Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:24:45 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: ./SrC2.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 40 20 5 2159 753 116 Max 41 21 6 2167 780 124 Sum 1467 735 215 77895 27623 4407 bravais-lattice index = 14 lattice parameter (alat) = 7.8828 a.u. unit-cell volume = 779.5589 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 41.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.882841 celldm(2)= 1.000000 celldm(3)= 1.841963 celldm(4)= 0.250006 celldm(5)= 0.250006 celldm(6)= 0.426349 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.426349 0.904559 0.000000 ) a(3) = ( 0.460502 0.292040 1.759397 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.471333 -0.183502 ) b(2) = ( 0.000000 1.105511 -0.183502 ) b(3) = ( 0.000000 0.000000 0.568377 ) PseudoPot. # 1 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. # 2 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential C 4.00 12.01070 C( 1.00) Sr 10.00 87.62000 Sr( 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= 353 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 2) = ( 0.0106383 0.0067466 -0.0039043), wk = 0.0028329 k( 3) = ( 0.0212766 0.0134931 -0.0078086), wk = 0.0028329 k( 4) = ( 0.0319149 0.0202397 -0.0117129), wk = 0.0028329 k( 5) = ( 0.0425532 0.0269863 -0.0156172), wk = 0.0028329 k( 6) = ( 0.0531915 0.0337329 -0.0195215), wk = 0.0028329 k( 7) = ( 0.0638298 0.0404794 -0.0234258), wk = 0.0028329 k( 8) = ( 0.0744681 0.0472260 -0.0273301), wk = 0.0028329 k( 9) = ( 0.0851064 0.0539726 -0.0312344), wk = 0.0028329 k( 10) = ( 0.0957447 0.0607192 -0.0351388), wk = 0.0028329 k( 11) = ( 0.1063830 0.0674657 -0.0390431), wk = 0.0028329 k( 12) = ( 0.1170213 0.0742123 -0.0429474), wk = 0.0028329 k( 13) = ( 0.1276596 0.0809589 -0.0468517), wk = 0.0028329 k( 14) = ( 0.1382979 0.0877054 -0.0507560), wk = 0.0028329 k( 15) = ( 0.1489362 0.0944520 -0.0546603), wk = 0.0028329 k( 16) = ( 0.1595745 0.1011986 -0.0585646), wk = 0.0028329 k( 17) = ( 0.1702128 0.1079452 -0.0624689), wk = 0.0028329 k( 18) = ( 0.1808511 0.1146917 -0.0663732), wk = 0.0028329 k( 19) = ( 0.1914894 0.1214383 -0.0702775), wk = 0.0028329 k( 20) = ( 0.2021277 0.1281849 -0.0741818), wk = 0.0028329 k( 21) = ( 0.2127660 0.1349315 -0.0780861), wk = 0.0028329 k( 22) = ( 0.2234043 0.1416780 -0.0819904), wk = 0.0028329 k( 23) = ( 0.2340425 0.1484246 -0.0858947), wk = 0.0028329 k( 24) = ( 0.2446809 0.1551712 -0.0897990), wk = 0.0028329 k( 25) = ( 0.2553191 0.1619177 -0.0937033), wk = 0.0028329 k( 26) = ( 0.2659574 0.1686643 -0.0976077), wk = 0.0028329 k( 27) = ( 0.2765957 0.1754109 -0.1015120), wk = 0.0028329 k( 28) = ( 0.2872340 0.1821575 -0.1054163), wk = 