8201 -8.6149 -8.6149 -8.3503 -8.3503 -8.1584 -8.1584 -8.1482 -8.1482 -7.7549 -7.7549 -7.7200 -7.7200 -7.5946 -7.5946 -5.2987 -5.2987 -5.1325 -5.1325 -4.8073 -4.8073 -4.4979 -4.4979 -4.3002 -4.3002 -4.2885 -4.2885 -1.3302 -1.3302 -0.8162 -0.8162 -0.6565 -0.6565 -0.6329 -0.6329 -0.4750 -0.4750 -0.2918 -0.2918 -0.2095 -0.2095 0.5696 0.5696 4.3278 4.3278 6.3961 6.3961 6.5693 6.5693 8.0119 8.0119 8.4119 8.4119 9.1989 9.1989 k = 0.1264 0.1616 0.8460 ( 6300 PWs) bands (ev): -20.3340 -20.3340 -20.3235 -20.3235 -19.0158 -19.0158 -19.0008 -19.0008 -18.0573 -18.0573 -18.0506 -18.0506 -12.7866 -12.7866 -9.8276 -9.8276 -8.5940 -8.5940 -8.3502 -8.3502 -8.1539 -8.1539 -8.1425 -8.1425 -7.7809 -7.7809 -7.7194 -7.7194 -7.5967 -7.5967 -5.2835 -5.2835 -5.1380 -5.1380 -4.8078 -4.8078 -4.5073 -4.5073 -4.2937 -4.2937 -4.2846 -4.2846 -1.3376 -1.3376 -0.8249 -0.8249 -0.6607 -0.6607 -0.6302 -0.6302 -0.4850 -0.4850 -0.2832 -0.2832 -0.1982 -0.1982 0.5728 0.5728 4.3327 4.3327 6.3978 6.3978 6.5636 6.5636 8.0024 8.0024 8.4171 8.4171 9.1871 9.1871 k = 0.1390 0.1778 0.8460 ( 6298 PWs) bands (ev): -20.3337 -20.3337 -20.3233 -20.3233 -19.0184 -19.0184 -19.0012 -19.0012 -18.0576 -18.0576 -18.0480 -18.0480 -12.7866 -12.7866 -9.8345 -9.8345 -8.5730 -8.5730 -8.3502 -8.3502 -8.1488 -8.1488 -8.1364 -8.1364 -7.8098 -7.8098 -7.7187 -7.7187 -7.5975 -7.5975 -5.2677 -5.2677 -5.1437 -5.1437 -4.8080 -4.8080 -4.5163 -4.5163 -4.2877 -4.2877 -4.2809 -4.2809 -1.3453 -1.3453 -0.8338 -0.8338 -0.6651 -0.6651 -0.6271 -0.6271 -0.4944 -0.4944 -0.2742 -0.2742 -0.1876 -0.1876 0.5761 0.5761 4.3374 4.3374 6.3999 6.3999 6.5576 6.5576 7.9934 7.9934 8.4215 8.4215 9.1766 9.1766 k = 0.1517 0.1940 0.8460 ( 6301 PWs) bands (ev): -20.3333 -20.3333 -20.3231 -20.3231 -19.0212 -19.0212 -19.0016 -19.0016 -18.0579 -18.0579 -18.0452 -18.0452 -12.7865 -12.7865 -9.8408 -9.8408 -8.5521 -8.5521 -8.3501 -8.3501 -8.1433 -8.1433 -8.1298 -8.1298 -7.8405 -7.8405 -7.7180 -7.7180 -7.5974 -7.5974 -5.2517 -5.2517 -5.1497 -5.1497 -4.8079 -4.8079 -4.5248 -4.5248 -4.2837 -4.2837 -4.2761 -4.2761 -1.3534 -1.3534 -0.8426 -0.8426 -0.6697 -0.6697 -0.6237 -0.6237 -0.5034 -0.5034 -0.2648 -0.2648 -0.1779 -0.1779 0.5794 0.5794 4.3417 4.3417 6.4023 6.4023 6.5514 6.5514 7.9850 7.9850 8.4247 8.4247 9.1674 9.1674 k = 0.1643 0.2101 0.8460 ( 6291 PWs) bands (ev): -20.3330 -20.3330 -20.3228 -20.3228 -19.0241 -19.0241 -19.0020 -19.0020 -18.0582 -18.0582 -18.0422 -18.0422 -12.7866 -12.7866 -9.8461 -9.8461 -8.5318 -8.5318 -8.3501 -8.3501 -8.1378 -8.1378 -8.1227 -8.1227 -7.8722 -7.8722 -7.7172 -7.7172 -7.5965 -7.5965 -5.2359 -5.2359 -5.1556 -5.1556 -4.8075 -4.8075 -4.5327 -4.5327 -4.2823 -4.2823 -4.2697 -4.2697 -1.3619 -1.3619 -0.8511 -0.8511 -0.6744 -0.6744 -0.6200 -0.6200 -0.5119 -0.5119 -0.2550 -0.2550 -0.1690 -0.1690 0.5827 0.5827 4.3454 4.3454 6.4051 6.4051 6.5450 6.5450 7.9773 7.9773 8.4267 8.4267 9.1595 9.1595 k = 0.1770 0.2263 0.8460 ( 6292 PWs) bands (ev): -20.3327 -20.3327 -20.3224 -20.3224 -19.0271 -19.0271 -19.0024 -19.0024 -18.0586 -18.0586 -18.0392 -18.0392 -12.7868 -12.7868 -9.8505 -9.8505 -8.5125 -8.5125 -8.3501 -8.3501 -8.1331 -8.1331 -8.1154 -8.1154 -7.9035 -7.9035 -7.7164 -7.7164 -7.5951 -7.5951 -5.2211 -5.2211 -5.1608 -5.1608 -4.8066 -4.8066 -4.5398 -4.5398 -4.2827 -4.2827 -4.2627 -4.2627 -1.3705 -1.3705 -0.8591 -0.8591 -0.6791 -0.6791 -0.6161 -0.6161 -0.5200 -0.5200 -0.2448 -0.2448 -0.1611 -0.1611 0.5858 0.5858 4.3484 4.3484 6.4085 6.4085 6.5386 6.5386 7.9704 7.9704 8.4272 8.4272 9.1529 9.1529 k = 0.1896 0.2425 0.8460 ( 6298 PWs) bands (ev): -20.3325 -20.3325 -20.3220 -20.3220 -19.0303 -19.0303 -19.0028 -19.0028 -18.0589 -18.0589 -18.0361 -18.0361 -12.7871 -12.7871 -9.8537 -9.8537 -8.4944 -8.4944 -8.3500 -8.3500 -8.1307 -8.1307 -8.1078 -8.1078 -7.9326 -7.9326 -7.7155 -7.7155 -7.5933 -7.5933 -5.2088 -5.2088 -5.1638 -5.1638 -4.8052 -4.8052 -4.5461 -4.5461 -4.2844 -4.2844 -4.2557 -4.2557 -1.3792 -1.3792 -0.8663 -0.8663 -0.6839 -0.6839 -0.6120 -0.6120 -0.5279 -0.5279 -0.2344 -0.2344 -0.1541 -0.1541 0.5886 0.5886 4.3505 4.3505 6.4124 6.4124 6.5323 6.5323 7.9643 7.9643 8.4261 8.4261 9.1475 9.1475 k = 0.2022 0.2586 0.8460 ( 6309 PWs) bands (ev): -20.3323 -20.3323 -20.3215 -20.3215 -19.0336 -19.0336 -19.0033 -19.0033 -18.0593 -18.0593 -18.0329 -18.0329 -12.7875 -12.7875 -9.8556 -9.8556 -8.4777 -8.4777 -8.3500 -8.3500 -8.1329 -8.1329 -8.0999 -8.0999 -7.9567 -7.9567 -7.7145 -7.7145 -7.5912 -7.5912 -5.2024 -5.2024 -5.1615 -5.1615 -4.8032 -4.8032 -4.5515 -4.5515 -4.2873 -4.2873 -4.2489 -4.2489 -1.3880 -1.3880 -0.8728 -0.8728 -0.6888 -0.6888 -0.6079 -0.6079 -0.5355 -0.5355 -0.2236 -0.2236 -0.1480 -0.1480 0.5912 0.5912 4.3515 4.3515 6.4170 6.4170 6.5261 6.5261 7.9591 7.9591 8.4232 8.4232 9.1428 9.1432 k = 0.2149 0.2748 0.8460 ( 6309 PWs) bands (ev): -20.3322 -20.3322 -20.3209 -20.3209 -19.0368 -19.0368 -19.0037 -19.0037 -18.0597 -18.0597 -18.0296 -18.0296 -12.7880 -12.7880 -9.8562 -9.8562 -8.4626 -8.4626 -8.3500 -8.3500 -8.1429 -8.1429 -8.0919 -8.0919 -7.9725 -7.9725 -7.7136 -7.7136 -7.5889 -7.5889 -5.2032 -5.2032 -5.1526 -5.1526 -4.8006 -4.8006 -4.5559 -4.5559 -4.2914 -4.2914 -4.2423 -4.2423 -1.3968 -1.3968 -0.8782 -0.8782 -0.6935 -0.6935 -0.6038 -0.6038 -0.5429 -0.5429 -0.2124 -0.2124 -0.1430 -0.1430 0.5933 0.5933 4.3513 4.3513 6.4224 6.4224 6.5203 6.5203 7.9548 7.9548 8.4183 8.4183 9.1136 9.1136 k = 0.2275 0.2910 0.8460 ( 6313 PWs) bands (ev): -20.3321 -20.3321 -20.3203 -20.3203 -19.0402 -19.0402 -19.0041 -19.0041 -18.0601 -18.0601 -18.0264 -18.0264 -12.7886 -12.7886 -9.8555 -9.8555 -8.4492 -8.4492 -8.3500 -8.3500 -8.1622 -8.1622 -8.0837 -8.0837 -7.9783 -7.9783 -7.7125 -7.7125 -7.5865 -7.5865 -5.2084 -5.2084 -5.1400 -5.1400 -4.7974 -4.7974 -4.5594 -4.5594 -4.2967 -4.2967 -4.2361 -4.2361 -1.4055 -1.4055 -0.8824 -0.8824 -0.6983 -0.6983 -0.5998 -0.5998 -0.5501 -0.5501 -0.2009 -0.2009 -0.1390 -0.1390 0.5949 0.5949 4.3498 4.3498 6.4286 6.4286 6.5148 6.5148 7.9512 7.9512 8.4115 8.4115 9.0863 9.0863 k = 0.2402 0.3071 0.8460 ( 6311 PWs) bands (ev): -20.3321 -20.3321 -20.3197 -20.3197 -19.0435 -19.0435 -19.0046 -19.0046 -18.0605 -18.0605 -18.0231 -18.0231 -12.7893 -12.7893 -9.8533 -9.8533 -8.4373 -8.4373 -8.3500 -8.3500 -8.1894 -8.1894 -8.0753 -8.0753 -7.9754 -7.9754 -7.7115 -7.7115 -7.5840 -7.5840 -5.2154 -5.2154 -5.1263 -5.1263 -4.7935 -4.7935 -4.5619 -4.5619 -4.3032 -4.3032 -4.2302 -4.2302 -1.4140 -1.4140 -0.8855 -0.8855 -0.7029 -0.7029 -0.5959 -0.5959 -0.5572 -0.5572 -0.1890 -0.1890 -0.1359 -0.1359 0.5959 0.5959 4.3469 4.3469 6.4356 6.4356 6.5099 6.5099 7.9484 7.9484 8.4025 8.4025 9.0600 9.0600 k = 0.2528 0.3233 0.8460 ( 6315 PWs) bands (ev): -20.3322 -20.3322 -20.3190 -20.3190 -19.0468 -19.0468 -19.0050 -19.0050 -18.0609 -18.0609 -18.0199 -18.0199 -12.7901 -12.7901 -9.8498 -9.8498 -8.4271 -8.4271 -8.3500 -8.3500 -8.2218 -8.2218 -8.0670 -8.0670 -7.9665 -7.9665 -7.7105 -7.7105 -7.5814 -7.5814 -5.2232 -5.2232 -5.1126 -5.1126 -4.7888 -4.7888 -4.5633 -4.5633 -4.3107 -4.3107 -4.2249 -4.2249 -1.4224 -1.4224 -0.8872 -0.8872 -0.7074 -0.7074 -0.5922 -0.5922 -0.5640 -0.5640 -0.1767 -0.1767 -0.1340 -0.1340 0.5962 0.5962 4.3426 4.3426 6.4435 6.4435 6.5057 6.5057 7.9462 7.9462 8.3913 8.3913 9.0347 9.0347 k = 0.2528 0.3233 0.8460 ( 6315 PWs) bands (ev): -20.3322 -20.3322 -20.3190 -20.3190 -19.0468 -19.0468 -19.0050 -19.0050 -18.0609 -18.0609 -18.0199 -18.0199 -12.7901 -12.7901 -9.8498 -9.8498 -8.4271 -8.4271 -8.3500 -8.3500 -8.2218 -8.2218 -8.0670 -8.0670 -7.9665 -7.9665 -7.7105 -7.7105 -7.5814 -7.5814 -5.2232 -5.2232 -5.1126 -5.1126 -4.7888 -4.7888 -4.5633 -4.5633 -4.3107 -4.3107 -4.2249 -4.2249 -1.4224 -1.4224 -0.8872 -0.8872 -0.7074 -0.7074 -0.5922 -0.5922 -0.5640 -0.5640 -0.1767 -0.1767 -0.1340 -0.1340 0.5962 0.5962 4.3426 4.3426 6.4435 6.4435 6.5057 6.5057 7.9462 7.9462 8.3913 8.3913 9.0347 9.0347 k = 0.2639 0.3376 0.8356 ( 6316 PWs) bands (ev): -20.3324 -20.3324 -20.3180 -20.3180 -19.0484 -19.0484 -19.0050 -19.0050 -18.0618 -18.0618 -18.0176 -18.0176 -12.7904 -12.7904 -9.8479 -9.8479 -8.4185 -8.4185 -8.3523 -8.3523 -8.2489 -8.2489 -8.0601 -8.0601 -7.9595 -7.9595 -7.7088 -7.7088 -7.5801 -7.5801 -5.2313 -5.2313 -5.1027 -5.1027 -4.7870 -4.7870 -4.5641 -4.5641 -4.3157 -4.3157 -4.2208 -4.2208 -1.4278 -1.4278 -0.8873 -0.8873 -0.7134 -0.7134 -0.5919 -0.5919 -0.5666 -0.5666 -0.1658 -0.1658 -0.1344 -0.1344 0.5958 0.5958 4.3448 4.3448 6.4534 6.4534 6.5047 6.5047 7.9405 7.9405 8.3895 8.3895 9.0315 9.0315 k = 0.2751 0.3518 0.8252 ( 6317 PWs) bands (ev): -20.3327 -20.3327 -20.3170 -20.3170 -19.0498 -19.0498 -19.0050 -19.0050 -18.0628 -18.0628 -18.0155 -18.0155 -12.7908 -12.7908 -9.8452 -9.8452 -8.4106 -8.4106 -8.3547 -8.3547 -8.2768 -8.2768 -8.0533 -8.0533 -7.9514 -7.9514 -7.7071 -7.7071 -7.5787 -7.5787 -5.2396 -5.2396 -5.0933 -5.0933 -4.7844 -4.7844 -4.5644 -4.5644 -4.3211 -4.3211 -4.2172 -4.2172 -1.4329 -1.4329 -0.8860 -0.8860 -0.7192 -0.7192 -0.5921 -0.5921 -0.5690 -0.5690 -0.1551 -0.1551 -0.1353 -0.1353 0.5949 0.5949 4.3460 4.3460 6.4637 6.4637 6.5045 6.5045 7.9359 7.9359 8.3835 8.3835 9.0297 9.0297 k = 0.2862 0.3661 0.8147 ( 6308 PWs) bands (ev): -20.3328 -20.3328 -20.3161 -20.3161 -19.0512 -19.0512 -19.0050 -19.0050 -18.0639 -18.0639 -18.0133 -18.0133 -12.7912 -12.7912 -9.8417 -9.8417 -8.4036 -8.4036 -8.3571 -8.3571 -8.3050 -8.3050 -8.0466 -8.0466 -7.9428 -7.9428 -7.7054 -7.7054 -7.5772 -7.5772 -5.2481 -5.2481 -5.0844 -5.0844 -4.7812 -4.7812 -4.5643 -4.5643 -4.3269 -4.3269 -4.2141 -4.2141 -1.4375 -1.4375 -0.8833 -0.8833 -0.7249 -0.7249 -0.5929 -0.5929 -0.5713 -0.5713 -0.1468 -0.1468 -0.1344 -0.1344 0.5934 0.5934 4.3463 4.3463 6.4743 6.4743 6.5050 6.5050 7.9323 7.9323 8.3735 8.3735 9.0292 9.0292 k = 0.2974 0.3803 0.8043 ( 6301 PWs) bands (ev): -20.3329 -20.3329 -20.3153 -20.3153 -19.0525 -19.0525 -19.0049 -19.0049 -18.0650 -18.0650 -18.0113 -18.0113 -12.7917 -12.7917 -9.8374 -9.8374 -8.3979 -8.3979 -8.3594 -8.3594 -8.3325 -8.3325 -8.0401 -8.0401 -7.9338 -7.9338 -7.7036 -7.7036 -7.5755 -7.5755 -5.2569 -5.2569 -5.0760 -5.0760 -4.7772 -4.7772 -4.5636 -4.5636 -4.3330 -4.3330 -4.2116 -4.2116 -1.4417 -1.4417 -0.8794 -0.8794 -0.7302 -0.7302 -0.5944 -0.5944 -0.5734 -0.5734 -0.1464 -0.1464 -0.1263 -0.1263 0.5913 0.5913 4.3458 4.3458 6.4851 6.4851 6.5062 6.5062 7.9298 7.9298 8.3599 8.3599 9.0301 9.0301 k = 0.3085 0.3946 0.7939 ( 6295 PWs) bands (ev): -20.3330 -20.3330 -20.3147 -20.3147 -19.0536 -19.0536 -19.0048 -19.0048 -18.0661 -18.0661 -18.0093 -18.0093 -12.7922 -12.7922 -9.8325 -9.8325 -8.3959 -8.3959 -8.3617 -8.3617 -8.3568 -8.3568 -8.0336 -8.0336 -7.9248 -7.9248 -7.7018 -7.7018 -7.5738 -7.5738 -5.2658 -5.2658 -5.0681 -5.0681 -4.7726 -4.7726 -4.5624 -4.5624 -4.3395 -4.3395 -4.2097 -4.2097 -1.4455 -1.4455 -0.8741 -0.8741 -0.7353 -0.7353 -0.5966 -0.5966 -0.5752 -0.5752 -0.1502 -0.1502 -0.1146 -0.1146 0.5887 0.5887 4.3445 4.3445 6.4961 6.4961 6.5081 6.5081 7.9284 7.9284 8.3434 8.3434 9.0322 9.0322 k = 0.3197 0.4088 0.7835 ( 6288 PWs) bands (ev): -20.3330 -20.3330 -20.3141 -20.3141 -19.0547 -19.0547 -19.0047 -19.0047 -18.0672 -18.0672 -18.0074 -18.0074 -12.7927 -12.7927 -9.8269 -9.8269 -8.4059 -8.4059 -8.3692 -8.3692 -8.3640 -8.3640 -8.0274 -8.0274 -7.9159 -7.9159 -7.7001 -7.7001 -7.5719 -7.5719 -5.2748 -5.2748 -5.0608 -5.0608 -4.7675 -4.7675 -4.5608 -4.5608 -4.3463 -4.3463 -4.2083 -4.2083 -1.4488 -1.4488 -0.8678 -0.8678 -0.7401 -0.7401 -0.5994 -0.5994 -0.5768 -0.5768 -0.1556 -0.1556 -0.1020 -0.1020 0.5855 0.5855 4.3425 4.3425 6.5071 6.5071 6.5107 6.5107 7.9280 7.9280 8.3245 8.3245 9.0356 9.0356 k = 0.3308 0.4231 0.7731 ( 6284 PWs) bands (ev): -20.3329 -20.3329 -20.3136 -20.3136 -19.0557 -19.0557 -19.0046 -19.0046 -18.0684 -18.0684 -18.0055 -18.0055 -12.7933 -12.7933 -9.8208 -9.8208 -8.4285 -8.4285 -8.3690 -8.3690 -8.3663 -8.3663 -8.0214 -8.0214 -7.9074 -7.9074 -7.6983 -7.6983 -7.5699 -7.5699 -5.2838 -5.2838 -5.0540 -5.0540 -4.7618 -4.7618 -4.5587 -4.5587 -4.3534 -4.3534 -4.2075 -4.2075 -1.4517 -1.4517 -0.8605 -0.8605 -0.7445 -0.7445 -0.6030 -0.6030 -0.5780 -0.5780 -0.1622 -0.1622 -0.0889 -0.0889 0.5817 0.5817 4.3399 4.3399 6.5137 6.5137 6.5181 6.5181 7.9285 7.9285 8.3037 8.3037 9.0403 9.0403 k = 0.3420 0.4374 0.7627 ( 6290 PWs) bands (ev): -20.3328 -20.3328 -20.3132 -20.3132 -19.0566 -19.0566 -19.0044 -19.0044 -18.0695 -18.0695 -18.0038 -18.0038 -12.7939 -12.7939 -9.8143 -9.8143 -8.4542 -8.4542 -8.3685 -8.3685 -8.3652 -8.3652 -8.0156 -8.0156 -7.8993 -7.8993 -7.6967 -7.6967 -7.5678 -7.5678 -5.2928 -5.2928 -5.0477 -5.0477 -4.7556 -4.7556 -4.5561 -4.5561 -4.3608 -4.3608 -4.2072 -4.2072 -1.4541 -1.4541 -0.8524 -0.8524 -0.7484 -0.7484 -0.6072 -0.6072 -0.5787 -0.5787 -0.1697 -0.1697 -0.0755 -0.0755 0.5774 0.5774 4.3368 4.3368 6.5174 6.5174 6.5288 6.5288 7.9298 7.9298 8.2816 8.2816 9.0462 9.0462 k = 0.3531 0.4516 0.7523 ( 6294 PWs) bands (ev): -20.3326 -20.3326 -20.3130 -20.3130 -19.0574 -19.0574 -19.0042 -19.0042 -18.0706 -18.0706 -18.0022 -18.0022 -12.7945 -12.7945 -9.8073 -9.8073 -8.4801 -8.4801 -8.3707 -8.3707 -8.3610 -8.3610 -8.0101 -8.0101 -7.8917 -7.8917 -7.6950 -7.6950 -7.5656 -7.5656 -5.3017 -5.3017 -5.0418 -5.0418 -4.7491 -4.7491 -4.5531 -4.5531 -4.3683 -4.3683 -4.2074 -4.2074 -1.4561 -1.4561 -0.8436 -0.8436 -0.7518 -0.7518 -0.6120 -0.6120 -0.5788 -0.5788 -0.1781 -0.1781 -0.0620 -0.0620 0.5727 0.5727 4.3333 4.3333 6.5215 6.5215 6.5394 6.5394 7.9319 7.9319 8.2587 8.2587 9.0533 9.0533 k = 0.3643 0.4659 0.7419 ( 6298 PWs) bands (ev): -20.3324 -20.3324 -20.3128 -20.3128 -19.0581 -19.0581 -19.0041 -19.0041 -18.0718 -18.0718 -18.0006 -18.0006 -12.7951 -12.7951 -9.8002 -9.8002 -8.5053 -8.5053 -8.3728 -8.3728 -8.3567 -8.3567 -8.0049 -8.0049 -7.8847 -7.8847 -7.6934 -7.6934 -7.5634 -7.5634 -5.3104 -5.3104 -5.0365 -5.0365 -4.7424 -4.7424 -4.5497 -4.5497 -4.3760 -4.3760 -4.2081 -4.2081 -1.4577 -1.4577 -0.8344 -0.8344 -0.7548 -0.7548 -0.6173 -0.6173 -0.5783 -0.5783 -0.1873 -0.1873 -0.0485 -0.0485 0.5675 0.5675 4.3295 4.3295 6.5259 6.5259 6.5495 6.5495 