0.0028329 k( 29) = ( 0.2978723 0.1889040 -0.1093206), wk = 0.0028329 k( 30) = ( 0.3085106 0.1956506 -0.1132249), wk = 0.0028329 k( 31) = ( 0.3191489 0.2023972 -0.1171292), wk = 0.0028329 k( 32) = ( 0.3297872 0.2091438 -0.1210335), wk = 0.0028329 k( 33) = ( 0.3404255 0.2158903 -0.1249378), wk = 0.0028329 k( 34) = ( 0.3510638 0.2226369 -0.1288421), wk = 0.0028329 k( 35) = ( 0.3617021 0.2293835 -0.1327464), wk = 0.0028329 k( 36) = ( 0.3723404 0.2361301 -0.1366507), wk = 0.0028329 k( 37) = ( 0.3829787 0.2428766 -0.1405550), wk = 0.0028329 k( 38) = ( 0.3936170 0.2496232 -0.1444593), wk = 0.0028329 k( 39) = ( 0.4042553 0.2563698 -0.1483636), wk = 0.0028329 k( 40) = ( 0.4148936 0.2631163 -0.1522679), wk = 0.0028329 k( 41) = ( 0.4255319 0.2698629 -0.1561722), wk = 0.0028329 k( 42) = ( 0.4361702 0.2766095 -0.1600765), wk = 0.0028329 k( 43) = ( 0.4468085 0.2833561 -0.1639809), wk = 0.0028329 k( 44) = ( 0.4574468 0.2901026 -0.1678852), wk = 0.0028329 k( 45) = ( 0.4680851 0.2968492 -0.1717895), wk = 0.0028329 k( 46) = ( 0.4787234 0.3035958 -0.1756938), wk = 0.0028329 k( 47) = ( 0.4893617 0.3103423 -0.1795981), wk = 0.0028329 k( 48) = ( 0.5000000 0.3170889 -0.1835024), wk = 0.0028329 k( 49) = ( 0.5000000 0.3170889 -0.1835024), wk = 0.0028329 k( 50) = ( 0.5032942 0.3191780 -0.1709166), wk = 0.0028329 k( 51) = ( 0.5065883 0.3212671 -0.1583309), wk = 0.0028329 k( 52) = ( 0.5098825 0.3233562 -0.1457452), wk = 0.0028329 k( 53) = ( 0.5131767 0.3254453 -0.1331594), wk = 0.0028329 k( 54) = ( 0.5164709 0.3275344 -0.1205737), wk = 0.0028329 k( 55) = ( 0.5197650 0.3296235 -0.1079879), wk = 0.0028329 k( 56) = ( 0.5230592 0.3317126 -0.0954022), wk = 0.0028329 k( 57) = ( 0.5263534 0.3338017 -0.0828165), wk = 0.0028329 k( 58) = ( 0.5263534 0.3338017 -0.0828165), wk = 0.0028329 k( 59) = ( 0.5245965 0.3326875 -0.0705830), wk = 0.0028329 k( 60) = ( 0.5228396 0.3315733 -0.0583495), wk = 0.0028329 k( 61) = ( 0.5210827 0.3304591 -0.0461160), wk = 0.0028329 k( 62) = ( 0.5193258 0.3293449 -0.0338825), wk = 0.0028329 k( 63) = ( 0.5175689 0.3282307 -0.0216490), wk = 0.0028329 k( 64) = ( 0.5158120 0.3271166 -0.0094155), wk = 0.0028329 k( 65) = ( 0.5140551 0.3260024 0.0028180), wk = 0.0028329 k( 66) = ( 0.5122982 0.3248882 0.0150515), wk = 0.0028329 k( 67) = ( 0.5105414 0.3237740 0.0272850), wk = 0.0028329 k( 68) = ( 0.5087845 0.3226598 0.0395185), wk = 0.0028329 k( 69) = ( 0.5070276 0.3215457 0.0517520), wk = 0.0028329 k( 70) = ( 0.5052707 0.3204315 0.0639854), wk = 0.0028329 k( 71) = ( 0.5035138 0.3193173 0.0762189), wk = 0.0028329 k( 72) = ( 0.5017569 0.3182031 0.0884524), wk = 0.0028329 k( 73) = ( 0.5000000 0.3170889 0.1006859), wk = 0.0028329 k( 74) = ( 0.5000000 0.3170889 0.1006859), wk = 0.0028329 k( 75) = ( 0.5070713 0.3059385 0.1006859), wk = 0.0028329 k( 76) = ( 0.5141427 0.2947882 0.1006859), wk = 0.0028329 k( 77) = ( 0.5212140 0.2836378 0.1006859), wk = 0.0028329 k( 78) = ( 0.5282853 0.2724874 0.1006859), wk = 0.0028329 k( 79) = ( 0.5353566 0.2613370 0.1006859), wk = 0.0028329 k( 80) = ( 0.5424279 0.2501866 0.1006859), wk = 0.0028329 k( 81) = ( 0.5494993 0.2390363 0.1006859), wk = 0.0028329 k( 82) = ( 0.5565706 0.2278859 0.1006859), wk = 0.0028329 k( 83) = ( 0.5636419 0.2167355 0.1006859), wk = 0.0028329 k( 84) = ( 0.5707132 0.2055851 0.1006859), wk = 0.0028329 k( 85) = ( 0.5777846 0.1944347 0.1006859), wk = 0.0028329 k( 86) = ( 0.5848559 0.1832844 0.1006859), wk = 0.0028329 k( 87) = ( 0.5919272 0.1721340 0.1006859), wk = 0.0028329 k( 88) = ( 0.5989985 0.1609836 0.1006859), wk = 0.0028329 k( 89) = ( 0.6060699 0.1498332 0.1006859), wk = 0.0028329 k( 90) = ( 0.6131412 0.1386828 0.1006859), wk = 0.0028329 k( 91) = ( 0.6202125 0.1275325 0.1006859), wk = 0.0028329 k( 92) = ( 0.6272838 0.1163821 0.1006859), wk = 0.0028329 k( 93) = ( 0.6343551 0.1052317 0.1006859), wk = 0.0028329 k( 94) = ( 0.6414265 0.0940813 0.1006859), wk = 0.0028329 k( 95) = ( 0.6484978 0.0829309 0.1006859), wk = 0.0028329 k( 96) = ( 0.6555691 0.0717806 0.1006859), wk = 0.0028329 k( 97) = ( 0.6626405 0.0606302 0.1006859), wk = 0.0028329 k( 98) = ( 0.6697118 0.0494798 0.1006859), wk = 0.0028329 k( 99) = ( 0.3302882 -0.5208133 0.2841883), wk = 0.0028329 k( 100) = ( 0.3232608 -0.5097321 0.2841883), wk = 0.0028329 k( 101) = ( 0.3162334 -0.4986510 0.2841883), wk = 0.0028329 k( 102) = ( 0.3092060 -0.4875699 0.2841883), wk = 0.0028329 k( 103) = ( 0.3021786 -0.4764887 0.2841883), wk = 0.0028329 k( 104) = ( 0.2951512 -0.4654076 0.2841883), wk = 0.0028329 k( 105) = ( 0.2881238 -0.4543265 0.2841883), wk = 0.0028329 k( 106) = ( 0.2810964 -0.4432453 0.2841883), wk = 0.0028329 k( 107) = ( 0.2740690 -0.4321642 0.2841883), wk = 0.0028329 k( 108) = ( 0.2670416 -0.4210831 0.2841883), wk = 0.0028329 k( 109) = ( 0.2600141 -0.4100019 0.2841883), wk = 0.0028329 k( 110) = ( 0.2529867 -0.3989208 0.2841883), wk = 0.0028329 k( 111) = ( 0.2459593 -0.3878397 0.2841883), wk = 0.0028329 k( 112) = ( 0.2389319 -0.3767585 0.2841883), wk = 0.0028329 k( 113) = ( 0.2319045 -0.3656774 0.2841883), wk = 0.0028329 k( 114) = ( 0.2248771 -0.3545963 0.2841883), wk = 0.0028329 k( 115) = ( 0.2178497 -0.3435151 0.2841883), wk = 0.0028329 k( 116) = ( 0.2108223 -0.3324340 0.2841883), wk = 0.0028329 k( 117) = ( 0.2037949 -0.3213529 0.2841883), wk = 0.0028329 k( 118) = ( 0.1967675 -0.3102717 0.2841883), wk = 0.0028329 k( 119) = ( 0.1897400 -0.2991906 0.2841883), wk = 0.0028329 k( 120) = ( 0.1827126 -0.2881095 0.2841883), wk = 0.0028329 k( 121) = ( 0.1756852 -0.2770283 0.2841883), wk = 0.0028329 k( 122) = ( 0.1686578 -0.2659472 0.2841883), wk = 0.0028329 k( 123) = ( 0.1616304 -0.2548661 0.2841883), wk = 0.0028329 k( 124) = ( 0.1546030 -0.2437849 0.2841883), wk = 0.0028329 k( 125) = ( 0.1475756 -0.2327038 0.2841883), wk = 0.0028329 k( 126) = ( 0.1405482 -0.2216227 0.2841883), wk = 0.0028329 k( 127) = ( 0.1335208 -0.2105415 0.2841883), wk = 0.0028329 k( 128) = ( 0.1264934 -0.1994604 0.2841883), wk = 0.0028329 k( 129) = ( 0.1194660 -0.1883793 0.2841883), wk = 0.0028329 k( 130) = ( 0.1124385 -0.1772981 0.2841883), wk = 0.0028329 k( 131) = ( 0.1054111 -0.1662170 0.2841883), wk = 0.0028329 k( 132) = ( 0.0983837 -0.1551359 0.2841883), wk = 0.0028329 k( 133) = ( 0.0913563 -0.1440547 0.2841883), wk = 0.0028329 k( 134) = ( 0.0843289 -0.1329736 0.2841883), wk = 0.0028329 k( 135) = ( 0.0773015 -0.1218925 0.2841883), wk = 0.0028329 k( 136) = ( 0.0702741 -0.1108113 0.2841883), wk = 0.0028329 k( 137) = ( 0.0632467 -0.0997302 0.2841883), wk = 0.0028329 k( 138) = ( 0.0562193 -0.0886491 0.2841883), wk = 0.0028329 k( 139) = ( 0.0491919 -0.0775679 0.2841883), wk = 0.0028329 k( 140) = ( 0.0421644 -0.0664868 0.2841883), wk = 0.0028329 k( 141) = ( 0.0351371 -0.0554057 0.2841883), wk = 0.0028329 k( 142) = ( 0.0281096 -0.0443245 0.2841883), wk = 0.0028329 k( 143) = ( 0.0210822 -0.0332434 0.2841883), wk = 0.0028329 k( 144) = ( 0.0140548 -0.0221623 0.2841883), wk = 0.0028329 k( 145) = ( 0.0070274 -0.0110811 0.2841883), wk = 0.0028329 k( 146) = ( 0.0000000 0.0000000 0.2841883), wk = 0.0028329 k( 147) = ( 0.0000000 0.0000000 0.2841883), wk = 0.0028329 k( 148) = ( 0.0110150 0.0069855 0.2841883), wk = 0.0028329 k( 149) = ( 0.0220301 0.0139710 0.2841883), wk = 0.0028329 k( 150) = ( 0.0330451 0.0209565 0.2841883), wk = 0.0028329 k( 151) = ( 0.0440601 0.0279420 0.2841883), wk = 0.0028329 k( 152) = ( 0.0550752 0.0349275 0.2841883), wk = 0.0028329 k( 153) = ( 0.0660902 0.0419130 0.2841883), wk = 0.0028329 k( 154) = ( 0.0771053 0.0488984 0.2841883), wk = 0.0028329 k( 155) = ( 0.0881203 0.0558839 0.2841883), wk = 0.0028329 k( 156) = ( 0.0991353 0.0628694 0.2841883), wk = 0.0028329 k( 157) = ( 0.1101504 0.0698549 0.2841883), wk = 0.0028329 k( 158) = ( 0.1211654 0.0768404 0.2841883), wk = 0.0028329 k( 159) = ( 0.1321805 0.0838259 0.2841883), wk = 0.0028329 k( 160) = ( 0.1431955 0.0908114 0.2841883), wk = 0.0028329 k( 161) = ( 0.1542105 0.0977969 0.2841883), wk = 0.0028329 k( 162) = ( 0.1652256 0.1047824 0.2841883), wk = 0.0028329 k( 163) = ( 0.1762406 0.1117679 0.2841883), wk = 0.0028329 k( 164) = ( 0.1872556 0.1187534 0.2841883), wk = 0.0028329 k( 165) = ( 0.1982707 0.1257389 0.2841883), wk = 0.0028329 