7.9345 7.9345 8.2355 8.2355 9.0615 9.0615 k = 0.3754 0.4801 0.7315 ( 6296 PWs) bands (ev): -20.3321 -20.3321 -20.3127 -20.3127 -19.0587 -19.0587 -19.0038 -19.0038 -18.0729 -18.0729 -17.9992 -17.9992 -12.7956 -12.7956 -9.7929 -9.7929 -8.5294 -8.5294 -8.3748 -8.3748 -8.3525 -8.3525 -8.0000 -8.0000 -7.8784 -7.8784 -7.6918 -7.6918 -7.5611 -7.5611 -5.3189 -5.3189 -5.0317 -5.0317 -4.7355 -4.7355 -4.5459 -4.5459 -4.3838 -4.3838 -4.2092 -4.2092 -1.4590 -1.4590 -0.8251 -0.8251 -0.7572 -0.7572 -0.6232 -0.6232 -0.5769 -0.5769 -0.1972 -0.1972 -0.0351 -0.0351 0.5620 0.5620 4.3256 4.3256 6.5306 6.5306 6.5593 6.5593 7.9377 7.9377 8.2124 8.2124 9.0708 9.0708 k = 0.3866 0.4944 0.7211 ( 6296 PWs) bands (ev): -20.3317 -20.3317 -20.3127 -20.3127 -19.0592 -19.0592 -19.0036 -19.0036 -18.0739 -18.0739 -17.9979 -17.9979 -12.7962 -12.7962 -9.7856 -9.7856 -8.5521 -8.5521 -8.3767 -8.3767 -8.3486 -8.3486 -7.9955 -7.9955 -7.8728 -7.8728 -7.6903 -7.6903 -7.5588 -7.5588 -5.3271 -5.3271 -5.0273 -5.0273 -4.7286 -4.7286 -4.5417 -4.5417 -4.3916 -4.3916 -4.2106 -4.2106 -1.4599 -1.4599 -0.8158 -0.8158 -0.7591 -0.7591 -0.6295 -0.6295 -0.5747 -0.5747 -0.2077 -0.2077 -0.0219 -0.0219 0.5563 0.5563 4.3217 4.3217 6.5355 6.5355 6.5684 6.5684 7.9412 7.9412 8.1898 8.1898 9.0811 9.0811 k = 0.3977 0.5086 0.7107 ( 6298 PWs) bands (ev): -20.3314 -20.3314 -20.3128 -20.3128 -19.0597 -19.0597 -19.0034 -19.0034 -18.0750 -18.0750 -17.9967 -17.9967 -12.7967 -12.7967 -9.7785 -9.7785 -8.5734 -8.5734 -8.3785 -8.3785 -8.3450 -8.3450 -7.9913 -7.9913 -7.8679 -7.8679 -7.6889 -7.6889 -7.5565 -7.5565 -5.3348 -5.3348 -5.0234 -5.0234 -4.7218 -4.7218 -4.5373 -4.5373 -4.3994 -4.3994 -4.2122 -4.2122 -1.4605 -1.4605 -0.8069 -0.8069 -0.7604 -0.7604 -0.6362 -0.6362 -0.5714 -0.5714 -0.2188 -0.2188 -0.0092 -0.0092 0.5505 0.5505 4.3178 4.3178 6.5404 6.5404 6.5769 6.5769 7.9447 7.9447 8.1682 8.1682 9.0923 9.0923 k = 0.4089 0.5229 0.7003 ( 6299 PWs) bands (ev): -20.3310 -20.3310 -20.3130 -20.3130 -19.0600 -19.0600 -19.0032 -19.0032 -18.0759 -18.0759 -17.9957 -17.9957 -12.7972 -12.7972 -9.7716 -9.7716 -8.5928 -8.5928 -8.3802 -8.3802 -8.3416 -8.3416 -7.9875 -7.9875 -7.8638 -7.8638 -7.6876 -7.6876 -7.5543 -7.5543 -5.3421 -5.3421 -5.0199 -5.0199 -4.7152 -4.7152 -4.5326 -4.5326 -4.4070 -4.4070 -4.2140 -4.2140 -1.4608 -1.4608 -0.7985 -0.7985 -0.7611 -0.7611 -0.6432 -0.6432 -0.5672 -0.5672 -0.2302 -0.2302 0.0030 0.0030 0.5446 0.5446 4.3141 4.3141 6.5453 6.5453 6.5847 6.5847 7.9480 7.9480 8.1479 8.1479 9.1043 9.1043 k = 0.4200 0.5372 0.6899 ( 6297 PWs) bands (ev): -20.3305 -20.3305 -20.3132 -20.3132 -19.0602 -19.0602 -19.0029 -19.0029 -18.0769 -18.0769 -17.9948 -17.9948 -12.7977 -12.7977 -9.7652 -9.7652 -8.6104 -8.6104 -8.3818 -8.3818 -8.3385 -8.3385 -7.9842 -7.9842 -7.8604 -7.8604 -7.6863 -7.6863 -7.5522 -7.5522 -5.3489 -5.3489 -5.0169 -5.0169 -4.7088 -4.7088 -4.5279 -4.5279 -4.4143 -4.4143 -4.2160 -4.2160 -1.4608 -1.4608 -0.7909 -0.7909 -0.7613 -0.7613 -0.6503 -0.6503 -0.5619 -0.5619 -0.2418 -0.2418 0.0144 0.0144 0.5389 0.5389 4.3107 4.3107 6.5500 6.5500 6.5916 6.5916 7.9508 7.9508 8.1294 8.1294 9.1170 9.1170 k = 0.4312 0.5514 0.6795 ( 6291 PWs) bands (ev): -20.3301 -20.3301 -20.3134 -20.3134 -19.0603 -19.0603 -19.0027 -19.0027 -18.0777 -18.0777 -17.9940 -17.9940 -12.7981 -12.7981 -9.7595 -9.7595 -8.6258 -8.6258 -8.3833 -8.3833 -8.3357 -8.3357 -7.9812 -7.9812 -7.8577 -7.8577 -7.6852 -7.6852 -7.5503 -7.5503 -5.3550 -5.3550 -5.0144 -5.0144 -4.7029 -4.7029 -4.5232 -4.5232 -4.4212 -4.4212 -4.2179 -4.2179 -1.4606 -1.4606 -0.7841 -0.7841 -0.7609 -0.7609 -0.6576 -0.6576 -0.5557 -0.5557 -0.2534 -0.2534 0.0249 0.0249 0.5335 0.5335 4.3078 4.3078 6.5545 6.5545 6.5977 6.5977 7.9525 7.9525 8.1133 8.1133 9.1303 9.1303 k = 0.4423 0.5657 0.6691 ( 6300 PWs) bands (ev): -20.3297 -20.3297 -20.3137 -20.3137 -19.0604 -19.0604 -19.0025 -19.0025 -18.0785 -18.0785 -17.9933 -17.9933 -12.7984 -12.7984 -9.7544 -9.7544 -8.6389 -8.6389 -8.3846 -8.3846 -8.3332 -8.3332 -7.9787 -7.9787 -7.8558 -7.8558 -7.6842 -7.6842 -7.5487 -7.5487 -5.3605 -5.3605 -5.0123 -5.0123 -4.6976 -4.6976 -4.5188 -4.5188 -4.4274 -4.4274 -4.2198 -4.2198 -1.4602 -1.4602 -0.7782 -0.7782 -0.7600 -0.7600 -0.6648 -0.6648 -0.5489 -0.5489 -0.2648 -0.2648 0.0343 0.0343 0.5286 0.5286 4.3053 4.3053 6.5587 6.5587 6.6028 6.6028 7.9527 7.9527 8.1000 8.1000 9.1440 9.1440 k = 0.4535 0.5799 0.6587 ( 6299 PWs) bands (ev): -20.3293 -20.3293 -20.3140 -20.3140 -19.0604 -19.0604 -19.0023 -19.0023 -18.0792 -18.0792 -17.9928 -17.9928 -12.7986 -12.7986 -9.7502 -9.7502 -8.6497 -8.6497 -8.3858 -8.3858 -8.3309 -8.3309 -7.9767 -7.9767 -7.8546 -7.8546 -7.6834 -7.6834 -7.5472 -7.5472 -5.3652 -5.3652 -5.0107 -5.0107 -4.6929 -4.6929 -4.5150 -4.5150 -4.4325 -4.4325 -4.2216 -4.2216 -1.4597 -1.4597 -0.7734 -0.7734 -0.7587 -0.7587 -0.6718 -0.6718 -0.5418 -0.5418 -0.2756 -0.2756 0.0424 0.0424 0.5242 0.5242 4.3033 4.3033 6.5625 6.5625 6.6069 6.6069 7.9509 7.9509 8.0902 8.0902 9.1580 9.1580 k = 0.4646 0.5942 0.6483 ( 6289 PWs) bands (ev): -20.3289 -20.3289 -20.3144 -20.3144 -19.0602 -19.0602 -19.0021 -19.0021 -18.0798 -18.0798 -17.9924 -17.9924 -12.7988 -12.7988 -9.7470 -9.7470 -8.6578 -8.6578 -8.3868 -8.3868 -8.3289 -8.3289 -7.9751 -7.9751 -7.8540 -7.8540 -7.6826 -7.6826 -7.5461 -7.5461 -5.3692 -5.3692 -5.0095 -5.0095 -4.6889 -4.6889 -4.5122 -4.5122 -4.4363 -4.4363 -4.2230 -4.2230 -1.4590 -1.4590 -0.7695 -0.7695 -0.7570 -0.7570 -0.6786 -0.6786 -0.5348 -0.5348 -0.2854 -0.2854 0.0489 0.0489 0.5207 0.5207 4.3020 4.3020 6.5658 6.5658 6.6101 6.6101 7.9469 7.9469 8.0841 8.0841 9.1720 9.1720 k = 0.7472-0.0748 0.5658 ( 6315 PWs) bands (ev): -20.3322 -20.3322 -20.3190 -20.3190 -19.0468 -19.0468 -19.0050 -19.0050 -18.0609 -18.0609 -18.0199 -18.0199 -12.7901 -12.7901 -9.8498 -9.8498 -8.4271 -8.4271 -8.3500 -8.3500 -8.2218 -8.2218 -8.0670 -8.0670 -7.9665 -7.9665 -7.7105 -7.7105 -7.5814 -7.5814 -5.2232 -5.2232 -5.1126 -5.1126 -4.7888 -4.7888 -4.5633 -4.5633 -4.3107 -4.3107 -4.2249 -4.2249 -1.4224 -1.4224 -0.8872 -0.8872 -0.7074 -0.7074 -0.5922 -0.5922 -0.5640 -0.5640 -0.1767 -0.1767 -0.1340 -0.1340 0.5962 0.5962 4.3426 4.3426 6.4435 6.4435 6.5057 6.5057 7.9462 7.9462 8.3913 8.3913 9.0347 9.0347 k = 0.7430-0.0801 0.5463 ( 6316 PWs) bands (ev): -20.3318 -20.3318 -20.3198 -20.3198 -19.0504 -19.0504 -19.0057 -19.0057 -18.0600 -18.0600 -18.0176 -18.0176 -12.7914 -12.7914 -9.8440 -9.8440 -8.4253 -8.4253 -8.3454 -8.3454 -8.2400 -8.2400 -8.0631 -8.0631 -7.9557 -7.9557 -7.7115 -7.7115 -7.5787 -7.5787 -5.2248 -5.2248 -5.1046 -5.1046 -4.7809 -4.7809 -4.5628 -4.5628 -4.3181 -4.3181 -4.2228 -4.2228 -1.4280 -1.4280 -0.8880 -0.8880 -0.7048 -0.7048 -0.5863 -0.5863 -0.5726 -0.5726 -0.1723 -0.1723 -0.1310 -0.1310 0.5962 0.5962 4.3266 4.3266 6.4415 6.4415 6.5005 6.5005 7.9520 7.9520 8.3631 8.3631 8.9924 8.9924 k = 0.7389-0.0854 0.5267 ( 6312 PWs) bands (ev): -20.3316 -20.3316 -20.3205 -20.3205 -19.0542 -19.0542 -19.0063 -19.0063 -18.0591 -18.0591 -18.0154 -18.0154 -12.7928 -12.7928 -9.8375 -9.8375 -8.4240 -8.4240 -8.3403 -8.3403 -8.2584 -8.2584 -8.0593 -8.0593 -7.9438 -7.9438 -7.7125 -7.7125 -7.5762 -7.5762 -5.2267 -5.2267 -5.0967 -5.0967 -4.7717 -4.7717 -4.5617 -4.5617 -4.3260 -4.3260 -4.2201 -4.2201 -1.4336 -1.4336 -0.8890 -0.8890 -0.7022 -0.7022 -0.5824 -0.5824 -0.5794 -0.5794 -0.1678 -0.1678 -0.1282 -0.1282 0.5963 0.5963 4.3087 4.3087 6.4388 6.4388 6.4955 6.4955 7.9538 7.9538 8.3300 8.3300 8.9501 8.9501 k = 0.7347-0.0908 0.5072 ( 6319 PWs) bands (ev): -20.3315 -20.3315 -20.3213 -20.3213 -19.0581 -19.0581 -19.0070 -19.0070 -18.0583 -18.0583 -18.0130 -18.0130 -12.7943 -12.7943 -9.8305 -9.8305 -8.4233 -8.4233 -8.3348 -8.3348 -8.2764 -8.2764 -8.0553 -8.0553 -7.9313 -7.9313 -7.7137 -7.7137 -7.5739 -7.5739 -5.2288 -5.2288 -5.0891 -5.0891 -4.7612 -4.7612 -4.5600 -4.5600 -4.3345 -4.3345 -4.2170 -4.2170 -1.4390 -1.4390 -0.8901 -0.8901 -0.6995 -0.6995 -0.5914 -0.5914 -0.5737 -0.5737 -0.1632 -0.1632 -0.1256 -0.1256 0.5962 0.5962 4.2889 4.2889 6.4355 6.4355 6.4905 6.4905 7.9514 7.9514 8.2932 8.2932 8.9077 8.9077 k = 0.7306-0.0961 0.4876 ( 6320 PWs) bands (ev): -20.3316 -20.3316 -20.3221 -20.3221 -19.0621 -19.0621 -19.0076 -19.0076 -18.0575 -18.0575 -18.0107 -18.0107 -12.7959 -12.7959 -9.8229 -9.8229 -8.4232 -8.4232 -8.3289 -8.3289 -8.2936 -8.2936 -8.0513 -8.0513 -7.9182 -7.9182 -7.7149 -7.7149 -7.5718 -7.5718 -5.2311 -5.2311 -5.0818 -5.0818 -4.7495 -4.7495 -4.5578 -4.5578 -4.3435 -4.3435 -4.2133 -4.2133 -1.4444 -1.4444 -0.8914 -0.8914 -0.6967 -0.6967 -0.6012 -0.6012 -0.5673 -0.5673 -0.1586 -0.1586 -0.1232 -0.1232 0.5960 0.5960 4.2675 4.2675 6.4315 6.4315 6.4858 6.4858 7.9448 7.9448 8.2541 8.2541 8.8655 8.8655 k = 0.7264-0.1014 0.4681 ( 6317 PWs) bands (ev): -20.3317 -20.3317 -20.3228 -20.3228 -19.0661 -19.0661 -19.0082 -19.0082 -18.0567 -18.0567 -18.0082 -18.0082 -12.7975 -12.7975 -9.8148 -9.8148 -8.4242 -8.4242 -8.3227 -8.3227 -8.3095 -8.3095 -8.0472 -8.0472 -7.9050 -7.9050 -7.7162 -7.7162 -7.5700 -7.5700 -5.2335 -5.2335 -5.0748 -5.0748 -4.7366 -4.7366 -4.5551 -4.5551 -4.3529 -4.3529 -4.2093 -4.2093 -1.4496 -1.4496 -0.8928 -0.8928 -0.6939 -0.6939 -0.6113 -0.6113 -0.5610 -0.5610 -0.1540 -0.1540 -0.1211 -0.1211 0.5956 0.5956 4.2444 4.2444 6.4270 6.4270 6.4812 6.4812 7.9339 7.9339 8.2137 8.2137 8.8235 8.8235 k = 0.7223-0.1067 0.4485 ( 6318 PWs) bands (ev): -20.3320 -20.3320 -20.3236 -20.3236 -19.0702 -19.0702 -19.0088 -19.0088 -18.0560 -18.0560 -18.0058 -18.0058 -12.7992 -12.7992 -9.8063 -9.8063 -8.4264 -8.4264 -8.3237 -8.3237 -8.3161 -8.3161 -8.0430 -8.0430 -7.8918 -7.8918 -7.7176 -7.7176 -7.5683 -7.5683 -5.2359 -5.2359 -5.0681 -5.0681 -4.7225 -4.7225 -4.5519 -4.5519 -4.3627 -4.3627 -4.2048 -4.2048 -1.4547 -1.4547 -0.8945 -0.8945 -0.6909 -0.6909 -0.6215 -0.6215 -0.5547 -0.5547 -0.1493 -0.1493 -0.1193 -0.1193 0.5952 0.5952 4.2199 4.2199 6.4220 6.4220 6.4770 6.4770 7.9187 7.9187 8.1728 8.1728 8.7817 8.7817 k = 0.7181-0.1120 0.4290 ( 6310 PWs) bands (ev): -20.3324 -20.3324 -20.3245 -20.3245 -19.0743 -19.0743 -19.0093 -19.0093 -18.0553 -18.0553 -18.0034 -18.0034 -12.8009 -12.8009 -9.7976 -9.7976 -8.4302 -8.4302 -8.3354 -8.3354 -8.3094 -8.3094 -8.0387 -8.0387 -7.8786 -7.8786 -7.7190 -7.7190 -7.5669 -7.5669 -5.2384 -5.2384 -5.0619 -5.0619 -4.7074 -4.7074 -4.5482 -4.5482 -4.3728 -4.3728 -4.2000 -4.2000 -1.4596 -1.4596 -0.8965 -0.8965 -0.6878 -0.6878 -0.6318 -0.6318 -0.5484 -0.5484 -0.1447 -0.1447 -0.1178 -0.1178 0.5946 0.5946 4.1942 4.1942 6.4167 6.4167 6.4729 6.4729 7.8992 7.8992 8.1320 8.1320 8.7403 8.7403 k = 0.7140-0.1173 0.4094 ( 6308 PWs) bands (ev): -20.3329 -20.3329 -20.3253 -20.3253 -19.0785 -19.0785 -19.0099 -19.0099 -18.0546 -18.0546 -18.0009 -18.0009 -12.8027 -12.8027 -9.7887 -9.7887 -8.4359 -8.4359 -8.3446 -8.3446 -8.3026 -8.3026 -8.0343 -8.0343 -7.8658 -7.8658 -7.7205 -7.7205 -7.5657 -7.5657 -5.2409 -5.2409 -5.0561 -5.0561 -4.6912 -4.6912 -4.5442 -4.5442 -4.3832 -4.3832 -4.1949 -4.1949 -1.4645 -1.4645 -0.8987 -0.8987 -0.6846 -0.6846 -0.6420 -0.6420 -0.5422 -0.5422 -0.1402 -0.1402 -0.1168 -0.1168 0.5938 0.5938 4.1674 4.1674 6.4109 6.4109 6.4693 6.4693 7.8758 7.8758 8.0916 8.0916 8.6993 8.6993 k = 0.7098-0.1227 0.3899 ( 6308 PWs) bands (ev): -20.3335 -20.3335 -20.3261 -20.3261 -19.0827 -19.0827 -19.0104 -19.0104 -18.0540 -18.0540 -17.9985 -17.9985 -12.8044 -12.8044 -9.7796 -9.7796 -8.4433 -8.4433 -8.3510 -8.3510 -8.2956 -8.2956 -8.0298 -8.0298 -7.8534 -7.8534 -7.7221 -7.7221 -7.5648 -7.5648 -5.2433 -5.2433 -5.0506 -5.0506 -4.6741 -4.6741 -4.5399 -4.5399 -4.3936 -4.3936 -4.1896 -4.1896 -1.4692 -1.4692 -0.9011 -0.9011 -0.6814 -0.6814 -0.6521 -0.6521 -0.5362 -0.5362 -0.1358 -0.1358 -0.1161 -0.1161 0.5928 0.5928 4.1396 4.1396 6.4048 6.4048 6.4659 6.4659 7.8489 7.8489 8.0515 8.0515 8.6588 8.6588 k = 0.7056-0.1280 0.3703 ( 6314 PWs) bands (ev): -20.3341 -20.3341 -20.3269 -20.3269 -19.0868 -19.0868 -19.0109 -19.0109 -18.0534 -18.0534 -17.9960 -17.9960 -12.8062 -12.8062 -9.7706 -9.7706 -8.4521 -8.4521 -8.3550 -8.3550 -8.2886 -8.2886 -8.0251 -8.0251 -7.8414 -7.8414 -7.7237 -7.7237 -7.5642 -7.5642 -5.2457 -5.2457 -5.0457 -5.0457 -4.6562 -4.6562 -4.5354 -4.5354 -4.4040 -4.4040 -4.1840 -4.1840 -1.4737 -1.4737 -0.9039 -0.9039 -0.6781 -0.6781 -0.6619 -0.6619 -0.5303 -0.5303 -0.1318 -0.1318 -0.1156 -0.1156 0.5916 0.5916 4.1111 4.1111 6.3985 6.3985 6.4630 6.4630 7.8194 7.8194 8.0117 8.0117 8.6188 8.6188 k = 0.7015-0.1333 0.3508 ( 6312 PWs) bands (ev): -20.3349 -20.3349 -20.3277 -20.3277 -19.0909 -19.0909 -19.0114 -19.0114 -18.0529 -18.0529 -17.9936 -17.9936 -12.8079 -12.8079 -9.7616 -9.7616 -8.4615 -8.4615 -8.3571 -8.3571 -8.2816 -8.2816 -8.0204 -8.0204 -7.8300 -7.8300 -7.7254 -7.7254 -7.5638 -7.5638 -5.2479 -5.2479 -5.0411 -5.0411 -4.6374 -4.6374 -4.5309 -4.5309 -4.4141 -4.4141 -4.1783 -4.1783 -1.4782 -1.4782 -0.9071 -0.9071 -0.6749 -0.6749 -0.6713 -0.6713 -0.5245 -0.5245 -0.1283 -0.1283 -0.1151 -0.1151 0.5902 0.5902 4.0820 4.0820 6.3921 6.3921 6.4605 6.4605 7.7879 7.7879 7.9717 7.9717 8.5794 8.5794 k = 0.6973-0.1386 0.3312 ( 6314 PWs) bands (ev): -20.3357 -20.3357 -20.3285 -20.3285 -19.0950 -19.0950 -19.0118 -19.0118 -18.0524 -18.0524 -17.9913 -17.9913 -12.8096 -12.8096 -9.7528 -9.7528 -8.4711 -8.4711 -8.3578 -8.3578 -8.2747 -8.2747 -8.0154 -8.0154 -7.8193 -7.8193 -7.7270 -7.7270 -7.5638 -7.5638 -5.2499 -5.2499 -5.0371 -5.0371 -4.6180 -4.6180 -4.5267 -4.5267 -4.4237 -4.4237 -4.1725 -4.1725 -1.4825 -1.4825 -0.9107 -0.9107 -0.6804 -0.6804 -0.6714 -0.6714 -0.5190 -0.5190 -0.1262 -0.1262 -0.1139 -0.1139 0.5886 0.5886 4.0526 4.0526 6.3856 6.3856 6.4586 6.4586 7.7554 7.7554 7.9315 7.9315 8.5406 8.5406 k = 0.6932-0.1439 0.3117 ( 6314 PWs) bands (ev): -20.3365 -20.3365 -20.3292 -20.3292 -19.0990 -19.0990 -19.0122 -19.0122 -18.0519 -18.0519 -17.9890 -17.9890 -12.8113 -12.8113 -9.7443 -9.7443 -8.4803 -8.4803 -8.3574 -8.3574 -8.2680 -8.2680 -8.0103 -8.0103 -7.8094 -7.8094 -7.7288 -7.7288 -7.5640 -7.5640 -5.2517 -5.2517 -5.0335 -5.0335 -4.5979 -4.5979 -4.5232 -4.5232 -4.4323 -4.4323 -4.1668 -4.1668 -1.4867 -1.4867 -0.9147 -0.9147 -0.6886 -0.6886 -0.6681 -0.6681 -0.5135 -0.5135 -0.1260 -0.1260 -0.1114 -0.1114 0.5867 0.5867 4.0230 4.0230 6.3790 6.3790 6.4571 6.4571 7.7226 7.7226 7.8908 7.8908 8.5024 8.5024 k = 0.6890-0.1492 0.2921 ( 6313 PWs) bands (ev): -20.3374 -20.3374 -20.3300 -20.3300 -19.1029 -19.1029 -19.0127 -19.0127 -18.0514 -18.0514 -17.9867 -17.9867 -12.8129 -12.8129 -9.7362 -9.7362 -8.4888 -8.4888 -8.3563 -8.3563 -8.2613 -8.2613 -8.0051 -8.0051 -7.8002 -7.8002 -7.7305 -7.7305 -7.5646 -7.5646 -5.2533 -5.2533 -5.0304 -5.0304 -4.5774 -4.5774 -4.5210 -4.5210 -4.4394 -4.4394 -4.1610 -4.1610 -1.4908 -1.4908 -0.9192 -0.9192 -0.6962 -0.6962 -0.6648 -0.6648 -0.5083 -0.5083 -0.1274 -0.1274 -0.1080 -0.1080 0.5846 0.5846 3.9935 3.9935 6.3725 6.3725 6.4563 6.4563 7.6901 7.6901 7.8495 7.8495 8.4649 8.4649 k = 0.6849-0.1545 0.2726 ( 6305 PWs) bands (ev): -20.3384 -20.3384 -20.3307 -20.3307 -19.1067 -19.1067 -19.0130 -19.0130 -18.0510 -18.0510 -17.9845 -17.9845 -12.8144 -12.8144 -9.7286 -9.7286 -8.4964 -8.4964 -8.3546 -8.3546 -8.2550 -8.2550 -7.9998 -7.9998 -7.7920 -7.7920 -7.7322 -7.7322 -7.5655 -7.5655 -5.2547 -5.2547 -5.0277 -5.0277 -4.5564 -4.5564 -4.5207 -4.5207 -4.4442 -4.4442 -4.1555 -4.1555 -1.4948 -1.4948 -0.9242 -0.9242 -0.7028 -0.7028 -0.6616 -0.6616 -0.5033 -0.5033 -0.1300 -0.1300 -0.1041 -0.1041 0.5822 0.5822 3.9642 3.9642 6.3661 6.3661 6.4561 6.4561 7.6585 7.6585 7.8078 7.8078 8.4282 8.4282 k = 0.6807-0.1599 0.2530 ( 6313 PWs) bands (ev): -20.3393 -20.3393 -20.3313 -20.3313 -19.1104 -19.1104 -19.0134 -19.0134 -18.0506 -18.0506 -17.9825 -17.9825 -12.8159 -12.8159 -9.7215 -9.7215 -8.5028 -8.5028 -8.3525 -8.3525 -8.2489 -8.2489 -7.9943 -7.9943 -7.7847 -7.7847 -7.7340 -7.7340 -7.5668 -7.5668 -5.2557 -5.2557 -5.0255 -5.0255 -4.5353 -4.5353 -4.5228 -4.5228 -4.4461 -4.4461 -4.1501 -4.1501 -1.4987 -1.4987 -0.9297 -0.9297 -0.7085 -0.7085 -0.6585 -0.6585 -0.4984 -0.4984 -0.1335 -0.1335 -0.1000 -0.1000 0.5797 0.5797 3.9353 3.9353 6.3599 6.3599 6.4565 6.4565 7.6283 7.6283 7.7658 7.7658 8.3923 8.3923 k = 0.6766-0.1652 0.2335 ( 6319 PWs) bands (ev): -20.3403 -20.3403 -20.3320 -20.3320 -19.1139 -19.1139 -19.0137 -19.0137 -18.0503 -18.0503 -17.9805 -17.9805 -12.8173 -12.8173 -9.7150 -9.7150 -8.5080 -8.5080 -8.3500 -8.3500 -8.2432 -8.2432 -7.9888 -7.9888 -7.7784 -7.7784 -7.7357 -7.7357 -7.5683 -7.5683 -5.2564 -5.2564 -5.0238 -5.0238 -4.5281 -4.5281 -4.5134 -4.5134 -4.4451 -4.4451 -4.1450 -4.1450 -1.5025 -1.5025 -0.9357 -0.9357 -0.7131 -0.7131 -0.6556 -0.6556 -0.4938 -0.4938 -0.1377 -0.1377 -0.0957 -0.0957 0.5768 0.5768 3.9070 3.9070 6.3540 6.3540 6.4577 6.4577 7.5996 7.5996 7.7238 7.7238 8.3571 8.3571 k = 0.6724-0.1705 0.2139 ( 6303 PWs) bands (ev): -20.3413 -20.3413 -20.3326 -20.3326 -19.1173 -19.1173 -19.0140 -19.0140 -18.0500 -18.0500 -17.9785 -17.9785 -12.8186 -12.8186 -9.7092 -9.7092 -8.5118 -8.5118 -8.3473 -8.3473 -8.2378 -8.2378 -7.9832 -7.9832 -7.7731 -7.7731 -7.7374 -7.7374 -7.5701 -7.5701 -5.2568 -5.2568 -5.0226 -5.0226 -4.5349 -4.5349 -4.4921 -4.4921 -4.4417 -4.4417 -4.1402 -4.1402 -1.5063 -1.5063 -0.9421 -0.9421 -0.7166 -0.7166 -0.6528 -0.6528 -0.4893 -0.4893 -0.1427 -0.1427 -0.0914 -0.0914 0.5738 0.5738 3.8795 3.8795 6.3484 6.3484 6.4597 6.4597 7.5728 7.5728 7.6818 7.6818 8.3229 8.3229 k = 0.6682-0.1758 0.1944 ( 6307 PWs) bands (ev): -20.3423 -20.3423 -20.3331 -20.3331 -19.1206 -19.1206 -19.0143 -19.0143 -18.0496 -18.0496 -17.9768 -17.9768 -12.8198 -12.8198 -9.7042 -9.7042 -8.5142 -8.5142 -8.3442 -8.3442 -8.2328 -8.2328 -7.9775 -7.9775 -7.7690 -7.7690 -7.7390 -7.7390 -7.5723 -7.5723 -5.2568 -5.2568 -5.0218 -5.0218 -4.5432 -4.5432 -4.4707 -4.4707 -4.4364 -4.4364 -4.1360 -4.1360 -1.5099 -1.5099 -0.9488 -0.9488 -0.7189 -0.7189 -0.6503 -0.6503 -0.4850 -0.4850 -0.1484 -0.1484 -0.0871 -0.0871 0.5705 0.5705 3.8529 3.8529 6.3432 6.3432 6.4624 6.4624 7.5481 7.5481 7.6403 7.6403 8.2895 8.2895 k = 0.6641-0.1811 0.1748 ( 6311 PWs) bands (ev): -20.3433 -20.3433 -20.3336 -20.3336 -19.1237 -19.1237 -19.0146 -19.0146 -18.0494 -18.0494 -17.9751 -17.9751 -12.8209 -12.8209 -9.6999 -9.6999 -8.5151 -8.5151 -8.3410 -8.3410 -8.2281 -8.2281 -7.9719 -7.9719 -7.7661 -7.7661 -7.7406 -7.7406 -7.5746 -7.5746 -5.2565 -5.2565 -5.0214 -5.0214 -4.5524 -4.5524 -4.4495 -4.4495 -4.4298 -4.4298 -4.1322 -4.1322 -1.5135 -1.5135 -0.9557 -0.9557 -0.7201 -0.7201 -0.6480 -0.6480 -0.4810 -0.4810 -0.1547 -0.1547 -0.0828 -0.0828 0.5670 0.5670 3.8275 3.8275 6.3384 6.3384 6.4660 6.4660 7.5256 7.5256 7.5994 7.5994 8.2571 8.2571 k = 0.6599-0.1864 0.1553 ( 6320 PWs) bands (ev): -20.3442 -20.3442 -20.3340 -20.3340 -19.1265 -19.1265 -19.0148 -19.0148 -18.0491 -18.0491 -17.9735 -17.9735 -12.8219 -12.8219 -9.6964 -9.6964 -8.5147 -8.5147 -8.3376 -8.3376 -8.2239 -8.2239 -7.9664 -7.9664 -7.7645 -7.7645 -7.7422 -7.7422 -7.5770 -7.5770 -5.2557 -5.2557 -5.0216 -5.0216 -4.5620 -4.5620 -4.4294 -4.4294 -4.4216 -4.4216 -4.1290 -4.1290 -1.5170 -1.5170 -0.9627 -0.9627 -0.7202 -0.7202 -0.6459 -0.6459 -0.4772 -0.4772 -0.1616 -0.1616 -0.0785 -0.0785 0.5633 0.5633 3.8033 3.8033 6.3342 6.3342 6.4704 6.4704 7.5053 7.5053 7.5596 7.5596 8.2258 8.2258 k = 0.6558-0.1917 0.1357 ( 6321 PWs) bands (ev): -20.3452 -20.3452 -20.3344 -20.3344 -19.1292 -19.1292 -19.0150 -19.0150 -18.0488 -18.0488 -17.9721 -17.9721 -12.8228 -12.8228 -9.6937 -9.6937 -8.5129 -8.5129 -8.3340 -8.3340 -8.2202 -8.2202 -7.9609 -7.9609 -7.7643 -7.7643 -7.7436 -7.7436 -7.5796 -7.5796 -5.2546 -5.2546 -5.0221 -5.0221 -4.5718 -4.5718 -4.4164 -4.4164 -4.4062 -4.4062 -4.1266 -4.1266 -1.5205 -1.5205 -0.9697 -0.9697 -0.7192 -0.7192 -0.6442 -0.6442 -0.4736 -0.4736 -0.1691 -0.1691 -0.0742 -0.0742 0.5594 0.5594 3.7806 3.7806 6.3306 6.3306 6.4757 6.4757 7.4869 7.4869 7.5214 7.5214 8.1956 8.1956 k = 0.6516-0.1971 0.1162 ( 6317 PWs) bands (ev): -20.3461 -20.3461 -20.3348 -20.3348 -19.1317 -19.1317 -19.0152 -19.0152 -18.0486 -18.0486 -17.9708 -17.9708 -12.8236 -12.8236 -9.6919 -9.6919 -8.5097 -8.5097 -8.3302 -8.3302 -8.2168 -8.2168 -7.9557 -7.9557 -7.7655 -7.7655 -7.7449 -7.7449 -7.5822 -7.5822 -5.2531 -5.2531 -5.0231 -5.0231 -4.5815 -4.5815 -4.4078 -4.4078 -4.3865 -4.3865 -4.1249 -4.1249 -1.5238 -1.5238 -0.9765 -0.9765 -0.7171 -0.7171 -0.6427 -0.6427 -0.4703 -0.4703 -0.1771 -0.1771 -0.0699 -0.0699 0.5553 0.5553 3.7594 3.7594 6.3276 6.3276 6.4818 6.4818 7.4684 7.4684 7.4870 7.4870 8.1666 8.1666 k = 0.6475-0.2024 0.0966 ( 6317 PWs) bands (ev): -20.3469 -20.3469 -20.3350 -20.3350 -19.1340 -19.1340 -19.0153 -19.0153 -18.0484 -18.0484 -17.9696 -17.9696 -12.8243 -12.8243 -9.6907 -9.6907 -8.5053 -8.5053 -8.3262 -8.3262 -8.2138 -8.2138 -7.9506 -7.9506 -7.7681 -7.7681 -7.7462 -7.7462 -7.5848 -7.5848 -5.2512 -5.2512 -5.0245 -5.0245 -4.5911 -4.5911 -4.3995 -4.3995 -4.3669 -4.3669 -4.1240 -4.1240 -1.5271 -1.5271 -0.9830 -0.9830 -0.7139 -0.7139 -0.6416 -0.6416 -0.4673 -0.4673 -0.1857 -0.1857 -0.0656 -0.0656 0.5511 0.5511 3.7399 3.7399 6.3253 6.3253 6.4888 6.4888 7.4413 7.4413 7.4652 7.4652 8.1388 8.1388 k = 0.6433-0.2077 0.0771 ( 6313 PWs) bands (ev): -20.3478 -20.3478 -20.3353 -20.3353 -19.1360 -19.1360 -19.0154 -19.0154 -18.0482 -18.0482 -17.9686 -17.9686 -12.8249 -12.8249 -9.6904 -9.6904 -8.4998 -8.4998 -8.3221 -8.3221 -8.2113 -8.2113 -7.9458 -7.9458 -7.7723 -7.7723 -7.7473 -7.7473 -7.5872 -7.5872 -5.2490 -5.2490 -5.0262 -5.0262 -4.6003 -4.6003 -4.3911 -4.3911 -4.3480 -4.3480 -4.1241 -4.1241 -1.5303 -1.5303 -0.9890 -0.9890 -0.7098 -0.7098 -0.6408 -0.6408 -0.4645 -0.4645 -0.1948 -0.1948 -0.0613 -0.0613 0.5468 0.5468 3.7221 3.7221 6.3236 6.3236 6.4966 6.4966 7.4085 7.4085 7.4534 7.4534 8.1125 8.1125 k = 0.6392-0.2130 0.0575 ( 6317 PWs) bands (ev): -20.3485 -20.3485 -20.3354 -20.3354 -19.1378 -19.1378 -19.0155 -19.0155 -18.0480 -18.0480 -17.9677 -17.9677 -12.8253 -12.8253 -9.6907 -9.6907 -8.4933 -8.4933 -8.3177 -8.3177 -8.2092 -8.2092 -7.9414 -7.9414 -7.7781 -7.7781 -7.7482 -7.7482 -7.5893 -7.5893 -5.2464 -5.2464 -5.0284 -5.0284 -4.6092 -4.6092 -4.3829 -4.3829 -4.3297 -4.3297 -4.1252 -4.1252 -1.5333 -1.5333 -0.9943 -0.9943 -0.7048 -0.7048 -0.6403 -0.6403 -0.4621 -0.4621 -0.2043 -0.2043 -0.0569 -0.0569 0.5424 0.5424 3.7063 3.7063 6.3228 6.3228 6.5053 6.5053 7.3763 7.3763 7.4454 7.4454 8.0876 8.0876 k = 0.6350-0.2183 0.0380 ( 6317 PWs) bands (ev): -20.3492 -20.3492 -20.3355 -20.3355 -19.1394 -19.1394 -19.0156 -19.0156 -18.0479 -18.0479 -17.9670 -17.9670 -12.8257 -12.8257 -9.6917 -9.6917 -8.4858 -8.4858 -8.3132 -8.3132 -8.2076 -8.2076 -7.9373 -7.9373 -7.7854 -7.7854 -7.7490 -7.7490 -7.5912 -7.5912 -5.2435 -5.2435 -5.0308 -5.0308 -4.6176 -4.6176 -4.3748 -4.3748 -4.3123 -4.3123 -4.1273 -4.1273 -1.5363 -1.5363 -0.9990 -0.9990 -0.6989 -0.6989 -0.6402 -0.6402 -0.4600 -0.4600 -0.2142 -0.2142 -0.0526 -0.0526 0.5380 0.5380 3.6924 3.6924 6.3227 6.3227 6.5146 6.5146 7.3458 7.3458 7.4403 7.4403 8.0643 8.0643 k = 0.6308-0.2236 0.0184 ( 6317 PWs) bands (ev): -20.3498 -20.3498 -20.3356 -20.3356 -19.1407 -19.1407 -19.0156 -19.0156 -18.0477 -18.0477 -17.9664 -17.9664 -12.8259 -12.8259 -9.6933 -9.6933 -8.4777 -8.4777 -8.3085 -8.3085 -8.2063 -8.2063 -7.9336 -7.9336 -7.7942 -7.7942 -7.7496 -7.7496 -7.5928 -7.5928 -5.2404 -5.2404 -5.0336 -5.0336 -4.6255 -4.6255 -4.3669 -4.3669 -4.2958 -4.2958 -4.1305 -4.1305 -1.5392 -1.5392 -1.0028 -1.0028 -0.6921 -0.6921 -0.6405 -0.6405 -0.4582 -0.4582 -0.2245 -0.2245 -0.0482 -0.0482 0.5335 0.5335 3.6806 3.6806 6.3233 6.3233 6.5246 6.5246 7.3174 7.3174 7.4378 7.4378 8.0428 8.0428 k = 0.6267-0.2289-0.0011 ( 6313 PWs) bands (ev): -20.3504 -20.3504 -20.3355 -20.3355 -19.1418 -19.1418 -19.0156 -19.0156 -18.0476 -18.0476 -17.9659 -17.9659 -12.8260 -12.8260 -9.6953 -9.6953 -8.4689 -8.4689 -8.3035 -8.3035 -8.2055 -8.2055 -7.9303 -7.9303 -7.8046 -7.8046 -7.7500 -7.7500 -7.5940 -7.5940 -5.2370 -5.2370 -5.0366 -5.0366 -4.6328 -4.6328 -4.3593 -4.3593 -4.2802 -4.2802 -4.1349 -4.1349 -1.5419 -1.5419 -1.0057 -1.0057 -0.6846 -0.6846 -0.6411 -0.6411 -0.4568 -0.4568 -0.2352 -0.2352 -0.0438 -0.0438 0.5290 0.5290 3.6709 3.6709 6.3247 6.3247 6.5353 6.5353 7.2911 7.2911 7.4379 7.4379 8.0232 8.0232 k = 0.6225-0.2343-0.0207 ( 6312 PWs) bands (ev): -20.3508 -20.3508 -20.3354 -20.3354 -19.1426 -19.1426 -19.0156 -19.0156 -18.0475 -18.0475 -17.9656 -17.9656 -12.8260 -12.8260 -9.6978 -9.6978 -8.4598 -8.4598 -8.2984 -8.2984 -8.2050 -8.2050 -7.9276 -7.9276 -7.8162 -7.8162 -7.7502 -7.7502 -7.5948 -7.5948 -5.2335 -5.2335 -5.0399 -5.0399 -4.6395 -4.6395 -4.3520 -4.3520 -4.2657 -4.2657 -4.1404 -4.1404 -1.5445 -1.5445 -1.0075 -1.0075 -0.6764 -0.6764 -0.6421 -0.6421 -0.4557 -0.4557 -0.2461 -0.2461 -0.0394 -0.0394 0.5245 0.5245 3.6633 3.6633 6.3269 6.3269 6.5464 6.5464 7.2672 7.2672 7.4405 7.4405 8.0056 8.0056 k = 0.6184-0.2396-0.0402 ( 6315 PWs) bands (ev): -20.3512 -20.3512 -20.3353 -20.3353 -19.1432 -19.1432 -19.0155 -19.0155 -18.0475 -18.0475 -17.9654 -17.9654 -12.8259 -12.8259 -9.7007 -9.7007 -8.4505 -8.4505 -8.2931 -8.2931 -8.2050 -8.2050 -7.9253 -7.9253 -7.8292 -7.8292 -7.7502 -7.7502 -7.5953 -7.5953 -5.2299 -5.2299 -5.0433 -5.0433 -4.6456 -4.6456 -4.3451 -4.3451 -4.2522 -4.2522 -4.1472 -4.1472 -1.5469 -1.5469 -1.0083 -1.0083 -0.6675 -0.6675 -0.6434 -0.6434 -0.4551 -0.4551 -0.2572 -0.2572 -0.0350 -0.0350 0.5201 0.5201 3.6579 3.6579 6.3298 6.3298 6.5578 6.5578 7.2458 7.2458 7.4455 7.4455 7.9901 7.9901 k = 0.6142-0.2449-0.0598 ( 6317 PWs) bands (ev): -20.3515 -20.3515 -20.3350 -20.3350 -19.1435 -19.1435 -19.0154 -19.0154 -18.0474 -18.0474 -17.9654 -17.9654 -12.8258 -12.8258 -9.7039 -9.7039 -8.4411 -8.4411 -8.2877 -8.2877 -8.2054 -8.2054 -7.9236 -7.9236 -7.8431 -7.8431 -7.7499 -7.7499 -7.5955 -7.5955 -5.2262 -5.2262 -5.0469 -5.0469 -4.6510 -4.6510 -4.3386 -4.3386 -4.2397 -4.2397 -4.1552 -4.1552 -1.5491 -1.5491 -1.0080 -1.0080 -0.6579 -0.6579 -0.6450 -0.6450 -0.4550 -0.4550 -0.2685 -0.2685 -0.0305 -0.0305 0.5158 0.5158 3.6548 3.6548 6.3334 6.3334 6.5695 6.5695 7.2269 7.2269 7.4530 7.4530 7.9771 7.9771 k = 0.6101-0.2502-0.0793 ( 6327 PWs) bands (ev): -20.3517 -20.3517 -20.3348 -20.3348 -19.1435 -19.1435 -19.0153 -19.0153 -18.0474 -18.0474 -17.9655 -17.9655 -12.8255 -12.8255 -9.7073 -9.7073 -8.4319 -8.4319 -8.2822 -8.2822 -8.2063 -8.2063 -7.9224 -7.9224 -7.8579 -7.8579 -7.7494 -7.7494 -7.5954 -7.5954 -5.2227 -5.2227 -5.0505 -5.0505 -4.6558 -4.6558 -4.3326 -4.3326 -4.2284 -4.2284 -4.1644 -4.1644 -1.5512 -1.5512 -1.0065 -1.0065 -0.6482 -0.6482 -0.6465 -0.6465 -0.4552 -0.4552 -0.2800 -0.2800 -0.0261 -0.0261 0.5117 0.5117 3.6539 3.6539 6.3376 6.3376 6.5812 6.5812 7.2106 7.2106 7.4629 7.4629 7.9665 7.9665 k = 0.6059-0.2555-0.0989 ( 6326 PWs) bands (ev): -20.3518 -20.3518 -20.3344 -20.3344 -19.1433 -19.1433 -19.0152 -19.0152 -18.0474 -18.0474 -17.9657 -17.9657 -12.8251 -12.8251 -9.7108 -9.7108 -8.4230 -8.4230 -8.2767 -8.2767 -8.2075 -8.2075 -7.9217 -7.9217 -7.8732 -7.8732 -7.7486 -7.7486 -7.5951 -7.5951 -5.2194 -5.2194 -5.0540 -5.0540 -4.6599 -4.6599 -4.3271 -4.3271 -4.2183 -4.2183 -4.1749 -4.1749 -1.5530 -1.5530 -1.0040 -1.0040 -0.6494 -0.6494 -0.6370 -0.6370 -0.4560 -0.4560 -0.2916 -0.2916 -0.0216 -0.0216 0.5076 0.5076 3.6551 3.6551 6.3426 6.3426 6.5928 6.5928 7.1970 7.1970 7.4751 7.4751 7.9587 7.9587 k = 0.6059-0.2555-0.0989 ( 6326 PWs) bands (ev): -20.3518 -20.3518 -20.3344 -20.3344 -19.1433 -19.1433 -19.0152 -19.0152 -18.0474 -18.0474 -17.9657 -17.9657 -12.8251 -12.8251 -9.7108 -9.7108 -8.4230 -8.4230 -8.2767 -8.2767 -8.2075 -8.2075 -7.9217 -7.9217 -7.8732 -7.8732 -7.7486 -7.7486 -7.5951 -7.5951 -5.2194 -5.2194 -5.0540 -5.0540 -4.6599 -4.6599 -4.3271 -4.3271 -4.2183 -4.2183 -4.1749 -4.1749 -1.5530 -1.5530 -1.0040 -1.0040 -0.6494 -0.6494 -0.6370 -0.6370 -0.4560 -0.4560 -0.2916 -0.2916 -0.0216 -0.0216 0.5076 0.5076 3.6551 3.6551 6.3426 6.3426 6.5928 6.5928 7.1970 7.1970 7.4751 7.4751 7.9587 7.9587 k = 0.5953-0.2691-0.0890 ( 6317 PWs) bands (ev): -20.3525 -20.3525 -20.3326 -20.3326 -19.1460 -19.1460 -19.0163 -19.0163 -18.0469 -18.0469 -17.9633 -17.9633 -12.8253 -12.8253 -9.7111 -9.7111 -8.4191 -8.4191 -8.2783 -8.2783 -8.2059 -8.2059 -7.9177 -7.9177 -7.8857 -7.8857 -7.7495 -7.7495 -7.5919 -7.5919 -5.2094 -5.2094 -5.0523 -5.0523 -4.6677 -4.6677 -4.3236 -4.3236 -4.2211 -4.2211 -4.1747 -4.1747 -1.5577 -1.5577 -1.0032 -1.0032 -0.6491 -0.6491 -0.6241 -0.6241 -0.4533 -0.4533 -0.3076 -0.3076 -0.0118 -0.0118 0.4976 0.4976 3.6467 3.6467 6.3576 6.3576 6.6051 6.6051 7.2356 7.2356 7.4695 7.4695 7.9253 7.9253 k = 0.5847-0.2826-0.0791 ( 6317 PWs) bands (ev): -20.3532 -20.3532 -20.3309 -20.3309 -19.1485 -19.1485 -19.0172 -19.0172 -18.0464 -18.0464 -17.9611 -17.9611 -12.8255 -12.8255 -9.7113 -9.7113 -8.4149 -8.4149 -8.2800 -8.2800 -8.2045 -8.2045 -7.9141 -7.9141 -7.8974 -7.8974 -7.7504 -7.7504 -7.5889 -7.5889 -5.2002 -5.2002 -5.0509 -5.0509 -4.6749 -4.6749 -4.3204 -4.3204 -4.2243 -4.2243 -4.1741 -4.1741 -1.5619 -1.5619 -1.0026 -1.0026 -0.6489 -0.6489 -0.6106 -0.6106 -0.4508 -0.4508 -0.3240 -0.3240 -0.0022 -0.0022 0.4877 0.4877 3.6388 3.6388 6.3719 6.3719 6.6173 6.6173 7.2623 7.2623 7.4758 7.4758 7.8941 7.8941 k = 0.5741-0.2962-0.0692 ( 6319 PWs) bands (ev): -20.3539 -20.3539 -20.3293 -20.3293 -19.1507 -19.1507 -19.0181 -19.0181 -18.0459 -18.0459 -17.9592 -17.9592 -12.8256 -12.8256 -9.7114 -9.7114 -8.4104 -8.4104 -8.2820 -8.2820 -8.2032 -8.2032 -7.9114 -7.9114 -7.9078 -7.9078 -7.7512 -7.7512 -7.5861 -7.5861 -5.1917 -5.1917 -5.0498 -5.0498 -4.6813 -4.6813 -4.3175 -4.3175 -4.2274 -4.2274 -4.1732 -4.1732 -1.5658 -1.5658 -1.0020 -1.0020 -0.6488 -0.6488 -0.5966 -0.5966 -0.4485 -0.4485 -0.3405 -0.3405 0.0069 0.0069 0.4782 0.4782 3.6314 3.6314 6.3854 6.3854 6.6290 6.6290 7.2761 7.2761 7.4945 7.4945 7.8655 7.8655 k = 0.5635-0.3097-0.0593 ( 6315 PWs) bands (ev): -20.3545 -20.3545 -20.3278 -20.3278 -19.1526 -19.1526 -19.0189 -19.0189 -18.0455 -18.0455 -17.9575 -17.9575 -12.8257 -12.8257 -9.7116 -9.7116 -8.4059 -8.4059 -8.2840 -8.2840 -8.2021 -8.2021 -7.9186 -7.9186 -7.9075 -7.9075 -7.7519 -7.7519 -7.5836 -7.5836 -5.1842 -5.1842 -5.0490 -5.0490 -4.6869 -4.6869 -4.3150 -4.3150 -4.2304 -4.2304 -4.1723 -4.1723 -1.5692 -1.5692 -1.0014 -1.0014 -0.6486 -0.6486 -0.5823 -0.5823 -0.4465 -0.4465 -0.3571 -0.3571 0.0154 0.0154 0.4693 0.4693 3.6248 3.6248 6.3978 6.3978 6.6400 6.6400 7.2799 7.2799 7.5218 7.5218 7.8398 7.8398 k = 0.5530-0.3232-0.0494 ( 6322 PWs) bands (ev): -20.3550 -20.3550 -20.3266 -20.3266 -19.1543 -19.1543 -19.0195 -19.0195 -18.0452 -18.0452 -17.9561 -17.9561 -12.8259 -12.8259 -9.7117 -9.7117 -8.4016 -8.4016 -8.2861 -8.2861 -8.2012 -8.2012 -7.9273 -7.9273 -7.9051 -7.9051 -7.7525 -7.7525 -7.5815 -7.5815 -5.1776 -5.1776 -5.0484 -5.0484 -4.6917 -4.6917 -4.3128 -4.3128 -4.2331 -4.2331 -4.1714 -4.1714 -1.5721 -1.5721 -1.0009 -1.0009 -0.6485 -0.6485 -0.5677 -0.5677 -0.4447 -0.4447 -0.3736 -0.3736 0.0232 0.0232 0.4612 0.4612 3.6190 3.6190 6.4087 6.4087 6.6500 6.6500 7.2780 7.2780 7.5524 7.5524 7.8173 7.8173 k = 0.5424-0.3368-0.0395 ( 6315 PWs) bands (ev): -20.3554 -20.3554 -20.3256 -20.3256 -19.1556 -19.1556 -19.0201 -19.0201 -18.0449 -18.0449 -17.9549 -17.9549 -12.8260 -12.8260 -9.7118 -9.7118 -8.3975 -8.3975 -8.2881 -8.2881 -8.2004 -8.2004 -7.9346 -7.9346 -7.9030 -7.9030 -7.7530 -7.7530 -7.5797 -7.5797 -5.1720 -5.1720 -5.0480 -5.0480 -4.6957 -4.6957 -4.3111 -4.3111 -4.2354 -4.2354 -4.1706 -4.1706 -1.5745 -1.5745 -1.0005 -1.0005 -0.6484 -0.6484 -0.5533 -0.5533 -0.4432 -0.4432 -0.3896 -0.3896 0.0299 0.0299 0.4542 0.4542 3.6142 3.6142 6.4179 6.4179 6.6587 6.6587 7.2740 7.2740 7.5820 7.5820 7.7983 7.7983 k = 0.5318-0.3503-0.0297 ( 6317 PWs) bands (ev): -20.3558 -20.3558 -20.3248 -20.3248 -19.1567 -19.1567 -19.0205 -19.0205 -18.0447 -18.0447 -17.9540 -17.9540 -12.8261 -12.8261 -9.7119 -9.7119 -8.3940 -8.3940 -8.2899 -8.2899 -8.1998 -8.1998 -7.9404 -7.9404 -7.9014 -7.9014 -7.7534 -7.7534 -7.5783 -7.5783 -5.1676 -5.1676 -5.0478 -5.0478 -4.6988 -4.6988 -4.3097 -4.3097 -4.2373 -4.2373 -4.1699 -4.1699 -1.5764 -1.5764 -1.0002 -1.0002 -0.6484 -0.6484 -0.5394 -0.5394 -0.4421 -0.4421 -0.4047 -0.4047 0.0353 0.0353 0.4484 0.4484 3.6103 3.6103 6.4253 6.4253 6.6657 6.6657 7.2696 7.2696 7.6076 7.6076 7.7833 7.7833 k = 0.5212-0.3639-0.0198 ( 6319 PWs) bands (ev): -20.3560 -20.3560 -20.3242 -20.3242 -19.1575 -19.1575 -19.0208 -19.0208 -18.0445 -18.0445 -17.9533 -17.9533 -12.8261 -12.8261 -9.7119 -9.7119 -8.3913 -8.3913 -8.2913 -8.2913 -8.1994 -8.1994 -7.9447 -7.9447 -7.9002 -7.9002 -7.7537 -7.7537 -7.5773 -7.5773 -5.1644 -5.1644 -5.0477 -5.0477 -4.7010 -4.7010 -4.3087 -4.3087 -4.2386 -4.2386 -4.1694 -4.1694 -1.5778 -1.5778 -1.0000 -1.0000 -0.6483 -0.6483 -0.5270 -0.5270 -0.4412 -0.4412 -0.4180 -0.4180 0.0394 0.0394 0.4441 0.4441 3.6075 3.6075 6.4307 6.4307 6.6710 6.6710 7.2659 7.2659 7.6273 7.6273 7.7723 7.7723 k = 0.5106-0.3774-0.0099 ( 6323 PWs) bands (ev): -20.3562 -20.3562 -20.3239 -20.3239 -19.1579 -19.1579 -19.0210 -19.0210 -18.0444 -18.0444 -17.9529 -17.9529 -12.8262 -12.8262 -9.7119 -9.7119 -8.3896 -8.3896 -8.2923 -8.2923 -8.1991 -8.1991 -7.9473 -7.9473 -7.8995 -7.8995 -7.7539 -7.7539 -7.5766 -7.5766 -5.1624 -5.1624 -5.0476 -5.0476 -4.7024 -4.7024 -4.3081 -4.3081 -4.2395 -4.2395 -4.1691 -4.1691 -1.5786 -1.5786 -0.9998 -0.9998 -0.6483 -0.6483 -0.5177 -0.5177 -0.4407 -0.4407 -0.4278 -0.4278 0.0419 0.0419 0.4415 0.4415 3.6058 3.6058 6.4340 6.4340 6.6742 6.6742 7.2635 7.2635 7.6397 7.6397 7.7656 7.7656 k = 0.5000-0.3910 0.0000 ( 6322 PWs) bands (ev): -20.3562 -20.3562 -20.3238 -20.3238 -19.1581 -19.1581 -19.0211 -19.0211 -18.0444 -18.0444 -17.9528 -17.9528 -12.8262 -12.8262 -9.7119 -9.7119 -8.3890 -8.3890 -8.2926 -8.2926 -8.1991 -8.1991 -7.9482 -7.9482 -7.8992 -7.8992 -7.7540 -7.7540 -7.5764 -7.5764 -5.1617 -5.1617 -5.0476 -5.0476 -4.7028 -4.7028 -4.3079 -4.3079 -4.2398 -4.2398 -4.1690 -4.1690 -1.5789 -1.5789 -0.9998 -0.9998 -0.6483 -0.6483 -0.5141 -0.5141 -0.4405 -0.4405 -0.4316 -0.4316 0.0428 0.0428 0.4406 0.4406 3.6053 3.6053 6.4351 6.4351 6.6753 6.6753 7.2627 7.2627 7.6439 7.6439 7.7633 7.7633 k = 0.5000-0.3910 0.0000 ( 6322 PWs) bands (ev): -20.3562 -20.3562 -20.3238 -20.3238 -19.1581 -19.1581 -19.0211 -19.0211 -18.0444 -18.0444 -17.9528 -17.9528 -12.8262 -12.8262 -9.7119 -9.7119 -8.3890 -8.3890 -8.2926 -8.2926 -8.1991 -8.1991 -7.9482 -7.9482 -7.8992 -7.8992 -7.7540 -7.7540 -7.5764 -7.5764 -5.1617 -5.1617 -5.0476 -5.0476 -4.7028 -4.7028 -4.3079 -4.3079 -4.2398 -4.2398 -4.1690 -4.1690 -1.5789 -1.5789 -0.9998 -0.9998 -0.6483 -0.6483 -0.5141 -0.5141 -0.4405 -0.4405 -0.4316 -0.4316 0.0428 0.0428 0.4406 0.4406 3.6053 3.6053 6.4351 6.4351 6.6753 6.6753 7.2627 7.2627 7.6439 7.6439 7.7633 7.7633 k = 0.4833-0.3779 0.0000 ( 6328 PWs) bands (ev): -20.3564 -20.3564 -20.3237 -20.3237 -19.1576 -19.1576 -19.0211 -19.0211 -18.0445 -18.0445 -17.9530 -17.9530 -12.8262 -12.8262 -9.7119 -9.7119 -8.3888 -8.3888 -8.2924 -8.2924 -8.1991 -8.1991 -7.9488 -7.9488 -7.8986 -7.8986 -7.7542 -7.7542 -7.5763 -7.5763 -5.1620 -5.1620 -5.0495 -5.0495 -4.7016 -4.7016 -4.3077 -4.3077 -4.2396 -4.2396 -4.1687 -4.1687 -1.5784 -1.5784 -0.9998 -0.9998 -0.6487 -0.6487 -0.5133 -0.5133 -0.4412 -0.4412 -0.4310 -0.4310 0.0421 0.0421 0.4409 0.4409 3.6051 3.6051 6.4352 6.4352 6.6752 6.6752 7.2516 7.2516 7.6426 7.6426 7.7776 7.7776 k = 0.4667-0.3649-0.0000 ( 6324 PWs) bands (ev): -20.3570 -20.3570 -20.3236 -20.3236 -19.1563 -19.1563 -19.0210 -19.0210 -18.0447 -18.0447 -17.9538 -17.9538 -12.8262 -12.8262 -9.7116 -9.7116 -8.3881 -8.3881 -8.2917 -8.2917 -8.1994 -8.1994 -7.9506 -7.9506 -7.8969 -7.8969 -7.7548 -7.7548 -7.5760 -7.5760 -5.1627 -5.1627 -5.0551 -5.0551 -4.6979 -4.6979 -4.3074 -4.3074 -4.2393 -4.2393 -4.1681 -4.1681 -1.5771 -1.5771 -1.0000 -1.0000 -0.6498 -0.6498 -0.5107 -0.5107 -0.4429 -0.4429 -0.4295 -0.4295 0.0401 0.0401 0.4417 0.4417 3.6048 3.6048 6.4352 6.4352 6.6749 6.6749 7.2209 7.2209 7.6417 7.6417 7.8146 7.8146 k = 0.4500-0.3519 0.0000 ( 6324 PWs) bands (ev): -20.3579 -20.3579 -20.3234 -20.3234 -19.1542 -19.1542 -19.0209 -19.0209 -18.0451 -18.0451 -17.9552 -17.9552 -12.8263 -12.8263 -9.7112 -9.7112 -8.3869 -8.3869 -8.2906 -8.2906 -8.1997 -8.1997 -7.9533 -7.9533 -7.8943 -7.8943 -7.7559 -7.7559 -7.5754 -7.5754 -5.1638 -5.1638 -5.0640 -5.0640 -4.6922 -4.6922 -4.3067 -4.3067 -4.2388 -4.2388 -4.1669 -4.1669 -1.5748 -1.5748 -1.0003 -1.0003 -0.6516 -0.6516 -0.5067 -0.5067 -0.4451 -0.4451 -0.4276 -0.4276 0.0368 0.0368 0.4430 0.4430 3.6042 3.6042 6.4352 6.4352 6.6743 6.6743 7.1758 7.1758 7.6448 7.6448 7.8658 7.8658 k = 0.4333-0.3388-0.0000 ( 6308 PWs) bands (ev): -20.3592 -20.3592 -20.3232 -20.3232 -19.1512 -19.1512 -19.0208 -19.0208 -18.0457 -18.0457 -17.9570 -17.9570 -12.8264 -12.8264 -9.7106 -9.7106 -8.3853 -8.3853 -8.2891 -8.2891 -8.2003 -8.2003 -7.9566 -7.9566 -7.8911 -7.8911 -7.7573 -7.7573 -7.5747 -7.5747 -5.1654 -5.1654 -5.0758 -5.0758 -4.6848 -4.6848 -4.3058 -4.3058 -4.2381 -4.2381 -4.1654 -4.1654 -1.5717 -1.5717 -1.0006 -1.0006 -0.6537 -0.6537 -0.5014 -0.5014 -0.4476 -0.4476 -0.4256 -0.4256 0.0323 0.0323 0.4449 0.4449 3.6033 3.6033 6.4352 6.4352 6.6735 6.6735 7.1213 7.1213 7.6527 7.6527 7.9251 7.9251 k = 0.4167-0.3258 0.0000 ( 6294 PWs) bands (ev): -20.3608 -20.3608 -20.3228 -20.3228 -19.1474 -19.1474 -19.0206 -19.0206 -18.0464 -18.0464 -17.9594 -17.9594 -12.8266 -12.8266 -9.7098 -9.7098 -8.3833 -8.3833 -8.2872 -8.2872 -8.2009 -8.2009 -7.9605 -7.9605 -7.8874 -7.8874 -7.7590 -7.7590 -7.5739 -7.5739 -5.1673 -5.1673 -5.0900 -5.0900 -4.6762 -4.6762 -4.3047 -4.3047 -4.2372 -4.2372 -4.1635 -4.1635 -1.5677 -1.5677 -1.0011 -1.0011 -0.6559 -0.6559 -0.4952 -0.4952 -0.4502 -0.4502 -0.4235 -0.4235 0.0265 0.0265 0.4474 0.4474 3.6022 3.6022 6.4353 6.4353 6.6725 6.6725 7.0611 7.0611 7.6651 7.6651 7.9893 7.9893 k = 0.4000-0.3128-0.0000 ( 6296 PWs) bands (ev): -20.3627 -20.3627 -20.3224 -20.3224 -19.1428 -19.1428 -19.0204 -19.0204 -18.0472 -18.0472 -17.9622 -17.9622 -12.8267 -12.8267 -9.7090 -9.7090 -8.3809 -8.3809 -8.2849 -8.2849 -8.2017 -8.2017 -7.9647 -7.9647 -7.8835 -7.8835 -7.7609 -7.7609 -7.5731 -7.5731 -5.1697 -5.1697 -5.1060 -5.1060 -4.6670 -4.6670 -4.3032 -4.3032 -4.2360 -4.2360 -4.1613 -4.1613 -1.5629 -1.5629 -1.0017 -1.0017 -0.6579 -0.6579 -0.4884 -0.4884 -0.4530 -0.4530 -0.4213 -0.4213 0.0195 0.0195 0.4503 0.4503 3.6009 3.6009 6.4354 6.4354 6.6713 6.6713 6.9977 6.9977 7.6815 7.6815 8.0561 8.0561 k = 0.3833-0.2997 0.0000 ( 6296 PWs) bands (ev): -20.3649 -20.3649 -20.3220 -20.3220 -19.1375 -19.1375 -19.0202 -19.0202 -18.0482 -18.0482 -17.9655 -17.9655 -12.8269 -12.8269 -9.7079 -9.7079 -8.3780 -8.3780 -8.2823 -8.2823 -8.2026 -8.2026 -7.9690 -7.9690 -7.8794 -7.8794 -7.7628 -7.7628 -7.5723 -7.5723 -5.1725 -5.1725 -5.1234 -5.1234 -4.6575 -4.6575 -4.3015 -4.3015 -4.2347 -4.2347 -4.1588 -4.1588 -1.5573 -1.5573 -1.0023 -1.0023 -0.6596 -0.6596 -0.4813 -0.4813 -0.4559 -0.4559 -0.4191 -0.4191 0.0115 0.0115 0.4537 0.4537 3.5994 3.5994 6.4355 6.4355 6.6699 6.6699 6.9325 6.9325 7.7017 7.7017 8.1243 8.1243 k = 0.3667-0.2867-0.0000 ( 6292 PWs) bands (ev): -20.3674 -20.3674 -20.3214 -20.3214 -19.1316 -19.1316 -19.0199 -19.0199 -18.0493 -18.0493 -17.9693 -17.9693 -12.8271 -12.8271 -9.7068 -9.7068 -8.3748 -8.3748 -8.2794 -8.2794 -8.2037 -8.2037 -7.9735 -7.9735 -7.8753 -7.8753 -7.7649 -7.7649 -7.5716 -7.5716 -5.1756 -5.1756 -5.1418 -5.1418 -4.6480 -4.6480 -4.2995 -4.2995 -4.2332 -4.2332 -4.1560 -4.1560 -1.5509 -1.5509 -1.0030 -1.0030 -0.6608 -0.6608 -0.4740 -0.4740 -0.4589 -0.4589 -0.4168 -0.4168 0.0025 0.0025 0.4576 0.4576 3.5977 3.5977 6.4356 6.4356 6.6684 6.6684 6.8667 6.8667 7.7253 7.7253 8.1929 8.1929 k = 0.3500-0.2737 0.0000 ( 6294 PWs) bands (ev): -20.3701 -20.3701 -20.3209 -20.3209 -19.1251 -19.1251 -19.0195 -19.0195 -18.0505 -18.0505 -17.9734 -17.9734 -12.8274 -12.8274 -9.7055 -9.7055 -8.3713 -8.3713 -8.2762 -8.2762 -8.2049 -8.2049 -7.9780 -7.9780 -7.8712 -7.8712 -7.7668 -7.7668 -7.5711 -7.5711 -5.1790 -5.1790 -5.1608 -5.1608 -4.6388 -4.6388 -4.2973 -4.2973 -4.2316 -4.2316 -4.1531 -4.1531 -1.5439 -1.5439 -1.0039 -1.0039 -0.6614 -0.6614 -0.4668 -0.4668 -0.4618 -0.4618 -0.4145 -0.4145 -0.0075 -0.0075 0.4620 0.4620 3.5958 3.5958 6.4357 6.4357 6.6667 6.6667 6.8010 6.8010 7.7523 7.7523 8.2611 8.2611 k = 0.3333-0.2606-0.0000 ( 6296 PWs) bands (ev): -20.3730 -20.3730 -20.3203 -20.3203 -19.1181 -19.1181 -19.0192 -19.0192 -18.0518 -18.0518 -17.9780 -17.9780 -12.8276 -12.8276 -9.7042 -9.7042 -8.3675 -8.3675 -8.2728 -8.2728 -8.2062 -8.2062 -7.9825 -7.9825 -7.8672 -7.8672 -7.7686 -7.7686 -7.5709 -7.5709 -5.1829 -5.1829 -5.1798 -5.1798 -4.6302 -4.6302 -4.2947 -4.2947 -4.2298 -4.2298 -4.1500 -4.1500 -1.5362 -1.5362 -1.0047 -1.0047 -0.6613 -0.6613 -0.4652 -0.4652 -0.4596 -0.4596 -0.4122 -0.4122 -0.0183 -0.0183 0.4668 0.4668 3.5938 3.5938 6.4359 6.4359 6.6648 6.6648 6.7359 6.7359 7.7824 7.7824 8.3283 8.3283 k = 0.3167-0.2476 0.0000 ( 6298 PWs) bands (ev): -20.3760 -20.3760 -20.3196 -20.3196 -19.1106 -19.1106 -19.0187 -19.0187 -18.0532 -18.0532 -17.9828 -17.9828 -12.8279 -12.8279 -9.7027 -9.7027 -8.3633 -8.3633 -8.2692 -8.2692 -8.2076 -8.2076 -7.9870 -7.9870 -7.8632 -7.8632 -7.7701 -7.7701 -7.5710 -7.5710 -5.1997 -5.1997 -5.1863 -5.1863 -4.6222 -4.6222 -4.2919 -4.2919 -4.2279 -4.2279 -4.1469 -4.1469 -1.5279 -1.5279 -1.0056 -1.0056 -0.6604 -0.6604 -0.4683 -0.4683 -0.4531 -0.4531 -0.4097 -0.4097 -0.0298 -0.0298 0.4719 0.4719 3.5916 3.5916 6.4361 6.4361 6.6627 6.6627 6.6718 6.6718 7.8157 7.8157 8.3938 8.3938 k = 0.3000-0.2346-0.0000 ( 6296 PWs) bands (ev): -20.3792 -20.3792 -20.3189 -20.3189 -19.1028 -19.1028 -19.0182 -19.0182 -18.0547 -18.0547 -17.9880 -17.9880 -12.8282 -12.8282 -9.7012 -9.7012 -8.3590 -8.3590 -8.2655 -8.2655 -8.2091 -8.2091 -7.9914 -7.9914 -7.8594 -7.8594 -7.7713 -7.7713 -7.5715 -7.5715 -5.2189 -5.2189 -5.1904 -5.1904 -4.6149 -4.6149 -4.2889 -4.2889 -4.2259 -4.2259 -4.1438 -4.1438 -1.5192 -1.5192 -1.0066 -1.0066 -0.6588 -0.6588 -0.4715 -0.4715 -0.4470 -0.4470 -0.4072 -0.4072 -0.0420 -0.0420 0.4775 0.4775 3.5893 