k( 166) = ( 0.2092857 0.1327244 0.2841883), wk = 0.0028329 k( 167) = ( 0.2203008 0.1397099 0.2841883), wk = 0.0028329 k( 168) = ( 0.2313158 0.1466953 0.2841883), wk = 0.0028329 k( 169) = ( 0.2423308 0.1536808 0.2841883), wk = 0.0028329 k( 170) = ( 0.2533459 0.1606663 0.2841883), wk = 0.0028329 k( 171) = ( 0.2643609 0.1676518 0.2841883), wk = 0.0028329 k( 172) = ( 0.2753759 0.1746373 0.2841883), wk = 0.0028329 k( 173) = ( 0.2863910 0.1816228 0.2841883), wk = 0.0028329 k( 174) = ( 0.2974060 0.1886083 0.2841883), wk = 0.0028329 k( 175) = ( 0.3084211 0.1955938 0.2841883), wk = 0.0028329 k( 176) = ( 0.3194361 0.2025793 0.2841883), wk = 0.0028329 k( 177) = ( 0.3304511 0.2095648 0.2841883), wk = 0.0028329 k( 178) = ( 0.3414662 0.2165503 0.2841883), wk = 0.0028329 k( 179) = ( 0.3524812 0.2235358 0.2841883), wk = 0.0028329 k( 180) = ( 0.3634963 0.2305213 0.2841883), wk = 0.0028329 k( 181) = ( 0.3745113 0.2375068 0.2841883), wk = 0.0028329 k( 182) = ( 0.3855263 0.2444923 0.2841883), wk = 0.0028329 k( 183) = ( 0.3965414 0.2514777 0.2841883), wk = 0.0028329 k( 184) = ( 0.4075564 0.2584632 0.2841883), wk = 0.0028329 k( 185) = ( 0.4185714 0.2654487 0.2841883), wk = 0.0028329 k( 186) = ( 0.4295865 0.2724342 0.2841883), wk = 0.0028329 k( 187) = ( 0.4406015 0.2794197 0.2841883), wk = 0.0028329 k( 188) = ( 0.4516166 0.2864052 0.2841883), wk = 0.0028329 k( 189) = ( 0.4626316 0.2933907 0.2841883), wk = 0.0028329 k( 190) = ( 0.4736466 0.3003762 0.2841883), wk = 0.0028329 k( 191) = ( 0.5000000 0.3170889 -0.1835024), wk = 0.0028329 k( 192) = ( 0.5069898 0.3060671 -0.1835024), wk = 0.0028329 k( 193) = ( 0.5139796 0.2950452 -0.1835024), wk = 0.0028329 k( 194) = ( 0.5209694 0.2840234 -0.1835024), wk = 0.0028329 k( 195) = ( 0.5279593 0.2730015 -0.1835024), wk = 0.0028329 k( 196) = ( 0.5349491 0.2619796 -0.1835024), wk = 0.0028329 k( 197) = ( 0.5419389 0.2509578 -0.1835024), wk = 0.0028329 k( 198) = ( 0.5489287 0.2399359 -0.1835024), wk = 0.0028329 k( 199) = ( 0.5559185 0.2289141 -0.1835024), wk = 0.0028329 k( 200) = ( 0.5629083 0.2178922 -0.1835024), wk = 0.0028329 k( 201) = ( 0.5698981 0.2068704 -0.1835024), wk = 0.0028329 k( 202) = ( 0.5768880 0.1958485 -0.1835024), wk = 0.0028329 k( 203) = ( 0.5838778 0.1848267 -0.1835024), wk = 0.0028329 k( 204) = ( 0.5908676 0.1738048 -0.1835024), wk = 0.0028329 k( 205) = ( 0.5978574 0.1627830 -0.1835024), wk = 0.0028329 k( 206) = ( 0.6048472 0.1517611 -0.1835024), wk = 0.0028329 k( 207) = ( 0.6118370 0.1407393 -0.1835024), wk = 0.0028329 k( 208) = ( 0.6188269 0.1297174 -0.1835024), wk = 0.0028329 k( 209) = ( 0.6258167 0.1186956 -0.1835024), wk = 0.0028329 k( 210) = ( 0.6328065 0.1076737 -0.1835024), wk = 0.0028329 k( 211) = ( 0.6397963 