3.5893 6.4363 6.4363 6.6091 6.6091 6.6606 6.6606 7.8519 7.8519 8.4570 8.4570 k = 0.2833-0.2215 0.0000 ( 6294 PWs) bands (ev): -20.3824 -20.3824 -20.3182 -20.3182 -19.0947 -19.0947 -19.0177 -19.0177 -18.0562 -18.0562 -17.9933 -17.9933 -12.8285 -12.8285 -9.6997 -9.6997 -8.3543 -8.3543 -8.2617 -8.2617 -8.2106 -8.2106 -7.9956 -7.9956 -7.8556 -7.8556 -7.7721 -7.7721 -7.5724 -7.5724 -5.2377 -5.2377 -5.1945 -5.1945 -4.6083 -4.6083 -4.2856 -4.2856 -4.2239 -4.2239 -4.1407 -4.1407 -1.5099 -1.5099 -1.0076 -1.0076 -0.6564 -0.6564 -0.4747 -0.4747 -0.4414 -0.4414 -0.4045 -0.4045 -0.0546 -0.0546 0.4833 0.4833 3.5869 3.5869 6.4366 6.4366 6.5481 6.5481 6.6584 6.6584 7.8910 7.8910 8.5172 8.5172 k = 0.2667-0.2085-0.0000 ( 6298 PWs) bands (ev): -20.3857 -20.3857 -20.3175 -20.3175 -19.0866 -19.0866 -19.0170 -19.0170 -18.0578 -18.0578 -17.9989 -17.9989 -12.8288 -12.8288 -9.6981 -9.6981 -8.3496 -8.3496 -8.2580 -8.2580 -8.2123 -8.2123 -7.9998 -7.9998 -7.8521 -7.8521 -7.7724 -7.7724 -7.5738 -7.5738 -5.2561 -5.2561 -5.1988 -5.1988 -4.6026 -4.6026 -4.2822 -4.2822 -4.2219 -4.2219 -4.1377 -4.1377 -1.5004 -1.5004 -1.0087 -1.0087 -0.6533 -0.6533 -0.4779 -0.4779 -0.4365 -0.4365 -0.4017 -0.4017 -0.0676 -0.0676 0.4894 0.4894 3.5845 3.5845 6.4369 6.4369 6.4891 6.4891 6.6561 6.6561 7.9328 7.9328 8.5736 8.5736 k = 0.2500-0.1955 0.0000 ( 6304 PWs) bands (ev): -20.3890 -20.3890 -20.3168 -20.3168 -19.0783 -19.0783 -19.0162 -19.0162 -18.0593 -18.0593 -18.0047 -18.0047 -12.8291 -12.8291 -9.6965 -9.6965 -8.3447 -8.3447 -8.2542 -8.2542 -8.2140 -8.2140 -8.0038 -8.0038 -7.8487 -7.8487 -7.7723 -7.7723 -7.5756 -7.5756 -5.2738 -5.2738 -5.2031 -5.2031 -4.5976 -4.5976 -4.2785 -4.2785 -4.2200 -4.2200 -4.1348 -4.1348 -1.4906 -1.4906 -1.0097 -1.0097 -0.6495 -0.6495 -0.4811 -0.4811 -0.4323 -0.4323 -0.3988 -0.3988 -0.0809 -0.0809 0.4956 0.4956 3.5820 3.5820 6.4317 6.4317 6.4377 6.4377 6.6538 6.6538 7.9771 7.9771 8.6254 8.6254 k = 0.2333-0.1825 0.0000 ( 6302 PWs) bands (ev): -20.3923 -20.3923 -20.3161 -20.3161 -19.0703 -19.0703 -19.0153 -19.0153 -18.0609 -18.0609 -18.0105 -18.0105 -12.8294 -12.8294 -9.6949 -9.6949 -8.3397 -8.3397 -8.2506 -8.2506 -8.2158 -8.2158 -8.0076 -8.0076 -7.8455 -7.8455 -7.7715 -7.7715 -7.5780 -7.5780 -5.2908 -5.2908 -5.2073 -5.2073 -4.5934 -4.5934 -4.2747 -4.2747 -4.2181 -4.2181 -4.1320 -4.1320 -1.4806 -1.4806 -1.0108 -1.0108 -0.6452 -0.6452 -0.4842 -0.4842 -0.4288 -0.4288 -0.3957 -0.3957 -0.0944 -0.0944 0.5020 0.5020 3.5794 3.5794 6.3778 6.3778 6.4376 6.4376 6.6514 6.6514 8.0239 8.0239 8.6719 8.6719 k = 0.2167-0.1694-0.0000 ( 6294 PWs) bands (ev): -20.3955 -20.3955 -20.3153 -20.3153 -19.0624 -19.0624 -19.0141 -19.0141 -18.0624 -18.0624 -18.0163 -18.0163 -12.8297 -12.8297 -9.6934 -9.6934 -8.3346 -8.3346 -8.2470 -8.2470 -8.2176 -8.2176 -8.0112 -8.0112 -7.8425 -7.8425 -7.7702 -7.7702 -7.5808 -7.5808 -5.3069 -5.3069 -5.2116 -5.2116 -4.5898 -4.5898 -4.2709 -4.2709 -4.2164 -4.2164 -4.1295 -4.1295 -1.4706 -1.4706 -1.0118 -1.0118 -0.6403 -0.6403 -0.4873 -0.4873 -0.4260 -0.4260 -0.3925 -0.3925 -0.1079 -0.1079 0.5084 0.5084 3.5769 3.5769 6.3261 6.3261 6.4380 6.4380 6.6490 6.6490 8.0729 8.0729 8.7125 8.7125 k = 0.2000-0.1564-0.0000 ( 6302 PWs) bands (ev): -20.3986 -20.3986 -20.3146 -20.3146 -19.0551 -19.0551 -19.0126 -19.0126 -18.0639 -18.0639 -18.0220 -18.0220 -12.8300 -12.8300 -9.6918 -9.6918 -8.3296 -8.3296 -8.2437 -8.2437 -8.2195 -8.2195 -8.0147 -8.0147 -7.8397 -7.8397 -7.7683 -7.7683 -7.5842 -7.5842 -5.3221 -5.3221 -5.2157 -5.2157 -4.5869 -4.5869 -4.2669 -4.2669 -4.2147 -4.2147 -4.1271 -4.1271 -1.4606 -1.4606 -1.0128 -1.0128 -0.6351 -0.6351 -0.4903 -0.4903 -0.4239 -0.4239 -0.3891 -0.3891 -0.1213 -0.1213 0.5148 0.5148 3.5745 3.5745 6.2772 6.2772 6.4384 6.4384 6.6467 6.6467 8.1240 8.1240 8.7465 8.7465 k = 0.1833-0.1434-0.0000 ( 6294 PWs) bands (ev): -20.4016 -20.4016 -20.3139 -20.3139 -19.0484 -19.0484 -19.0106 -19.0106 -18.0654 -18.0654 -18.0277 -18.0277 -12.8303 -12.8303 -9.6904 -9.6904 -8.3245 -8.3245 -8.2405 -8.2405 -8.2215 -8.2215 -8.0179 -8.0179 -7.8371 -7.8371 -7.7658 -7.7658 -7.5880 -7.5880 -5.3362 -5.3362 -5.2196 -5.2196 -4.5845 -4.5845 -4.2630 -4.2630 -4.2133 -4.2133 -4.1250 -4.1250 -1.4509 -1.4509 -1.0138 -1.0138 -0.6295 -0.6295 -0.4932 -0.4932 -0.4224 -0.4224 -0.3855 -0.3855 -0.1345 -0.1345 0.5211 0.5211 3.5721 3.5721 6.2315 6.2315 6.4389 6.4389 6.6443 6.6443 8.1767 8.1767 8.7738 8.7738 k = 0.1667-0.1303-0.0000 ( 6300 PWs) bands (ev): -20.4044 -20.4044 -20.3133 -20.3133 -19.0426 -19.0426 -19.0081 -19.0081 -18.0668 -18.0668 -18.0331 -18.0331 -12.8306 -12.8306 -9.6890 -9.6890 -8.3196 -8.3196 -8.2376 -8.2376 -8.2234 -8.2234 -8.0208 -8.0208 -7.8347 -7.8347 -7.7628 -7.7628 -7.5922 -7.5922 -5.3492 -5.3492 -5.2234 -5.2234 -4.5826 -4.5826 -4.2592 -4.2592 -4.2119 -4.2119 -4.1231 -4.1231 -1.4414 -1.4414 -1.0148 -1.0148 -0.6238 -0.6238 -0.4960 -0.4960 -0.4216 -0.4216 -0.3818 -0.3818 -0.1474 -0.1474 0.5272 0.5272 3.5698 3.5698 6.1890 6.1890 6.4393 6.4393 6.6421 6.6421 8.2310 8.2310 8.7946 8.7946 k = 0.1500-0.1173-0.0000 ( 6298 PWs) bands (ev): -20.4070 -20.4070 -20.3127 -20.3127 -19.0379 -19.0379 -19.0050 -19.0050 -18.0681 -18.0681 -18.0384 -18.0384 -12.8308 -12.8308 -9.6877 -9.6877 -8.3149 -8.3149 -8.2349 -8.2349 -8.2254 -8.2254 -8.0236 -8.0236 -7.8325 -7.8325 -7.7592 -7.7592 -7.5968 -7.5968 -5.3612 -5.3612 -5.2270 -5.2270 -4.5812 -4.5812 -4.2554 -4.2554 -4.2108 -4.2108 -4.1215 -4.1215 -1.4323 -1.4323 -1.0157 -1.0157 -0.6181 -0.6181 -0.4986 -0.4986 -0.4213 -0.4213 -0.3779 -0.3779 -0.1598 -0.1598 0.5330 0.5330 3.5676 3.5676 6.1499 6.1499 6.4398 6.4398 6.6399 6.6399 8.2863 8.2863 8.8093 8.8093 k = 0.1333-0.1043-0.0000 ( 6303 PWs) bands (ev): -20.4094 -20.4094 -20.3121 -20.3121 -19.0342 -19.0342 -19.0014 -19.0014 -18.0693 -18.0693 -18.0433 -18.0433 -12.8311 -12.8311 -9.6864 -9.6864 -8.3103 -8.3103 -8.2325 -8.2325 -8.2273 -8.2273 -8.0261 -8.0261 -7.8306 -7.8306 -7.7553 -7.7553 -7.6018 -7.6018 -5.3719 -5.3719 -5.2303 -5.2303 -4.5800 -4.5800 -4.2519 -4.2519 -4.2098 -4.2098 -4.1201 -4.1201 -1.4238 -1.4238 -1.0165 -1.0165 -0.6124 -0.6124 -0.5010 -0.5010 -0.4215 -0.4215 -0.3740 -0.3740 -0.1717 -0.1717 0.5385 0.5385 3.5655 3.5655 6.1145 6.1145 6.4403 6.4403 6.6379 6.6379 8.3423 8.3423 8.8186 8.8186 k = 0.1167-0.0912 0.0000 ( 6297 PWs) bands (ev): -20.4116 -20.4116 -20.3116 -20.3116 -19.0315 -19.0315 -18.9974 -18.9974 -18.0704 -18.0704 -18.0478 -18.0478 -12.8313 -12.8313 -9.6853 -9.6853 -8.3059 -8.3059 -8.2305 -8.2305 -8.2291 -8.2291 -8.0283 -8.0283 -7.8289 -7.8289 -7.7510 -7.7510 -7.6069 -7.6069 -5.3815 -5.3815 -5.2332 -5.2332 -4.5792 -4.5792 -4.2485 -4.2485 -4.2089 -4.2089 -4.1189 -4.1189 -1.4160 -1.4160 -1.0173 -1.0173 -0.6069 -0.6069 -0.5032 -0.5032 -0.4221 -0.4221 -0.3700 -0.3700 -0.1829 -0.1829 0.5435 0.5435 3.5637 3.5637 6.0828 6.0828 6.4407 6.4407 6.6360 6.6360 8.3984 8.3984 8.8230 8.8230 k = 0.1000-0.0782-0.0000 ( 6299 PWs) bands (ev): -20.4136 -20.4136 -20.3111 -20.3111 -19.0295 -19.0295 -18.9934 -18.9934 -18.0714 -18.0714 -18.0518 -18.0518 -12.8315 -12.8315 -9.6844 -9.6844 -8.3019 -8.3019 -8.2312 -8.2312 -8.2284 -8.2284 -8.0302 -8.0302 -7.8274 -7.8274 -7.7465 -7.7465 -7.6120 -7.6120 -5.3898 -5.3898 -5.2359 -5.2359 -4.5786 -4.5786 -4.2455 -4.2455 -4.2082 -4.2082 -4.1179 -4.1179 -1.4089 -1.4089 -1.0179 -1.0179 -0.6017 -0.6017 -0.5052 -0.5052 -0.4229 -0.4229 -0.3660 -0.3660 -0.1933 -0.1933 0.5481 0.5481 3.5620 3.5620 6.0551 6.0551 6.4412 6.4412 6.6343 6.6343 8.4541 8.4541 8.8231 8.8231 k = 0.0833-0.0652-0.0000 ( 6311 PWs) bands (ev): -20.4153 -20.4153 -20.3107 -20.3107 -19.0281 -19.0281 -18.9896 -18.9896 -18.0723 -18.0723 -18.0554 -18.0554 -12.8317 -12.8317 -9.6835 -9.6835 -8.2983 -8.2983 -8.2330 -8.2330 -8.2269 -8.2269 -8.0319 -8.0319 -7.8261 -7.8261 -7.7421 -7.7421 -7.6171 -7.6171 -5.3969 -5.3969 -5.2382 -5.2382 -4.5782 -4.5782 -4.2428 -4.2428 -4.2076 -4.2076 -4.1172 -4.1172 -1.4027 -1.4027 -1.0185 -1.0185 -0.5971 -0.5971 -0.5069 -0.5069 -0.4239 -0.4239 -0.3622 -0.3622 -0.2026 -0.2026 0.5520 0.5520 3.5606 3.5606 6.0314 6.0314 6.4415 6.4415 6.6328 6.6328 8.5085 8.5085 8.8192 8.8193 k = 0.0667-0.0521 0.0000 ( 6319 PWs) bands (ev): -20.4167 -20.4167 -20.3104 -20.3104 -19.0271 -19.0271 -18.9862 -18.9862 -18.0730 -18.0730 -18.0583 -18.0583 -12.8318 -12.8318 -9.6828 -9.6828 -8.2952 -8.2952 -8.2345 -8.2345 -8.2256 -8.2256 -8.0333 -8.0333 -7.8251 -7.8251 -7.7378 -7.7378 -7.6218 -7.6218 -5.4027 -5.4027 -5.2401 -5.2401 -4.5779 -4.5779 -4.2405 -4.2405 -4.2072 -4.2072 -4.1166 -4.1166 -1.3975 -1.3975 -1.0190 -1.0190 -0.5930 -0.5930 -0.5083 -0.5083 -0.4249 -0.4249 -0.3587 -0.3587 -0.2107 -0.2107 0.5554 0.5554 3.5594 3.5594 6.0118 6.0118 6.4419 6.4419 6.6315 6.6315 8.5608 8.5608 8.8115 8.8115 k = 0.0500-0.0391-0.0000 ( 6325 PWs) bands (ev): -20.4178 -20.4178 -20.3101 -20.3101 -19.0264 -19.0264 -18.9835 -18.9835 -18.0736 -18.0736 -18.0607 -18.0607 -12.8320 -12.8320 -9.6822 -9.6822 -8.2926 -8.2926 -8.2359 -8.2359 -8.2247 -8.2247 -8.0344 -8.0344 -7.8243 -7.8243 -7.7340 -7.7340 -7.6260 -7.6260 -5.4072 -5.4072 -5.2416 -5.2416 -4.5777 -4.5777 -4.2387 -4.2387 -4.2069 -4.2069 -4.1162 -4.1162 -1.3934 -1.3934 -1.0194 -1.0194 -0.5897 -0.5897 -0.5095 -0.5095 -0.4259 -0.4259 -0.3556 -0.3556 -0.2174 -0.2174 0.5580 0.5580 3.5584 3.5584 5.9965 5.9965 6.4421 6.4421 6.6305 6.6305 8.6099 8.6099 8.7996 8.7996 k = 0.0333-0.0261-0.0000 ( 6327 PWs) bands (ev): -20.4186 -20.4186 -20.3099 -20.3099 -19.0260 -19.0260 -18.9814 -18.9814 -18.0740 -18.0740 -18.0624 -18.0624 -12.8320 -12.8320 -9.6818 -9.6818 -8.2906 -8.2906 -8.2370 -8.2370 -8.2240 -8.2240 -8.0351 -8.0351 -7.8237 -7.8237 -7.7310 -7.7310 -7.6293 -7.6293 -5.4104 -5.4104 -5.2427 -5.2427 -4.5776 -4.5776 -4.2373 -4.2373 -4.2066 -4.2066 -4.1159 -4.1159 -1.3904 -1.3904 -1.0197 -1.0197 -0.5872 -0.5872 -0.5103 -0.5103 -0.4266 -0.4266 -0.3532 -0.3532 -0.2224 -0.2224 0.5599 0.5599 3.5577 3.5577 5.9855 5.9855 6.4423 6.4423 6.6298 6.6298 8.6548 8.6548 8.7831 8.7831 k = 0.0167-0.0130-0.0000 ( 6323 PWs) bands (ev): -20.4190 -20.4190 -20.3098 -20.3098 -19.0257 -19.0257 -18.9802 -18.9802 -18.0742 -18.0742 -18.0635 -18.0635 -12.8321 -12.8321 -9.6816 -9.6816 -8.2894 -8.2894 -8.2376 -8.2376 -8.2235 -8.2235 -8.0356 -8.0356 -7.8234 -7.8234 -7.7290 -7.7290 -7.6314 -7.6314 -5.4124 -5.4124 -5.2433 -5.2433 -4.5775 -4.5775 -4.2365 -4.2365 -4.2065 -4.2065 -4.1157 -4.1157 -1.3886 -1.3886 -1.0198 -1.0198 -0.5857 -0.5857 -0.5108 -0.5108 -0.4271 -0.4271 -0.3517 -0.3517 -0.2255 -0.2255 0.5611 0.5611 3.5573 3.5573 5.9789 5.9789 6.4425 6.4425 6.6294 6.6294 8.6936 8.6936 8.7622 8.7622 k = 0.0000 0.0000 0.0000 ( 6333 PWs) bands (ev): -20.4192 -20.4192 -20.3098 -20.3098 -19.0256 -19.0256 -18.9798 -18.9798 -18.0743 -18.0743 -18.0638 -18.0638 -12.8321 -12.8321 -9.6815 -9.6815 -8.2890 -8.2890 -8.2379 -8.2379 -8.2234 -8.2234 -8.0358 -8.0358 -7.8233 -7.8233 -7.7283 -7.7283 -7.6322 -7.6322 -5.4130 -5.4130 -5.2436 -5.2436 -4.5775 -4.5775 -4.2362 -4.2362 -4.2064 -4.2064 -4.1157 -4.1157 -1.3880 -1.3880 -1.0199 -1.0199 -0.5852 -0.5852 -0.5110 -0.5110 -0.4273 -0.4273 -0.3511 -0.3511 -0.2266 -0.2266 0.5615 0.5615 3.5572 3.5572 5.9767 5.9767 6.4425 6.4425 6.6292 6.6292 8.7170 8.7170 8.7449 8.7449 k = 0.0000 0.0000 0.0000 ( 6333 PWs) bands (ev): -20.4192 -20.4192 -20.3098 -20.3098 -19.0256 -19.0256 -18.9798 -18.9798 -18.0743 -18.0743 -18.0638 -18.0638 -12.8321 -12.8321 -9.6815 -9.6815 -8.2890 -8.2890 -8.2379 -8.2379 -8.2234 -8.2234 -8.0358 -8.0358 -7.8233 -7.8233 -7.7283 -7.7283 -7.6322 -7.6322 -5.4130 -5.4130 -5.2436 -5.2436 -4.5775 -4.5775 -4.2362 -4.2362 -4.2064 -4.2064 -4.1157 -4.1157 -1.3880 -1.3880 -1.0199 -1.0199 -0.5852 -0.5852 -0.5110 -0.5110 -0.4273 -0.4273 -0.3511 -0.3511 -0.2266 -0.2266 0.5615 0.5615 3.5572 3.5572 5.9767 5.9767 6.4425 6.4425 6.6292 6.6292 8.7170 8.7170 8.7449 8.7449 k = 0.0192 0.0048-0.0054 ( 6329 PWs) bands (ev): -20.4191 -20.4191 -20.3098 -20.3098 -19.0258 -19.0258 -18.9799 -18.9799 -18.0742 -18.0742 -18.0636 -18.0636 -12.8321 -12.8321 -9.6816 -9.6816 -8.2890 -8.2890 -8.2380 -8.2380 -8.2239 -8.2239 -8.0356 -8.0356 -7.8236 -7.8236 -7.7286 -7.7286 -7.6312 -7.6312 -5.4130 -5.4130 -5.2430 -5.2430 -4.5773 -4.5773 -4.2367 -4.2367 -4.2065 -4.2065 -4.1157 -4.1157 -1.3883 -1.3883 -1.0199 -1.0199 -0.5857 -0.5857 -0.5107 -0.5107 -0.4314 -0.4314 -0.3473 -0.3473 -0.2261 -0.2261 0.5616 0.5616 3.5577 3.5577 5.9783 5.9783 6.4417 6.4417 6.6287 6.6287 8.7067 8.7067 8.7523 8.7523 k = 0.0385 0.0096-0.0108 ( 6328 PWs) bands (ev): -20.4186 -20.4186 -20.3100 -20.3100 -19.0263 -19.0263 -18.9804 -18.9804 -18.0739 -18.0739 -18.0631 -18.0631 -12.8320 -12.8320 -9.6817 -9.6817 -8.2890 -8.2890 -8.2382 -8.2382 -8.2253 -8.2253 -8.0353 -8.0353 -7.8245 -7.8245 -7.7293 -7.7293 -7.6284 -7.6284 -5.4130 -5.4130 -5.2412 -5.2412 -4.5768 -4.5768 -4.2382 -4.2382 -4.2066 -4.2066 -4.1158 -4.1158 -1.3892 -1.3892 -1.0199 -1.0199 -0.5870 -0.5870 -0.5101 -0.5101 -0.4418 -0.4418 -0.3378 -0.3378 -0.2247 -0.2247 0.5618 0.5618 3.5593 3.5593 5.9831 5.9831 6.4394 6.4394 6.6272 6.6272 8.6853 8.6853 8.7649 8.7649 k = 0.0577 0.0143-0.0162 ( 6330 PWs) bands (ev): -20.4180 -20.4180 -20.3103 -20.3103 -19.0271 -19.0271 -18.9813 -18.9813 -18.0733 -18.0733 -18.0622 -18.0622 -12.8319 -12.8319 -9.6820 -9.6820 -8.2892 -8.2892 -8.2388 -8.2388 -8.2276 -8.2276 -8.0347 -8.0347 -7.8258 -7.8258 -7.7303 -7.7303 -7.6241 -7.6241 -5.4130 -5.4130 -5.2384 -5.2384 -4.5759 -4.5759 -4.2406 -4.2406 -4.2068 -4.2068 -4.1160 -4.1160 -1.3908 -1.3908 -1.0200 -1.0200 -0.5891 -0.5891 -0.5091 -0.5091 -0.4555 -0.4555 -0.3255 -0.3255 -0.2223 -0.2223 0.5621 0.5621 3.5620 3.5620 5.9911 5.9911 6.4355 6.4355 6.6248 6.6248 8.6570 8.6570 8.7778 8.7778 k = 0.0769 0.0191-0.0215 ( 6325 PWs) bands (ev): -20.4171 -20.4171 -20.3106 -20.3106 -19.0282 -19.0282 -18.9825 -18.9825 -18.0726 -18.0726 -18.0610 -18.0610 -12.8318 -12.8318 -9.6823 -9.6823 -8.2895 -8.2895 -8.2396 -8.2396 -8.2305 -8.2305 -8.0338 -8.0338 -7.8274 -7.8274 -7.7315 -7.7315 -7.6186 -7.6186 -5.4128 -5.4128 -5.2346 -5.2346 -4.5746 -4.5746 -4.2441 -4.2441 -4.2070 -4.2070 -4.1163 -4.1163 -1.3930 -1.3930 -1.0200 -1.0200 -0.5921 -0.5921 -0.5079 -0.5079 -0.4706 -0.4706 -0.3123 -0.3123 -0.2188 -0.2188 0.5626 0.5626 3.5657 3.5657 6.0022 6.0022 6.4301 6.4301 6.6216 6.6216 8.6215 8.6215 8.7908 8.7908 k = 0.0962 0.0239-0.0269 ( 6320 PWs) bands (ev): -20.4159 -20.4159 -20.3111 -20.3111 -19.0296 -19.0296 -18.9840 -18.9840 -18.0717 -18.0717 -18.0595 -18.0595 -12.8316 -12.8316 -9.6827 -9.6827 -8.2900 -8.2900 -8.2414 -8.2414 -8.2336 -8.2336 -8.0326 -8.0326 -7.8289 -7.8289 -7.7328 -7.7328 -7.6124 -7.6124 -5.4123 -5.4123 -5.2299 -5.2299 -4.5730 -4.5730 -4.2485 -4.2485 -4.2072 -4.2072 -4.1167 -4.1167 -1.3957 -1.3957 -1.0201 -1.0201 -0.5957 -0.5957 -0.5070 -0.5070 -0.4857 -0.4857 -0.2994 -0.2994 -0.2142 -0.2142 0.5632 0.5632 3.5704 3.5704 6.0163 6.0163 6.4234 6.4234 6.6176 6.6176 8.5784 8.5784 8.8040 8.8040 k = 0.1154 0.0287-0.0323 ( 6316 PWs) bands (ev): -20.4144 -20.4144 -20.3118 -20.3118 -19.0312 -19.0312 -18.9857 -18.9857 -18.0705 -18.0705 -18.0577 -18.0577 -12.8314 -12.8314 -9.6832 -9.6832 -8.2909 -8.2909 -8.2448 -8.2448 -8.2358 -8.2358 -8.0311 -8.0311 -7.8302 -7.8302 -7.7341 -7.7341 -7.6057 -7.6057 -5.4116 -5.4116 -5.2245 -5.2245 -4.5710 -4.5710 -4.2539 -4.2539 -4.2073 -4.2073 -4.1172 -4.1172 -1.3990 -1.3990 -1.0202 -1.0202 -0.5999 -0.5999 -0.5095 -0.5095 -0.4973 -0.4973 -0.2871 -0.2871 -0.2085 -0.2085 0.5639 0.5639 3.5760 3.5760 6.0332 6.0332 6.4155 6.4155 6.6131 6.6131 8.5281 8.5281 8.8174 8.8174 k = 0.1346 0.0334-0.0377 ( 6315 PWs) bands (ev): -20.4127 -20.4127 -20.3125 -20.3125 -19.0331 -19.0331 -18.9878 -18.9878 -18.0692 -18.0692 -18.0557 -18.0557 -12.8311 -12.8311 -9.6837 -9.6837 -8.2925 -8.2925 -8.2497 -8.2497 -8.2369 -8.2369 -8.0293 -8.0293 -7.8310 -7.8310 -7.7354 -7.7354 -7.5989 -7.5989 -5.4105 -5.4105 -5.2186 -5.2186 -4.5686 -4.5686 -4.2602 -4.2602 -4.2074 -4.2074 -4.1178 -4.1178 -1.4027 -1.4027 -1.0204 -1.0204 -0.6048 -0.6048 -0.5214 -0.5214 -0.4991 -0.4991 -0.2760 -0.2760 -0.2015 -0.2015 0.5648 0.5648 3.5825 3.5825 6.0529 6.0529 6.4065 6.4065 6.6082 6.6082 8.4713 8.4713 8.8311 8.8311 k = 0.1538 0.0382-0.0431 ( 6311 PWs) bands (ev): -20.4108 -20.4108 -20.3134 -20.3134 -19.0352 -19.0352 -18.9900 -18.9900 -18.0677 -18.0677 -18.0535 -18.0535 -12.8308 -12.8308 -9.6843 -9.6843 -8.2949 -8.2949 -8.2553 -8.2553 -8.2375 -8.2375 -8.0271 -8.0271 -7.8312 -7.8312 -7.7366 -7.7366 -7.5922 -7.5922 -5.4089 -5.4089 -5.2122 -5.2122 -4.5660 -4.5660 -4.2673 -4.2673 -4.2075 -4.2075 -4.1185 -4.1185 -1.4069 -1.4069 -1.0205 -1.0205 -0.6103 -0.6103 -0.5358 -0.5358 -0.4976 -0.4976 -0.2661 -0.2661 -0.1935 -0.1935 0.5658 0.5658 3.5897 3.5897 6.0751 6.0751 6.3965 6.3965 6.6032 6.6032 8.4090 8.4090 8.8451 8.8451 k = 0.1731 0.0430-0.0485 ( 6309 PWs) bands (ev): -20.4087 -20.4087 -20.3144 -20.3144 -19.0375 -19.0375 -18.9925 -18.9925 -18.0660 -18.0660 -18.0512 -18.0512 -12.8305 -12.8305 -9.6849 -9.6849 -8.2986 -8.2986 -8.2608 -8.2608 -8.2378 -8.2378 -8.0246 -8.0246 -7.8306 -7.8306 -7.7377 -7.7377 -7.5860 -7.5860 -5.4067 -5.4067 -5.2056 -5.2056 -4.5630 -4.5630 -4.2752 -4.2752 -4.2076 -4.2076 -4.1192 -4.1192 -1.4115 -1.4115 -1.0207 -1.0207 -0.6165 -0.6165 -0.5498 -0.5498 -0.4955 -0.4955 -0.2574 -0.2574 -0.1846 -0.1846 0.5669 0.5669 3.5976 3.5976 6.0994 6.0994 6.3859 6.3859 6.5985 6.5985 8.3425 8.3425 8.8592 8.8592 k = 0.1923 0.0478-0.0539 ( 6309 PWs) bands (ev): -20.4064 -20.4064 -20.3155 -20.3155 -19.0398 -19.0398 -18.9951 -18.9951 -18.0643 -18.0643 -18.0487 -18.0487 -12.8302 -12.8302 -9.6856 -9.6856 -8.3040 -8.3040 -8.2658 -8.2658 -8.2379 -8.2379 -8.0219 -8.0219 -7.8291 -7.8291 -7.7388 -7.7388 -7.5803 -7.5803 -5.4041 -5.4041 -5.1989 -5.1989 -4.5596 -4.5596 -4.2836 -4.2836 -4.2078 -4.2078 -4.1201 -4.1201 -1.4164 -1.4164 -1.0208 -1.0208 -0.6234 -0.6234 -0.5628 -0.5628 -0.4933 -0.4933 -0.2499 -0.2499 -0.1751 -0.1751 0.5682 0.5682 3.6060 3.6060 6.1255 6.1255 6.3747 6.3747 6.5944 6.5944 8.2728 8.2728 8.8733 8.8733 k = 0.2115 0.0526-0.0593 ( 6308 PWs) bands (ev): -20.4039 -20.4039 -20.3167 -20.3167 -19.0423 -19.0423 -18.9979 -18.9979 -18.0624 -18.0624 -18.0461 -18.0461 -12.8299 -12.8299 -9.6862 -9.6862 -8.3111 -8.3111 -8.2697 -8.2697 -8.2378 -8.2378 -8.0190 -8.0190 -7.8268 -7.8268 -7.7397 -7.7397 -7.5753 -7.5753 -5.4008 -5.4008 -5.1922 -5.1922 -4.5560 -4.5560 -4.2926 -4.2926 -4.2080 -4.2080 -4.1209 -4.1209 -1.4215 -1.4215 -1.0210 -1.0210 -0.6311 -0.6311 -0.5746 -0.5746 -0.4909 -0.4909 -0.2433 -0.2433 -0.1653 -0.1653 0.5696 0.5696 3.6149 3.6149 6.1529 6.1529 6.3634 6.3634 6.5914 6.5914 8.2006 8.2006 8.8873 8.8873 k = 0.2308 0.0573-0.0646 ( 6309 PWs) bands (ev): -20.4011 -20.4011 -20.3181 -20.3181 -19.0448 -19.0448 -19.0007 -19.0007 -18.0605 -18.0605 -18.0435 -18.0435 -12.8295 -12.8295 -9.6868 -9.6868 -8.3196 -8.3196 -8.2728 -8.2728 -8.2376 -8.2376 -8.0160 -8.0160 -7.8237 -7.8237 -7.7407 -7.7407 -7.5711 -7.5711 -5.3970 -5.3970 -5.1857 -5.1857 -4.5521 -4.5521 -4.3020 -4.3020 -4.2084 -4.2084 -4.1218 -4.1218 -1.4268 -1.4268 -1.0212 -1.0212 -0.6395 -0.6395 -0.5850 -0.5850 -0.4885 -0.4885 -0.2375 -0.2375 -0.1554 -0.1554 0.5711 0.5711 3.6241 3.6241 6.1807 6.1807 6.3523 6.3523 6.5901 6.5901 8.1267 8.1267 8.9010 8.9010 k = 0.2500 0.0621-0.0700 ( 6308 PWs) bands (ev): -20.3983 -20.3983 -20.3197 -20.3197 -19.0474 -19.0474 -19.0036 -19.0036 -18.0585 -18.0585 -18.0409 -18.0409 -12.8292 -12.8292 -9.6874 -9.6874 -8.3291 -8.3291 -8.2752 -8.2752 -8.2372 -8.2372 -8.0128 -8.0128 -7.8197 -7.8197 -7.7415 -7.7415 -7.5677 -7.5677 -5.3927 -5.3927 -5.1793 -5.1793 -4.5480 -4.5480 -4.3117 -4.3117 -4.2090 -4.2090 -4.1226 -4.1226 -1.4322 -1.4322 -1.0213 -1.0213 -0.6486 -0.6486 -0.5940 -0.5940 -0.4861 -0.4861 -0.2324 -0.2324 -0.1458 -0.1458 0.5727 0.5727 3.6335 3.6335 6.2077 6.2077 6.3419 6.3419 6.5915 6.5915 8.0517 8.0517 8.9142 8.9142 k = 0.2692 0.0669-0.0754 ( 6308 PWs) bands (ev): -20.3953 -20.3953 -20.3214 -20.3214 -19.0499 -19.0499 -19.0065 -19.0065 -18.0565 -18.0565 -18.0384 -18.0384 -12.8288 -12.8288 -9.6880 -9.6880 -8.3392 -8.3392 -8.2771 -8.2771 -8.2368 -8.2368 -8.0097 -8.0097 -7.8150 -7.8150 -7.7423 -7.7423 -7.5653 -7.5653 -5.3879 -5.3879 -5.1733 -5.1733 -4.5436 -4.5436 -4.3217 -4.3217 -4.2096 -4.2096 -4.1234 -4.1234 -1.4376 -1.4376 -1.0215 -1.0215 -0.6580 -0.6580 -0.6017 -0.6017 -0.4837 -0.4837 -0.2277 -0.2277 -0.1366 -0.1366 0.5743 0.5743 3.6430 3.6430 6.2322 6.2322 6.3332 6.3332 6.5964 6.5964 7.9759 7.9759 8.9269 8.9269 k = 0.2885 0.0717-0.0808 ( 6313 PWs) bands (ev): -20.3921 -20.3921 -20.3232 -20.3232 -19.0523 -19.0523 -19.0094 -19.0094 -18.0545 -18.0545 -18.0358 -18.0358 -12.8285 -12.8285 -9.6885 -9.6885 -8.3495 -8.3495 -8.2788 -8.2788 -8.2363 -8.2363 -8.0066 -8.0066 -7.8096 -7.8096 -7.7430 -7.7430 -7.5637 -7.5637 -5.3827 -5.3827 -5.1676 -5.1676 -4.5390 -4.5390 -4.3317 -4.3317 -4.2105 -4.2105 -4.1241 -4.1241 -1.4429 -1.4429 -1.0217 -1.0217 -0.6675 -0.6675 -0.6082 -0.6082 -0.4814 -0.4814 -0.2235 -0.2235 -0.1280 -0.1280 0.5760 0.5760 3.6524 3.6524 6.2512 6.2512 6.3283 6.3283 6.6062 6.6062 7.8998 7.8998 8.9387 8.9387 k = 0.3077 0.0765-0.0862 ( 6312 PWs) bands (ev): -20.3889 -20.3889 -20.3251 -20.3251 -19.0547 -19.0547 -19.0121 -19.0121 -18.0526 -18.0526 -18.0334 -18.0334 -12.8282 -12.8282 -9.6890 -9.6890 -8.3598 -8.3598 -8.2802 -8.2802 -8.2357 -8.2357 -8.0037 -8.0037 -7.8038 -7.8038 -7.7435 -7.7435 -7.5629 -7.5629 -5.3773 -5.3773 -5.1625 -5.1625 -4.5343 -4.5343 -4.3417 -4.3417 -4.2115 -4.2115 -4.1247 -4.1247 -1.4481 -1.4481 -1.0219 -1.0219 -0.6768 -0.6768 -0.6139 -0.6139 -0.4792 -0.4792 -0.2198 -0.2198 -0.1199 -0.1199 0.5777 0.5777 3.6615 3.6615 6.2611 6.2611 6.3296 6.3296 6.6220 6.6220 7.8236 7.8236 8.9497 8.9497 k = 0.3269 0.0812-0.0916 ( 6314 PWs) bands (ev): -20.3856 -20.3856 -20.3272 -20.3272 -19.0569 -19.0569 -19.0148 -19.0148 -18.0508 -18.0508 -18.0311 -18.0311 -12.8279 -12.8279 -9.6895 -9.6895 -8.3696 -8.3696 -8.2815 -8.2815 -8.2351 -8.2351 -8.0009 -8.0009 -7.7976 -7.7976 -7.7440 -7.7440 -7.5630 -7.5630 -5.3718 -5.3718 -5.1578 -5.1578 -4.5294 -4.5294 -4.3515 -4.3515 -4.2126 -4.2126 -4.1252 -4.1252 -1.4531 -1.4531 -1.0220 -1.0220 -0.6856 -0.6856 -0.6188 -0.6188 -0.4770 -0.4770 -0.2164 -0.2164 -0.1126 -0.1126 0.5794 0.5794 3.6703 3.6703 6.2618 6.2618 6.3365 6.3365 6.6447 6.6447 7.7476 7.7476 8.9597 8.9597 k = 0.3462 0.0860-0.0970 ( 6311 PWs) bands (ev): -20.3822 -20.3822 -20.3295 -20.3295 -19.0590 -19.0590 -19.0173 -19.0173 -18.0491 -18.0491 -18.0290 -18.0290 -12.8276 -12.8276 -9.6899 -9.6899 -8.3790 -8.3790 -8.2827 -8.2827 -8.2345 -8.2345 -7.9983 -7.9983 -7.7913 -7.7913 -7.7442 -7.7442 -7.5637 -7.5637 -5.3662 -5.3662 -5.1536 -5.1536 -4.5245 -4.5245 -4.3611 -4.3611 -4.2137 -4.2137 -4.1256 -4.1256 -1.4577 -1.4577 -1.0222 -1.0222 -0.6939 -0.6939 -0.6231 -0.6231 -0.4750 -0.4750 -0.2134 -0.2134 -0.1061 -0.1061 0.5810 0.5810 3.6786 3.6786 6.2572 6.2572 6.3451 6.3451 6.6746 6.6746 7.6720 7.6720 8.9687 8.9687 k = 0.3654 0.0908-0.1024 ( 6306 PWs) bands (ev): -20.3787 -20.3787 -20.3319 -20.3319 -19.0609 -19.0609 -19.0195 -19.0195 -18.0475 -18.0475 -18.0271 -18.0271 -12.8273 -12.8273 -9.6902 -9.6902 -8.3876 -8.3876 -8.2837 -8.2837 -8.2340 -8.2340 -7.9959 -7.9959 -7.7852 -7.7852 -7.7441 -7.7441 -7.5651 -7.5651 -5.3608 -5.3608 -5.1500 -5.1500 -4.5196 -4.5196 -4.3703 -4.3703 -4.2150 -4.2150 -4.1259 -4.1259 -1.4620 -1.4620 -1.0224 -1.0224 -0.7014 -0.7014 -0.6268 -0.6268 -0.4732 -0.4732 -0.2107 -0.2107 -0.1003 -0.1003 0.5826 0.5826 3.6863 3.6863 6.2506 6.2506 6.3523 6.3523 6.7115 6.7115 7.5970 7.5970 8.9767 8.9767 k = 0.3846 0.0956-0.1077 ( 6310 PWs) bands (ev): -20.3753 -20.3753 -20.3343 -20.3343 -19.0626 -19.0626 -19.0216 -19.0216 -18.0461 -18.0461 -18.0253 -18.0253 -12.8270 -12.8270 -9.6905 -9.6905 -8.3953 -8.3953 -8.2846 -8.2846 -8.2335 -8.2335 -7.9938 -7.9938 -7.7795 -7.7795 -7.7438 -7.7438 -7.5668 -7.5668 -5.3557 -5.3557 -5.1469 -5.1469 -4.5148 -4.5148 -4.3789 -4.3789 -4.2162 -4.2162 -4.1261 -4.1261 -1.4659 -1.4659 -1.0225 -1.0225 -0.7080 -0.7080 -0.6299 -0.6299 -0.4715 -0.4715 -0.2084 -0.2084 -0.0953 -0.0953 0.5840 0.5840 3.6932 3.6932 6.2437 6.2437 6.3575 6.3575 6.7545 6.7545 7.5228 7.5228 8.9835 8.9835 k = 0.4038 0.1003-0.1131 ( 6319 PWs) bands (ev): -20.3719 -20.3719 -20.3369 -20.3369 -19.0641 -19.0641 -19.0234 -19.0234 -18.0449 -18.0449 -18.0238 -18.0238 -12.8268 -12.8268 -9.6907 -9.6907 -8.4021 -8.4021 -8.2854 -8.2854 -8.2331 -8.2331 -7.9920 -7.9920 -7.7745 -7.7745 -7.7431 -7.7431 -7.5689 -7.5689 -5.3510 -5.3510 -5.1444 -5.1444 -4.5102 -4.5102 -4.3868 -4.3868 -4.2173 -4.2173 -4.1263 -4.1263 -1.4693 -1.4693 -1.0226 -1.0226 -0.7137 -0.7137 -0.6326 -0.6326 -0.4701 -0.4701 -0.2065 -0.2065 -0.0910 -0.0910 0.5853 0.5853 3.6993 3.6993 6.2372 6.2372 6.3608 6.3608 6.8026 6.8026 7.4495 7.4495 8.9893 8.9893 k = 0.4231 0.1051-0.1185 ( 6319 PWs) bands (ev): -20.3686 -20.3686 -20.3396 -20.3396 -19.0653 -19.0653 -19.0250 -19.0250 -18.0439 -18.0439 -18.0226 -18.0226 -12.8267 -12.8267 -9.6909 -9.6909 -8.4077 -8.4077 -8.2860 -8.2860 -8.2327 -8.2327 -7.9905 -7.9905 -7.7704 -7.7704 -7.7420 -7.7420 -7.5709 -7.5709 -5.3469 -5.3469 -5.1424 -5.1424 -4.5060 -4.5060 -4.3938 -4.3938 -4.2184 -4.2184 -4.1264 -4.1264 -1.4721 -1.4721 -1.0227 -1.0227 -0.7185 -0.7185 -0.6348 -0.6348 -0.4688 -0.4688 -0.2049 -0.2049 -0.0876 -0.0876 0.5863 0.5863 3.7044 3.7044 6.2315 6.2315 6.3627 6.3627 6.8550 6.8550 7.3775 7.3775 8.9939 8.9939 k = 0.4423 0.1099-0.1239 ( 6321 PWs) bands (ev): -20.3654 -20.3654 -20.3422 -20.3422 -19.0663 -19.0663 -19.0262 -19.0262 -18.0430 -18.0430 -18.0216 -18.0216 -12.8265 -12.8265 -9.6911 -9.6911 -8.4122 -8.4122 -8.2865 -8.2865 -8.2324 -8.2324 -7.9893 -7.9893 -7.7674 -7.7674 -7.7407 -7.7407 -7.5728 -7.5728 -5.3436 -5.3436 -5.1409 -5.1409 -4.5023 -4.5023 -4.3997 -4.3997 -4.2192 -4.2192 -4.1265 -4.1265 -1.4744 -1.4744 -1.0228 -1.0228 -0.7222 -0.7222 -0.6364 -0.6364 -0.4679 -0.4679 -0.2036 -0.2036 -0.0849 -0.0849 0.5872 0.5872 3.7085 3.7085 6.2268 6.2268 6.3637 6.3637 6.9109 6.9109 7.3069 7.3069 8.9975 8.9975 k = 0.4615 0.1147-0.1293 ( 6322 PWs) bands (ev): -20.3625 -20.3625 -20.3447 -20.3447 -19.0670 -19.0670 -19.0270 -19.0270 -18.0424 -18.0424 -18.0209 -18.0209 -12.8264 -12.8264 -9.6912 -9.6912 -8.4155 -8.4155 -8.2869 -8.2869 -8.2322 -8.2322 -7.9885 -7.9885 -7.7654 -7.7654 -7.7394 -7.7394 -7.5744 -7.5744 -5.3411 -5.3411 -5.1398 -5.1398 -4.4994 -4.4994 -4.4041 -4.4041 -4.2199 -4.2199 -4.1265 -4.1265 -1.4760 -1.4760 -1.0228 -1.0228 -0.7249 -0.7249 -0.6376 -0.6376 -0.4672 -0.4672 -0.2027 -0.2027 -0.0830 -0.0830 0.5879 0.5879 3.7114 3.7114 6.2234 6.2234 6.3642 6.3642 6.9692 6.9692 7.2383 7.2383 9.0001 9.0001 k = 0.4808 0.1195-0.1347 ( 6321 PWs) bands (ev): -20.3602 -20.3602 -20.3468 -20.3468 -19.0674 -19.0674 -19.0276 -19.0276 -18.0421 -18.0421 -18.0204 -18.0204 -12.8263 -12.8263 -9.6912 -9.6912 -8.4175 -8.4175 -8.2871 -8.2871 -8.2321 -8.2321 -7.9879 -7.9879 -7.7643 -7.7643 -7.7384 -7.7384 -7.5754 -7.5754 -5.3396 -5.3396 -5.1392 -5.1392 -4.4976 -4.4976 -4.4070 -4.4070 -4.2203 -4.2203 -4.1265 -4.1265 -1.4770 -1.4770 -1.0229 -1.0229 -0.7265 -0.7265 -0.6384 -0.6384 -0.4667 -0.4667 -0.2022 -0.2022 -0.0819 -0.0819 0.5883 0.5883 3.7132 3.7132 6.2213 6.2213 6.3644 6.3644 7.0279 7.0279 7.1735 7.1735 9.0016 9.0016 k = 0.5000 0.1242-0.1401 ( 6320 PWs) bands (ev): -20.3592 -20.3592 -20.3476 -20.3476 -19.0675 -19.0675 -19.0277 -19.0277 -18.0420 -18.0420 -18.0203 -18.0203 -12.8263 -12.8263 -9.6913 -9.6913 -8.4181 -8.4181 -8.2872 -8.2872 -8.2320 -8.2320 -7.9878 -7.9878 -7.7639 -7.7639 -7.7380 -7.7380 -7.5758 -7.5758 -5.3391 -5.3391 -5.1390 -5.1390 -4.4969 -4.4969 -4.4079 -4.4079 -4.2204 -4.2204 -4.1265 -4.1265 -1.4773 -1.4773 -1.0229 -1.0229 -0.7270 -0.7270 -0.6386 -0.6386 -0.4666 -0.4666 -0.2020 -0.2020 -0.0815 -0.0815 0.5884 0.5884 3.7138 3.7138 6.2206 6.2206 6.3645 6.3645 7.0680 7.0680 7.1314 7.1314 9.0021 9.0021 k = 0.5000 0.1242 0.7059 ( 6314 PWs) bands (ev): -20.3374 -20.3374 -20.3142 -20.3142 -19.0283 -19.0283 -19.0039 -19.0039 -18.0499 -18.0499 -18.0457 -18.0457 -12.7855 -12.7855 -9.8695 -9.8695 -8.4160 -8.4160 -8.3429 -8.3429 -8.2218 -8.2218 -8.0631 -8.0631 -7.9819 -7.9819 -7.7353 -7.7353 -7.5752 -7.5752 -5.2174 -5.2174 -5.1612 -5.1612 -4.8125 -4.8125 -4.5459 -4.5459 -4.2930 -4.2930 -4.2120 -4.2120 -1.3865 -1.3865 -0.8839 -0.8839 -0.7462 -0.7462 -0.6234 -0.6234 -0.4896 -0.4896 -0.2837 -0.2837 -0.0821 -0.0821 0.5819 0.5819 4.3992 4.3992 6.4575 6.4575 6.5231 6.5231 7.9239 7.9239 8.5445 8.5445 8.9236 8.9236 k = 0.4881 0.1213 0.6891 ( 6315 PWs) bands (ev): -20.3375 -20.3375 -20.3142 -20.3142 -19.0283 -19.0283 -19.0039 -19.0039 -18.0500 -18.0500 -18.0457 -18.0457 -12.7856 -12.7856 -9.8691 -9.8691 -8.4162 -8.4162 -8.3436 -8.3436 -8.2226 -8.2226 -8.0638 -8.0638 -7.9790 -7.9790 -7.7353 -7.7353 -7.5754 -7.5754 -5.2184 -5.2184 -5.1608 -5.1608 -4.8119 -4.8119 -4.5455 -4.5455 -4.2931 -4.2931 -4.2119 -4.2119 -1.3864 -1.3864 -0.8840 -0.8840 -0.7462 -0.7462 -0.6233 -0.6233 -0.4898 -0.4898 -0.2834 -0.2834 -0.0823 -0.0823 0.5819 0.5819 4.3981 4.3981 6.4569 6.4569 6.5235 6.5235 7.9182 7.9182 8.5401 8.5401 8.9320 8.9320 k = 0.4762 0.1183 0.6723 ( 6314 PWs) bands (ev): -20.3379 -20.3379 -20.3142 -20.3142 -19.0281 -19.0281 -19.0040 -19.0040 -18.0500 -18.0500 -18.0458 -18.0458 -12.7858 -12.7858 -9.8678 -9.8678 -8.4168 -8.4168 -8.3457 -8.3457 -8.2248 -8.2248 -8.0654 -8.0654 -7.9706 -7.9706 -7.7352 -7.7352 -7.5760 -7.5760 -5.2214 -5.2214 -5.1595 -5.1595 -4.8100 -4.8100 -4.5442 -4.5442 -4.2935 -4.2935 -4.2115 -4.2115 -1.3861 -1.3861 -0.8843 -0.8843 -0.7464 -0.7464 -0.6229 -0.6229 -0.4905 -0.4905 -0.2825 -0.2825 -0.0827 -0.0827 0.5817 0.5817 4.3948 4.3948 6.4551 6.4551 6.5246 6.5246 7.9015 7.9015 8.5283 8.5283 8.9554 8.9554 k = 0.4643 0.1154 0.6555 ( 6310 PWs) bands (ev): -20.3385 -20.3385 -20.3142 -20.3142 -19.0277 -19.0277 -19.0042 -19.0042 -18.0501 -18.0501 -18.0460 -18.0460 -12.7861 -12.7861 -9.8656 -9.8656 -8.4181 -8.4181 -8.3487 -8.3487 -8.2280 -8.2280 -8.0676 -8.0676 -7.9579 -7.9579 -7.7352 -7.7352 -7.5770 -7.5770 -5.2261 -5.2261 -5.1577 -5.1577 -4.8067 -4.8067 -4.5420 -4.5420 -4.2942 -4.2942 -4.2107 -4.2107 -1.3856 -1.3856 -0.8848 -0.8848 -0.7466 -0.7466 -0.6223 -0.6223 -0.4917 -0.4917 -0.2810 -0.2810 -0.0834 -0.0834 0.5816 0.5816 4.3893 4.3893 6.4521 6.4521 6.5264 6.5264 7.8742 7.8742 8.5125 8.5125 8.9895 8.9895 k = 0.4524 0.1124 0.6387 ( 6307 PWs) bands (ev): -20.3393 -20.3393 -20.3141 -20.3141 -19.0272 -19.0272 -19.0044 -19.0044 -18.0502 -18.0502 -18.0463 -18.0463 -12.7865 -12.7865 -9.8625 -9.8625 -8.4203 -8.4203 -8.3525 -8.3525 -8.2315 -8.2315 -8.0698 -8.0698 -7.9421 -7.9421 -7.7352 -7.7352 -7.5783 -7.5783 -5.2322 -5.2322 -5.1557 -5.1557 -4.8022 -4.8022 -4.5390 -4.5390 -4.2952 -4.2952 -4.2096 -4.2096 -1.3850 -1.3850 -0.8854 -0.8854 -0.7470 -0.7470 -0.6214 -0.6214 -0.4933 -0.4933 -0.2789 -0.2789 -0.0845 -0.0845 0.5813 0.5813 4.3816 4.3816 6.4482 6.4482 6.5287 6.5287 7.8376 7.8376 8.4958 8.4958 9.0296 9.0296 k = 0.4405 0.1094 0.6219 ( 6303 PWs) bands (ev): -20.3404 -20.3404 -20.3140 -20.3140 -19.0266 -19.0266 -19.0047 -19.0047 -18.0504 -18.0504 -18.0466 -18.0466 -12.7871 -12.7871 -9.8587 -9.8587 -8.4240 -8.4240 -8.3563 -8.3563 -8.2348 -8.2348 -8.0720 -8.0720 -7.9240 -7.9240 -7.7352 -7.7352 -7.5799 -7.5799 -5.2394 -5.2394 -5.1535 -5.1535 -4.7964 -4.7964 -4.5352 -4.5352 -4.2966 -4.2966 -4.2082 -4.2082 -1.3842 -1.3842 -0.8862 -0.8862 -0.7473 -0.7473 -0.6203 -0.6203 -0.4953 -0.4953 -0.2764 -0.2764 -0.0858 -0.0858 0.5810 0.5810 4.3717 4.3717 6.4435 6.4435 6.5314 6.5314 7.7929 7.7929 8.4802 8.4802 9.0720 9.0720 k = 0.4286 0.1065 0.6051 ( 6299 PWs) bands (ev): -20.3417 -20.3417 -20.3139 -20.3139 -19.0259 -19.0259 -19.0050 -19.0050 -18.0506 -18.0506 -18.0470 -18.0470 -12.7877 -12.7877 -9.8540 -9.8540 -8.4293 -8.4293 -8.3593 -8.3593 -8.2376 -8.2376 -8.0740 -8.0740 -7.9045 -7.9045 -7.7351 -7.7351 -7.5817 -7.5817 -5.2476 -5.2476 -5.1515 -5.1515 -4.7894 -4.7894 -4.5306 -4.5306 -4.2985 -4.2985 -4.2063 -4.2063 -1.3833 -1.3833 -0.8871 -0.8871 -0.7477 -0.7477 -0.6189 -0.6189 -0.4977 -0.4977 -0.2735 -0.2735 -0.0873 -0.0873 0.5806 0.5806 4.3597 4.3597 6.4379 6.4379 6.5343 6.5343 7.7417 7.7417 8.4666 8.4666 9.1138 9.1138 k = 0.4167 0.1035 0.5883 ( 6305 PWs) bands (ev): -20.3432 -20.3432 -20.3139 -20.3139 -19.0251 -19.0251 -19.0054 -19.0054 -18.0508 -18.0508 -18.0474 -18.0474 -12.7885 -12.7885 -9.8487 -9.8487 -8.4366 -8.4366 -8.3612 -8.3612 -8.2398 -8.2398 -8.0759 -8.0759 -7.8841 -7.8841 -7.7351 -7.7351 -7.5838 -7.5838 -5.2565 -5.2565 -5.1497 -5.1497 -4.7811 -4.7811 -4.5252 -4.5252 -4.3009 -4.3009 -4.2039 -4.2039 -1.3824 -1.3824 -0.8882 -0.8882 -0.7481 -0.7481 -0.6172 -0.6172 -0.5004 -0.5004 -0.2703 -0.2703 -0.0891 -0.0891 0.5802 0.5802 4.3456 4.3456 6.4317 6.4317 6.5374 6.5374 7.6854 7.6854 8.4553 8.4553 9.1531 9.1531 k = 0.4048 0.1006 0.5714 ( 6304 PWs) bands (ev): -20.3449 -20.3449 -20.3138 -20.3138 -19.0241 -19.0241 -19.0058 -19.0058 -18.0511 -18.0511 -18.0479 -18.0479 -12.7894 -12.7894 -9.8426 -9.8426 -8.4456 -8.4456 -8.3617 -8.3617 -8.2412 -8.2412 -8.0777 -8.0777 -7.8634 -7.8634 -7.7351 -7.7351 -7.5859 -7.5859 -5.2660 -5.2660 -5.1482 -5.1482 -4.7717 -4.7717 -4.5191 -4.5191 -4.3038 -4.3038 -4.2011 -4.2011 -1.3814 -1.3814 -0.8893 -0.8893 -0.7484 -0.7484 -0.6152 -0.6152 -0.5033 -0.5033 -0.2669 -0.2669 -0.0912 -0.0912 0.5797 0.5797 4.3295 4.3295 6.4249 6.4249 6.5405 6.5405 7.6253 7.6253 8.4465 8.4465 9.1888 9.1888 k = 0.3929 0.0976 0.5546 ( 6301 PWs) bands (ev): -20.3467 -20.3467 -20.3136 -20.3136 -19.0230 -19.0230 -19.0063 -19.0063 -18.0515 -18.0515 -18.0485 -18.0485 -12.7904 -12.7904 -9.8360 -9.8360 -8.4558 -8.4558 -8.3608 -8.3608 -8.2420 -8.2420 -8.0793 -8.0793 -7.8427 -7.8427 -7.7351 -7.7351 -7.5880 -7.5880 -5.2761 -5.2761 -5.1470 -5.1470 -4.7611 -4.7611 -4.5123 -4.5123 -4.3074 -4.3074 -4.1977 -4.1977 -1.3804 -1.3804 -0.8904 -0.8904 -0.7486 -0.7486 -0.6130 -0.6130 -0.5066 -0.5066 -0.2633 -0.2633 -0.0935 -0.0935 0.5793 0.5793 4.3115 4.3115 6.4176 6.4176 6.5437 6.5437 7.5625 7.5625 8.4399 8.4399 9.2200 9.2200 k = 0.3810 0.0947 0.5378 ( 6301 PWs) bands (ev): -20.3488 -20.3488 -20.3135 -20.3135 -19.0218 -19.0218 -19.0068 -19.0068 -18.0519 -18.0519 -18.0490 -18.0490 -12.7915 -12.7915 -9.8288 -9.8288 -8.4666 -8.4666 -8.3589 -8.3589 -8.2421 -8.2421 -8.0810 -8.0810 -7.8226 -7.8226 -7.7351 -7.7351 -7.5899 -7.5899 -5.2866 -5.2866 -5.1461 -5.1461 -4.7494 -4.7494 -4.5049 -4.5049 -4.3115 -4.3115 -4.1939 -4.1939 -1.3793 -1.3793 -0.8916 -0.8916 -0.7487 -0.7487 -0.6105 -0.6105 -0.5100 -0.5100 -0.2597 -0.2597 -0.0961 -0.0961 0.5787 0.5787 4.2916 4.2916 6.4097 6.4097 6.5468 6.5468 7.4981 7.4981 8.4355 8.4355 9.2453 9.2453 k = 0.3690 0.0917 0.5210 ( 6306 PWs) bands (ev): -20.3510 -20.3510 -20.3134 -20.3134 -19.0205 -19.0205 -19.0074 -19.0074 -18.0523 -18.0523 -18.0497 -18.0497 -12.7927 -12.7927 -9.8212 -9.8212 -8.4775 -8.4775 -8.3561 -8.3561 -8.2418 -8.2418 -8.0825 -8.0825 -7.8035 -7.8035 -7.7351 -7.7351 -7.5916 -7.5916 -5.2973 -5.2973 -5.1456 -5.1456 -4.7367 -4.7367 -4.4969 -4.4969 -4.3163 -4.3163 -4.1897 -4.1897 -1.3784 -1.3784 -0.8929 -0.8929 -0.7485 -0.7485 -0.6078 -0.6078 -0.5135 -0.5135 -0.2561 -0.2561 -0.0989 -0.0989 0.5782 0.5782 4.2699 4.2699 6.4014 6.4014 6.5497 6.5497 7.4327 7.4327 8.4332 8.4332 9.2618 9.2618 k = 0.3571 0.0887 0.5042 ( 6304 PWs) bands (ev): -20.3534 -20.3534 -20.3132 -20.3132 -19.0192 -19.0192 -19.0080 -19.0080 -18.0528 -18.0528 -18.0503 -18.0503 -12.7940 -12.7940 -9.8131 -9.8131 -8.4881 -8.4881 -8.3526 -8.3526 -8.2410 -8.2410 -8.0840 -8.0840 -7.7856 -7.7856 -7.7351 -7.7351 -7.5926 -7.5926 -5.3083 -5.3083 -5.1455 -5.1455 -4.7229 -4.7229 -4.4885 -4.4885 -4.3216 -4.3216 -4.1850 -4.1850 -1.3775 -1.3775 -0.8942 -0.8942 -0.7479 -0.7479 -0.6048 -0.6048 -0.5172 -0.5172 -0.2527 -0.2527 -0.1019 -0.1019 0.5777 0.5777 4.2466 4.2466 6.3925 6.3925 6.5526 6.5526 7.3672 7.3672 8.4327 8.4327 9.2650 9.2650 k = 0.3452 0.0858 0.4874 ( 6307 PWs) bands (ev): -20.3559 -20.3559 -20.3131 -20.3131 -19.0177 -19.0177 -19.0087 -19.0087 -18.0534 -18.0534 -18.0509 -18.0509 -12.7953 -12.7953 -9.8048 -9.8048 -8.4980 -8.4980 -8.3487 -8.3487 -8.2397 -8.2397 -8.0855 -8.0855 -7.7696 -7.7696 -7.7351 -7.7351 -7.5929 -7.5929 -5.3193 -5.3193 -5.1457 -5.1457 -4.7081 -4.7081 -4.4796 -4.4796 -4.3275 -4.3275 -4.1800 -4.1800 -1.3768 -1.3768 -0.8956 -0.8956 -0.7470 -0.7470 -0.6016 -0.6016 -0.5209 -0.5209 -0.2494 -0.2494 -0.1051 -0.1051 0.5772 0.5772 4.2216 4.2216 6.3832 6.3832 6.5552 6.5552 7.3021 7.3021 8.4341 8.4341 9.2545 9.2545 k = 0.3333 0.0828 0.4706 ( 6303 PWs) bands (ev): -20.3586 -20.3586 -20.3130 -20.3130 -19.0162 -19.0162 -19.0094 -19.0094 -18.0540 -18.0540 -18.0516 -18.0516 -12.7968 -12.7968 -9.7963 -9.7963 -8.5069 -8.5069 -8.3443 -8.3443 -8.2381 -8.2381 -8.0868 -8.0868 -7.7559 -7.7559 -7.7348 -7.7348 -7.5922 -7.5922 -5.3304 -5.3304 -5.1463 -5.1463 -4.6925 -4.6925 -4.4704 -4.4704 -4.3338 -4.3338 -4.1747 -4.1747 -1.3762 -1.3762 -0.8971 -0.8971 -0.7456 -0.7456 -0.5982 -0.5982 -0.5245 -0.5245 -0.2463 -0.2463 -0.1086 -0.1086 0.5766 0.5766 4.1953 4.1953 6.3734 6.3734 6.5577 6.5577 7.2378 7.2378 8.4371 8.4371 9.2358 9.2358 k = 0.3214 0.0799 0.4538 ( 6307 PWs) bands (ev): -20.3613 -20.3613 -20.3128 -20.3128 -19.0147 -19.0147 -19.0100 -19.0100 -18.0548 -18.0548 -18.0522 -18.0522 -12.7983 -12.7983 -9.7877 -9.7877 -8.5146 -8.5146 -8.3398 -8.3398 -8.2362 -8.2362 -8.0880 -8.0880 -7.7454 -7.7454 -7.7338 -7.7338 -7.5903 -7.5903 -5.3413 -5.3413 -5.1472 -5.1472 -4.6760 -4.6760 -4.4611 -4.4611 -4.3405 -4.3405 -4.1691 -4.1691 -1.3757 -1.3757 -0.8988 -0.8988 -0.7437 -0.7437 -0.5947 -0.5947 -0.5280 -0.5280 -0.2435 -0.2435 -0.1123 -0.1123 0.5761 0.5761 4.1677 4.1677 6.3630 6.3630 6.5600 6.5600 7.1748 7.1748 8.4417 8.4417 9.2136 9.2136 k = 0.3095 0.0769 0.4370 ( 6303 PWs) bands (ev): -20.3642 -20.3642 -20.3126 -20.3126 -19.0132 -19.0132 -19.0106 -19.0106 -18.0556 -18.0556 -18.0528 -18.0528 -12.7998 -12.7998 -9.7791 -9.7791 -8.5209 -8.5209 -8.3350 -8.3350 -8.2340 -8.2340 -8.0891 -8.0891 -7.7402 -7.7402 -7.7302 -7.7302 -7.5870 -7.5870 -5.3520 -5.3520 -5.1484 -5.1484 -4.6587 -4.6587 -4.4518 -4.4518 -4.3473 -4.3473 -4.1634 -4.1634 -1.3754 -1.3754 -0.9007 -0.9007 -0.7411 -0.7411 -0.5911 -0.5911 -0.5314 -0.5314 -0.2410 -0.2410 -0.1163 -0.1163 0.5756 0.5756 4.1389 4.1389 6.3521 6.3521 6.5620 6.5620 7.1135 7.1135 8.4477 8.4477 9.1903 9.1903 k = 0.2976 0.0740 0.4202 ( 6305 PWs) bands (ev): -20.3671 -20.3671 -20.3125 -20.3125 -19.0124 -19.0124 -19.0105 -19.0105 -18.0565 -18.0565 -18.0534 -18.0534 -12.8015 -12.8015 -9.7705 -9.7705 -8.5256 -8.5256 -8.3303 -8.3303 -8.2315 -8.2315 -8.0900 -8.0900 -7.7391 -7.7391 -7.7251 -7.7251 -7.5826 -7.5826 -5.3624 -5.3624 -5.1500 -5.1500 -4.6408 -4.6408 -4.4428 -4.4428 -4.3540 -4.3540 -4.1575 -4.1575 -1.3753 -1.3753 -0.9030 -0.9030 -0.7379 -0.7379 -0.5873 -0.5873 -0.5345 -0.5345 -0.2388 -0.2388 -0.1205 -0.1205 0.5751 0.5751 4.1092 4.1092 6.3406 6.3406 6.5639 6.5639 7.0542 7.0542 8.4551 8.4551 9.1666 9.1666 k = 0.2857 0.0710 0.4034 ( 6303 PWs) bands (ev): -20.3701 -20.3701 -20.3123 -20.3123 -19.0128 -19.0128 -19.0091 -19.0091 -18.0574 -18.0574 -18.0539 -18.0539 -12.8031 -12.8031 -9.7621 -9.7621 -8.5287 -8.5287 -8.3255 -8.3255 -8.2288 -8.2288 -8.0906 -8.0906 -7.7392 -7.7392 -7.7213 -7.7213 -7.5772 -7.5772 -5.3724 -5.3724 -5.1520 -5.1520 -4.6222 -4.6222 -4.4346 -4.4346 -4.3601 -4.3601 -4.1515 -4.1515 -1.3753 -1.3753 -0.9056 -0.9056 -0.7340 -0.7340 -0.5835 -0.5835 -0.5373 -0.5373 -0.2369 -0.2369 -0.1250 -0.1250 0.5745 0.5745 4.0787 4.0787 6.3284 6.3284 6.5655 6.5655 6.9972 6.9972 8.4637 8.4637 9.1432 9.1432 k = 0.2738 0.0680 0.3866 ( 6302 PWs) bands (ev): -20.3731 -20.3731 -20.3122 -20.3122 -19.0135 -19.0135 -19.0074 -19.0074 -18.0583 -18.0583 -18.0545 -18.0545 -12.8048 -12.8048 -9.7540 -9.7540 -8.5301 -8.5301 -8.3209 -8.3209 -8.2258 -8.2258 -8.0910 -8.0910 -7.7399 -7.7399 -7.7191 -7.7191 -7.5714 -7.5714 -5.3818 -5.3818 -5.1542 -5.1542 -4.6032 -4.6032 -4.4280 -4.4280 -4.3648 -4.3648 -4.1456 -4.1456 -1.3755 -1.3755 -0.9086 -0.9086 -0.7293 -0.7293 -0.5797 -0.5797 -0.5396 -0.5396 -0.2354 -0.2354 -0.1298 -0.1298 0.5740 0.5740 4.0475 4.0475 6.3154 6.3154 6.5669 6.5669 6.9430 6.9430 8.4733 8.4733 9.1202 9.1202 k = 0.2619 0.0651 0.3698 ( 6307 PWs) bands (ev): -20.3761 -20.3761 -20.3120 -20.3120 -19.0142 -19.0142 -19.0057 -19.0057 -18.0593 -18.0593 -18.0551 -18.0551 -12.8065 -12.8065 -9.7461 -9.7461 -8.5296 -8.5296 -8.3165 -8.3165 -8.2227 -8.2227 -8.0911 -8.0911 -7.7410 -7.7410 -7.7184 -7.7184 -7.5655 -7.5655 -5.3907 -5.3907 -5.1568 -5.1568 -4.5837 -4.5837 -4.4243 -4.4243 -4.3668 -4.3668 -4.1397 -4.1397 -1.3758 -1.3758 -0.9120 -0.9120 -0.7238 -0.7238 -0.5760 -0.5760 -0.5414 -0.5414 -0.2342 -0.2342 -0.1350 -0.1350 0.5735 0.5735 4.0160 4.0160 6.3016 6.3016 6.5682 6.5682 6.8917 6.8917 8.4839 8.4839 9.0978 9.0978 k = 0.2500 0.0621 0.3530 ( 6306 PWs) bands (ev): -20.3792 -20.3792 -20.3118 -20.3118 -19.0150 -19.0150 -19.0039 -19.0039 -18.0603 -18.0603 -18.0557 -18.0557 -12.8083 -12.8083 -9.7387 -9.7387 -8.5273 -8.5273 -8.3124 -8.3124 -8.2194 -8.2194 -8.0908 -8.0908 -7.7424 -7.7424 -7.7186 -7.7186 -7.5600 -7.5600 -5.3988 -5.3988 -5.1597 -5.1597 -4.5641 -4.5641 -4.4243 -4.4243 -4.3652 -4.3652 -4.1340 -4.1340 -1.3763 -1.3763 -0.9160 -0.9160 -0.7176 -0.7176 -0.5723 -0.5723 -0.5426 -0.5426 -0.2334 -0.2334 -0.1405 -0.1405 0.5729 0.5729 3.9842 3.9842 6.2868 6.2868 6.5691 6.5691 6.8436 6.8436 8.4952 8.4952 9.0759 9.0759 k = 0.2381 0.0592 0.3361 ( 6310 PWs) bands (ev): -20.3822 -20.3822 -20.3117 -20.3117 -19.0158 -19.0158 -19.0021 -19.0021 -18.0613 -18.0613 -18.0562 -18.0562 -12.8100 -12.8100 -9.7317 -9.7317 -8.5231 -8.5231 -8.3085 -8.3085 -8.2161 -8.2161 -8.0902 -8.0902 -7.7443 -7.7443 -7.7195 -7.7195 -7.5552 -7.5552 -5.4062 -5.4062 -5.1629 -5.1629 -4.5445 -4.5445 -4.4277 -4.4277 -4.3601 -4.3601 -4.1284 -4.1284 -1.3768 -1.3768 -0.9204 -0.9204 -0.7108 -0.7108 -0.5687 -0.5687 -0.5432 -0.5432 -0.2329 -0.2329 -0.1463 -0.1463 0.5724 0.5724 3.9523 3.9523 6.2711 6.2711 6.5698 6.5698 6.7991 6.7991 8.5071 8.5071 9.0546 9.0546 k = 0.2262 0.0562 0.3193 ( 6307 PWs) bands (ev): -20.3853 -20.3853 -20.3115 -20.3115 -19.0166 -19.0166 -19.0003 -19.0003 -18.0624 -18.0624 -18.0568 -18.0568 -12.8117 -12.8117 -9.7251 -9.7251 -8.5170 -8.5170 -8.3051 -8.3051 -8.2127 -8.2127 -8.0892 -8.0892 -7.7466 -7.7466 -7.7207 -7.7207 -7.5515 -7.5515 -5.4128 -5.4128 -5.1664 -5.1664 -4.5253 -4.5253 -4.4329 -4.4329 -4.3526 -4.3526 -4.1231 -4.1231 -1.3774 -1.3774 -0.9254 -0.9254 -0.7032 -0.7032 -0.5652 -0.5652 -0.5430 -0.5430 -0.2326 -0.2326 -0.1526 -0.1526 0.5718 0.5718 3.9205 3.9205 6.2544 6.2544 6.5700 6.5700 6.7585 6.7585 8.5195 8.5195 9.0338 9.0338 k = 0.2143 0.0532 0.3025 ( 6307 PWs) bands (ev): -20.3882 -20.3882 -20.3114 -20.3114 -19.0174 -19.0174 -18.9985 -18.9985 -18.0634 -18.0634 -18.0574 -18.0574 -12.8135 -12.8135 -9.7191 -9.7191 -8.5091 -8.5091 -8.3019 -8.3019 -8.2093 -8.2093 -8.0877 -8.0877 -7.7493 -7.7493 -7.7220 -7.7220 -7.5490 -7.5490 -5.4184 -5.4184 -5.1702 -5.1702 -4.5077 -4.5077 -4.4380 -4.4380 -4.3440 -4.3440 -4.1181 -4.1181 -1.3782 -1.3782 -0.9308 -0.9308 -0.6951 -0.6951 -0.5618 -0.5618 -0.5422 -0.5422 -0.2327 -0.2327 -0.1592 -0.1592 0.5712 0.5712 3.8891 3.8891 6.2367 6.2367 6.5696 6.5696 6.7221 6.7221 8.5323 8.5323 9.0135 9.0135 k = 0.2024 0.0503 0.2857 ( 6306 PWs) bands (ev): -20.3911 -20.3911 -20.3112 -20.3112 -19.0182 -19.0182 -18.9968 -18.9968 -18.0644 -18.0644 -18.0580 -18.0580 -12.8152 -12.8152 -9.7136 -9.7136 -8.4995 -8.4995 -8.2992 -8.2992 -8.2060 -8.2060 -8.0858 -8.0858 -7.7526 -7.7526 -7.7233 -7.7233 -7.5478 -7.5478 -5.4232 -5.4232 -5.1742 -5.1742 -4.4939 -4.4939 -4.4400 -4.4400 -4.3347 -4.3347 -4.1134 -4.1134 -1.3789 -1.3789 -0.9366 -0.9366 -0.6866 -0.6866 -0.5584 -0.5584 -0.5407 -0.5407 -0.2332 -0.2332 -0.1662 -0.1662 0.5706 0.5706 3.8582 3.8582 6.2180 6.2180 6.5681 6.5681 6.6905 6.6905 8.5452 8.5452 8.9937 8.9937 k = 0.1905 0.0473 0.2689 ( 6304 PWs) bands (ev): -20.3940 -20.3940 -20.3111 -20.3111 -19.0189 -19.0189 -18.9951 -18.9951 -18.0653 -18.0653 -18.0585 -18.0585 -12.8168 -12.8168 -9.7086 -9.7086 -8.4882 -8.4882 -8.2968 -8.2968 -8.2030 -8.2030 -8.0834 -8.0834 -7.7563 -7.7563 -7.7244 -7.7244 -7.5480 -7.5480 -5.4271 -5.4271 -5.1785 -5.1785 -4.4881 -4.4881 -4.4345 -4.4345 -4.3252 -4.3252 -4.1092 -4.1092 -1.3797 -1.3797 -0.9427 -0.9427 -0.6777 -0.6777 -0.5548 -0.5548 -0.5387 -0.5387 -0.2339 -0.2339 -0.1736 -0.1736 0.5699 0.5699 3.8280 3.8280 6.1985 6.1985 6.5648 6.5648 6.6642 6.6642 8.5582 8.5582 8.9744 8.9744 k = 0.1786 0.0444 0.2521 ( 6306 PWs) bands (ev): -20.3967 -20.3967 -20.3109 -20.3109 -19.0196 -19.0196 -18.9934 -18.9934 -18.0663 -18.0663 -18.0591 -18.0591 -12.8185 -12.8185 -9.7042 -9.7042 -8.4754 -8.4754 -8.2948 -8.2948 -8.2001 -8.2001 -8.0807 -8.0807 -7.7604 -7.7604 -7.7254 -7.7254 -7.5496 -7.5496 -5.4300 -5.4300 -5.1831 -5.1831 -4.4905 -4.4905 -4.4211 -4.4211 -4.3158 -4.3158 -4.1055 -4.1055 -1.3805 -1.3805 -0.9492 -0.9492 -0.6686 -0.6686 -0.5508 -0.5508 -0.5363 -0.5363 -0.2352 -0.2352 -0.1812 -0.1812 0.5692 0.5692 3.7987 3.7987 6.1784 6.1784 6.5588 6.5588 6.6441 6.6441 8.5712 8.5712 8.9555 8.9555 k = 0.1667 0.0414 0.2353 ( 6304 PWs) bands (ev): -20.3994 -20.3994 -20.3108 -20.3108 -19.0203 -19.0203 -18.9918 -18.9918 -18.0672 -18.0672 -18.0596 -18.0596 -12.8200 -12.8200 -9.7003 -9.7003 -8.4611 -8.4611 -8.2932 -8.2932 -8.1976 -8.1976 -8.0775 -8.0775 -7.7648 -7.7648 -7.7263 -7.7263 -7.5526 -7.5526 -5.4320 -5.4320 -5.1878 -5.1878 -4.4971 -4.4971 -4.4037 -4.4037 -4.3065 -4.3065 -4.1023 -4.1023 -1.3813 -1.3813 -0.9559 -0.9559 -0.6594 -0.6594 -0.5462 -0.5462 -0.5337 -0.5337 -0.2369 -0.2369 -0.1889 -0.1889 0.5685 0.5685 3.7704 3.7704 6.1579 6.1579 6.5496 6.5496 6.6305 6.6305 8.5840 8.5840 8.9370 8.9370 k = 0.1548 0.0385 0.2185 ( 6305 PWs) bands (ev): -20.4019 -20.4019 -20.3106 -20.3106 -19.0210 -19.0210 -18.9903 -18.9903 -18.0681 -18.0681 -18.0601 -18.0601 -12.8215 -12.8215 -9.6968 -9.6968 -8.4456 -8.4456 -8.2918 -8.2918 -8.1954 -8.1954 -8.0740 -8.0740 -7.7695 -7.7695 -7.7270 -7.7270 -7.5568 -7.5568 -5.4332 -5.4332 -5.1928 -5.1928 -4.5053 -4.5053 -4.3849 -4.3849 -4.2976 -4.2976 -4.0997 -4.0997 -1.3821 -1.3821 -0.9627 -0.9627 -0.6502 -0.6502 -0.5410 -0.5410 -0.5310 -0.5310 -0.2395 -0.2395 -0.1965 -0.1965 0.5678 0.5678 3.7433 3.7433 6.1373 6.1373 6.5376 6.5376 6.6227 6.6227 8.5966 8.5966 8.9188 8.9188 k = 0.1429 0.0355 0.2017 ( 6309 PWs) bands (ev): -20.4043 -20.4043 -20.3105 -20.3105 -19.0216 -19.0216 -18.9889 -18.9889 -18.0690 -18.0690 -18.0606 -18.0606 -12.8230 -12.8230 -9.6939 -9.6939 -8.4291 -8.4291 -8.2907 -8.2907 -8.1937 -8.1937 -8.0702 -8.0702 -7.7744 -7.7744 -7.7276 -7.7276 -7.5622 -7.5622 -5.4335 -5.4335 -5.1979 -5.1979 -4.5139 -4.5139 -4.3657 -4.3657 -4.2890 -4.2890 -4.0978 -4.0978 -1.3829 -1.3829 -0.9695 -0.9695 -0.6413 -0.6413 -0.5351 -0.5351 -0.5282 -0.5282 -0.2431 -0.2431 -0.2035 -0.2035 0.5671 0.5671 3.7176 3.7176 6.1169 6.1169 6.5245 6.5245 6.6189 6.6189 8.6089 8.6089 8.9010 8.9010 k = 0.1310 0.0325 0.1849 ( 6312 PWs) bands (ev): -20.4066 -20.4066 -20.3104 -20.3104 -19.0222 -19.0222 -18.9875 -18.9875 -18.0698 -18.0698 -18.0611 -18.0611 -12.8243 -12.8243 -9.6913 -9.6913 -8.4116 -8.4116 -8.2899 -8.2899 -8.1924 -8.1924 -8.0662 -8.0662 -7.7794 -7.7794 -7.7281 -7.7281 -7.5686 -7.5686 -5.4331 -5.4331 -5.2031 -5.2031 -4.5227 -4.5227 -4.3466 -4.3466 -4.2809 -4.2809 -4.0965 -4.0965 -1.3837 -1.3837 -0.9762 -0.9762 -0.6328 -0.6328 -0.5286 -0.5286 -0.5253 -0.5253 -0.2483 -0.2483 -0.2096 -0.2096 0.5664 0.5664 3.6934 3.6934 6.0971 6.0971 6.5114 6.5114 6.6176 6.6176 8.6208 8.6208 8.8835 8.8835 k = 0.1190 0.0296 0.1681 ( 6312 PWs) bands (ev): -20.4087 -20.4087 -20.3103 -20.3103 -19.0228 -19.0228 -18.9862 -18.9862 -18.0705 -18.0705 -18.0615 -18.0615 -12.8256 -12.8256 -9.6892 -9.6892 -8.3935 -8.3935 -8.2892 -8.2892 -8.1916 -8.1916 -8.0622 -8.0622 -7.7846 -7.7846 -7.7284 -7.7284 -7.5757 -7.5757 -5.4320 -5.4320 -5.2083 -5.2083 -4.5311 -4.5311 -4.3279 -4.3279 -4.2733 -4.2733 -4.0960 -4.0960 -1.3844 -1.3844 -0.9827 -0.9827 -0.6247 -0.6247 -0.5239 -0.5239 -0.5196 -0.5196 -0.2552 -0.2552 -0.2144 -0.2144 0.5657 0.5657 3.6708 3.6708 6.0781 6.0781 6.4991 6.4991 6.6177 6.6177 8.6323 8.6323 8.8665 8.8665 k = 0.1071 0.0266 0.1513 ( 6308 PWs) bands (ev): -20.4106 -20.4106 -20.3102 -20.3102 -19.0233 -19.0233 -18.9850 -18.9850 -18.0712 -18.0712 -18.0619 -18.0619 -12.8268 -12.8268 -9.6874 -9.6874 -8.3750 -8.3750 -8.2888 -8.2888 -8.1914 -8.1914 -8.0581 -8.0581 -7.7898 -7.7898 -7.7287 -7.7287 -7.5834 -7.5834 -5.4303 -5.4303 -5.2135 -5.2135 -4.5392 -4.5392 -4.3098 -4.3098 -4.2662 -4.2662 -4.0961 -4.0961 -1.3850 -1.3850 -0.9890 -0.9890 -0.6173 -0.6173 -0.5214 -0.5214 -0.5111 -0.5111 -0.2639 -0.2639 -0.2179 -0.2179 0.5650 0.5650 3.6500 3.6500 6.0601 6.0601 6.4880 6.4880 6.6186 6.6186 8.6433 8.6433 8.8500 8.8500 k = 0.0952 0.0237 0.1345 ( 6315 PWs) bands (ev): -20.4123 -20.4123 -20.3101 -20.3101 -19.0238 -19.0238 -18.9839 -18.9839 -18.0718 -18.0718 -18.0623 -18.0623 -12.8279 -12.8279 -9.6859 -9.6859 -8.3564 -8.3564 -8.2884 -8.2884 -8.1918 -8.1918 -8.0541 -8.0541 -7.7951 -7.7951 -7.7288 -7.7288 -7.5913 -7.5913 -5.4282 -5.4282 -5.2186 -5.2186 -4.5467 -4.5467 -4.2925 -4.2925 -4.2597 -4.2597 -4.0970 -4.0970 -1.3856 -1.3856 -0.9950 -0.9950 -0.6106 -0.6106 -0.5192 -0.5192 -0.5015 -0.5015 -0.2738 -0.2738 -0.2205 -0.2205 0.5644 0.5644 3.6311 3.6311 6.0435 6.0435 6.4782 6.4782 6.6200 6.6200 8.6538 8.6538 8.8340 8.8340 k = 0.0833 0.0207 0.1177 ( 6318 PWs) bands (ev): -20.4139 -20.4139 -20.3100 -20.3100 -19.0242 -19.0242 -18.9830 -18.9830 -18.0724 -18.0724 -18.0627 -18.0627 -12.8288 -12.8288 -9.6847 -9.6847 -8.3379 -8.3379 -8.2881 -8.2881 -8.1928 -8.1928 -8.0503 -8.0503 -7.8003 -7.8003 -7.7289 -7.7289 -7.5992 -7.5992 -5.4258 -5.4258 -5.2236 -5.2236 -4.5536 -4.5536 -4.2762 -4.2762 -4.2537 -4.2537 -4.0986 -4.0986 -1.3861 -1.3861 -1.0004 -1.0004 -0.6047 -0.6047 -0.5173 -0.5173 -0.4912 -0.4912 -0.2848 -0.2848 -0.2224 -0.2224 0.5637 0.5637 3.6141 3.6141 6.0285 6.0285 6.4696 6.4696 6.6216 6.6216 8.6639 8.6639 8.8188 8.8188 k = 0.0714 0.0177 0.1008 ( 6319 PWs) bands (ev): -20.4153 -20.4153 -20.3100 -20.3100 -19.0246 -19.0246 -18.9821 -18.9821 -18.0729 -18.0729 -18.0630 -18.0630 -12.8297 -12.8297 -9.6838 -9.6838 -8.3199 -8.3199 -8.2878 -8.2878 -8.1947 -8.1947 -8.0468 -8.0468 -7.8054 -7.8054 -7.7289 -7.7289 -7.6069 -7.6069 -5.4232 -5.4232 -5.2283 -5.2283 -4.5597 -4.5597 -4.2615 -4.2615 -4.2480 -4.2480 -4.1008 -4.1008 -1.3866 -1.3866 -1.0053 -1.0053 -0.5995 -0.5995 -0.5156 -0.5156 -0.4802 -0.4802 -0.2964 -0.2964 -0.2237 -0.2237 0.5632 0.5632 3.5992 3.5992 6.0151 6.0151 6.4623 6.4623 6.6233 6.6233 8.6735 8.6735 8.8043 8.8043 k = 0.0595 0.0148 0.0840 ( 6318 PWs) bands (ev): -20.4165 -20.4165 -20.3099 -20.3099 -19.0249 -19.0249 -18.9814 -18.9814 -18.0733 -18.0733 -18.0632 -18.0632 -12.8304 -12.8304 -9.6830 -9.6830 -8.3030 -8.3030 -8.2871 -8.2871 -8.1975 -8.1975 -8.0437 -8.0437 -7.8101 -7.8101 -7.7288 -7.7288 -7.6139 -7.6139 -5.4206 -5.4206 -5.2325 -5.2325 -4.5650 -4.5650 -4.2500 -4.2500 -4.2411 -4.2411 -4.1036 -4.1036 -1.3870 -1.3870 -1.0096 -1.0096 -0.5951 -0.5951 -0.5142 -0.5142 -0.4689 -0.4689 -0.3083 -0.3083 -0.2247 -0.2247 0.5627 0.5627 3.5865 3.5865 6.0036 6.0036 6.4561 6.4561 6.6249 6.6249 8.6826 8.6826 8.7906 8.7906 k = 0.0476 0.0118 0.0672 ( 6321 PWs) bands (ev): -20.4174 -20.4174 -20.3098 -20.3098 -19.0251 -19.0251 -18.9808 -18.9808 -18.0737 -18.0737 -18.0634 -18.0634 -12.8310 -12.8310 -9.6825 -9.6825 -8.2915 -8.2915 -8.2820 -8.2820 -8.2012 -8.2012 -8.0409 -8.0409 -7.8144 -7.8144 -7.7287 -7.7287 -7.6201 -7.6201 -5.4181 -5.4181 -5.2363 -5.2363 -4.5695 -4.5695 -4.2437 -4.2437 -4.2313 -4.2313 -4.1067 -4.1067 -1.3874 -1.3874 -1.0132 -1.0132 -0.5916 -0.5916 -0.5130 -0.5130 -0.4576 -0.4576 -0.3201 -0.3201 -0.2254 -0.2254 0.5623 0.5623 3.5760 3.5760 5.9940 5.9940 6.4512 6.4512 6.6263 6.6263 8.6914 8.6914 8.7779 8.7779 k = 0.0357 0.0089 0.0504 ( 6321 PWs) bands (ev): -20.4182 -20.4182 -20.3098 -20.3098 -19.0253 -19.0253 -18.9804 -18.9804 -18.0739 -18.0739 -18.0636 -18.0636 -12.8315 -12.8315 -9.6820 -9.6820 -8.2894 -8.2894 -8.2688 -8.2688 -8.2061 -8.2061 -8.0387 -8.0387 -7.8181 -7.8181 -7.7286 -7.7286 -7.6252 -7.6252 -5.4160 -5.4160 -5.2393 -5.2393 -4.5729 -4.5729 -4.2402 -4.2402 -4.2214 -4.2214 -4.1100 -4.1100 -1.3876 -1.3876 -1.0161 -1.0161 -0.5888 -0.5888 -0.5121 -0.5121 -0.4466 -0.4466 -0.3313 -0.3313 -0.2260 -0.2260 0.5619 0.5619 3.5678 3.5678 5.9865 5.9865 6.4474 6.4474 6.6276 6.6276 8.6998 8.6998 8.7664 8.7664 k = 0.0238 0.0059 0.0336 ( 6322 PWs) bands (ev): -20.4187 -20.4187 -20.3098 -20.3098 -19.0255 -19.0255 -18.9800 -18.9800 -18.0741 -18.0741 -18.0637 -18.0637 -12.8318 -12.8318 -9.6817 -9.6817 -8.2891 -8.2891 -8.2554 -8.2554 -8.2121 -8.2121 -8.0371 -8.0371 -7.8209 -7.8209 -7.7284 -7.7284 -7.6290 -7.6290 -5.4144 -5.4144 -5.2417 -5.2417 -4.5755 -4.5755 -4.2380 -4.2380 -4.2134 -4.2134 -4.1128 -4.1128 -1.3878 -1.3878 -1.0182 -1.0182 -0.5868 -0.5868 -0.5115 -0.5115 -0.4370 -0.4370 -0.3412 -0.3412 -0.2263 -0.2263 0.5617 0.5617 3.5619 3.5619 5.9811 5.9811 6.4447 6.4447 6.6285 6.6285 8.7076 8.7076 8.7562 8.7562 k = 0.0119 0.0030 0.0168 ( 6327 PWs) bands (ev): -20.4191 -20.4191 -20.3098 -20.3098 -19.0256 -19.0256 -18.9798 -18.9798 -18.0743 -18.0743 -18.0638 -18.0638 -12.8320 -12.8320 -9.6816 -9.6816 -8.2890 -8.2890 -8.2439 -8.2439 -8.2189 -8.2189 -8.0361 -8.0361 -7.8227 -7.8227 -7.7284 -7.7284 -7.6314 -7.6314 -5.4134 -5.4134 -5.2431 -5.2431 -4.5770 -4.5770 -4.2367 -4.2367 -4.2082 -4.2082 -4.1149 -4.1149 -1.3879 -1.3879 -1.0195 -1.0195 -0.5856 -0.5856 -0.5111 -0.5111 -0.4300 -0.4300 -0.3484 -0.3484 -0.2265 -0.2265 0.5615 0.5615 3.5583 3.5583 5.9778 5.9778 6.4430 6.4430 6.6290 6.6290 8.7141 8.7141 8.7483 8.7483 k = 0.0000 0.0000 0.0000 ( 6333 PWs) bands (ev): -20.4192 -20.4192 -20.3098 -20.3098 -19.0256 -19.0256 -18.9798 -18.9798 -18.0743 -18.0743 -18.0638 -18.0638 -12.8321 -12.8321 -9.6815 -9.6815 -8.2890 -8.2890 -8.2379 -8.2379 -8.2234 -8.2234 -8.0358 -8.0358 -7.8233 -7.8233 -7.7283 -7.7283 -7.6322 -7.6322 -5.4130 -5.4130 -5.2436 -5.2436 -4.5775 -4.5775 -4.2362 -4.2362 -4.2064 -4.2064 -4.1157 -4.1157 -1.3880 -1.3880 -1.0199 -1.0199 -0.5852 -0.5852 -0.5110 -0.5110 -0.4273 -0.4273 -0.3511 -0.3511 -0.2266 -0.2266 0.5615 0.5615 3.5572 3.5572 5.9767 5.9767 6.4425 6.4425 6.6292 6.6292 8.7170 8.7170 8.7449 8.7449 Writing output data file H4C2NO2.save init_run : 0.30s CPU 0.60s WALL ( 1 calls) electrons : 273.14s CPU 278.33s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 273.14s CPU 278.32s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.10s WALL ( 295 calls) cegterg : 251.65s CPU 254.78s WALL ( 542 calls) Called by sum_band: Called by *egterg: h_psi : 124.40s CPU 126.14s WALL ( 8686 calls) s_psi : 5.97s CPU 5.89s WALL ( 8686 calls) g_psi : 0.36s CPU 0.44s WALL ( 7849 calls) cdiaghg : 99.99s CPU 101.18s WALL ( 8144 calls) cegterg:over : 13.67s CPU 13.72s WALL ( 7849 calls) cegterg:upda : 12.54s CPU 12.96s WALL ( 7849 calls) cegterg:last : 5.17s CPU 5.18s WALL ( 1132 calls) cdiaghg:chol : 5.62s CPU 5.87s WALL ( 8144 calls) cdiaghg:inve : 4.14s CPU 4.24s WALL ( 8144 calls) cdiaghg:para : 7.24s CPU 7.17s WALL ( 16288 calls) Called by h_psi: h_psi:vloc : 107.48s CPU 109.38s WALL ( 8686 calls) h_psi:vnl : 16.36s CPU 16.20s WALL ( 8686 calls) add_vuspsi : 6.50s CPU 6.66s WALL ( 8686 calls) General routines calbec : 9.84s CPU 9.51s WALL ( 8686 calls) fft : 0.02s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 98.16s CPU 99.91s WALL ( 1048704 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.28s CPU 0.36s WALL ( 590 calls) Parallel routines fft_scatter : 36.58s CPU 37.24s WALL ( 1048727 calls) PWSCF : 4m56.40s CPU 5m30.29s WALL This run was terminated on: 16:19: 4 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=