0.0966519 -0.1835024), wk = 0.0028329 k( 212) = ( 0.3602037 -0.5679853 -0.0000000), wk = 0.0028329 k( 213) = ( 0.3531409 -0.5568483 -0.0000000), wk = 0.0028329 k( 214) = ( 0.3460781 -0.5457114 -0.0000000), wk = 0.0028329 k( 215) = ( 0.3390152 -0.5345744 -0.0000000), wk = 0.0028329 k( 216) = ( 0.3319524 -0.5234374 -0.0000000), wk = 0.0028329 k( 217) = ( 0.3248896 -0.5123005 -0.0000000), wk = 0.0028329 k( 218) = ( 0.3178268 -0.5011635 -0.0000000), wk = 0.0028329 k( 219) = ( 0.3107640 -0.4900265 -0.0000000), wk = 0.0028329 k( 220) = ( 0.3037012 -0.4788896 -0.0000000), wk = 0.0028329 k( 221) = ( 0.2966383 -0.4677526 -0.0000000), wk = 0.0028329 k( 222) = ( 0.2895755 -0.4566156 -0.0000000), wk = 0.0028329 k( 223) = ( 0.2825127 -0.4454787 -0.0000000), wk = 0.0028329 k( 224) = ( 0.2754499 -0.4343417 -0.0000000), wk = 0.0028329 k( 225) = ( 0.2683871 -0.4232047 -0.0000000), wk = 0.0028329 k( 226) = ( 0.2613242 -0.4120678 -0.0000000), wk = 0.0028329 k( 227) = ( 0.2542614 -0.4009308 -0.0000000), wk = 0.0028329 k( 228) = ( 0.2471986 -0.3897938 -0.0000000), wk = 0.0028329 k( 229) = ( 0.2401358 -0.3786569 -0.0000000), wk = 0.0028329 k( 230) = ( 0.2330730 -0.3675199 -0.0000000), wk = 0.0028329 k( 231) = ( 0.2260102 -0.3563829 -0.0000000), wk = 0.0028329 k( 232) = ( 0.2189474 -0.3452460 -0.0000000), wk = 0.0028329 k( 233) = ( 0.2118845 -0.3341090 -0.0000000), wk = 0.0028329 k( 234) = ( 0.2048217 -0.3229720 -0.0000000), wk = 0.0028329 k( 235) = ( 0.1977589 -0.3118351 -0.0000000), wk = 0.0028329 k( 236) = ( 0.1906961 -0.3006981 -0.0000000), wk = 0.0028329 k( 237) = ( 0.1836333 -0.2895611 -0.0000000), wk = 0.0028329 k( 238) = ( 0.1765704 -0.2784242 -0.0000000), wk = 0.0028329 k( 239) = ( 0.1695076 -0.2672872 -0.0000000), wk = 0.0028329 k( 240) = ( 0.1624448 -0.2561502 -0.0000000), wk = 0.0028329 k( 241) = ( 0.1553820 -0.2450133 -0.0000000), wk = 0.0028329 k( 242) = ( 0.1483192 -0.2338763 -0.0000000), wk = 0.0028329 k( 243) = ( 0.1412564 -0.2227393 -0.0000000), wk = 0.0028329 k( 244) = ( 0.1341935 -0.2116024 -0.0000000), wk = 0.0028329 k( 245) = ( 0.1271307 -0.2004654 -0.0000000), wk = 0.0028329 k( 246) = ( 0.1200679 -0.1893284 -0.0000000), wk = 0.0028329 k( 247) = ( 0.1130051 -0.1781915 -0.0000000), wk = 0.0028329 k( 248) = ( 0.1059423 -0.1670545 -0.0000000), wk = 0.0028329 k( 249) = ( 0.0988794 -0.1559175 -0.0000000), wk = 0.0028329 k( 250) = ( 0.0918166 -0.1447806 -0.0000000), wk = 0.0028329 k( 251) = ( 0.0847538 -0.1336436 -0.0000000), wk = 0.0028329 k( 252) = ( 0.0776910 -0.1225066 -0.0000000), wk = 0.0028329 k( 253) = ( 0.0706282 -0.1113697 -0.0000000), wk = 0.0028329 k( 254) = ( 0.0635654 -0.1002327 -0.0000000), wk = 0.0028329 k( 255) = ( 0.0565025 -0.0890957 -0.0000000), wk = 0.0028329 k( 256) = ( 0.0494397 -0.0779588 -0.0000000), wk = 0.0028329 k( 257) = ( 0.0423769 -0.0668218 -0.0000000), wk = 0.0028329 k( 258) = ( 0.0353141 -0.0556848 -0.0000000), wk = 0.0028329 k( 259) = ( 0.0282513 -0.0445479 -0.0000000), wk = 0.0028329 k( 260) = ( 0.0211885 -0.0334109 -0.0000000), wk = 0.0028329 k( 261) = ( 0.0141256 -0.0222739 -0.0000000), wk = 0.0028329 k( 262) = ( 0.0070628 -0.0111370 -0.0000000), wk = 0.0028329 k( 263) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 264) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 265) = ( 0.0116279 -0.0054806 -0.0021337), wk = 0.0028329 k( 266) = ( 0.0232558 -0.0109612 -0.0042675), wk = 0.0028329 k( 267) = ( 0.0348837 -0.0164419 -0.0064012), wk = 0.0028329 k( 268) = ( 0.0465116 -0.0219225 -0.0085350), wk = 0.0028329 k( 269) = ( 0.0581395 -0.0274031 -0.0106687), wk = 0.0028329 k( 270) = ( 0.0697674 -0.0328837 -0.0128025), wk = 0.0028329 k( 271) = ( 0.0813954 -0.0383644 -0.0149362), wk = 0.0028329 k( 272) = ( 0.0930233 -0.0438450 -0.0170700), wk = 0.0028329 k( 273) = ( 0.1046512 -0.0493256 -0.0192037), wk = 0.0028329 k( 274) = ( 0.1162791 -0.0548062 -0.0213375), wk = 0.0028329 k( 275) = ( 0.1279070 -0.0602868 -0.0234712), wk = 0.0028329 k( 276) = ( 0.1395349 -0.0657675 -0.0256050), wk = 0.0028329 k( 277) = ( 0.1511628 -0.0712481 -0.0277387), wk = 0.0028329 k( 278) = ( 0.1627907 -0.0767287 -0.0298725), wk = 0.0028329 k( 279) = ( 0.1744186 -0.0822093 -0.0320062), wk = 0.0028329 k( 280) = ( 0.1860465 -0.0876899 -0.0341400), wk = 0.0028329 k( 281) = ( 0.1976744 -0.0931706 -0.0362737), wk = 0.0028329 k( 282) = ( 0.2093023 -0.0986512 -0.0384075), wk = 0.0028329 k( 283) = ( 0.2209302 -0.1041318 -0.0405412), wk = 0.0028329 k( 284) = ( 0.2325581 -0.1096124 -0.0426750), wk = 0.0028329 k( 285) = ( 0.2441860 -0.1150931 -0.0448087), wk = 0.0028329 k( 286) = ( 0.2558140 -0.1205737 -0.0469425), wk = 0.0028329 k( 287) = ( 0.2674419 -0.1260543 -0.0490762), wk = 0.0028329 k( 288) = ( 0.2790698 -0.1315349 -0.0512100), wk = 0.0028329 k( 289) = ( 0.2906977 -0.1370155 -0.0533437), wk = 0.0028329 k( 290) = ( 0.3023256 -0.1424962 -0.0554775), wk = 0.0028329 k( 291) = ( 0.3139535 -0.1479768 -0.0576112), wk = 0.0028329 k( 292) = ( 0.3255814 -0.1534574 -0.0597450), wk = 0.0028329 k( 293) = ( 0.3372093 -0.1589380 -0.0618787), wk = 0.0028329 k( 294) = ( 0.3488372 -0.1644186 -0.0640125), wk = 0.0028329 k( 295) = ( 0.3604651 -0.1698993 -0.0661462), wk = 0.0028329 k( 296) = ( 0.3720930 -0.1753799 -0.0682800), wk = 0.0028329 k( 297) = ( 0.3837209 -0.1808605 -0.0704137), wk = 0.0028329 k( 298) = ( 0.3953488 -0.1863411 -0.0725475), wk = 0.0028329 k( 299) = ( 0.4069767 -0.1918218 -0.0746812), wk = 0.0028329 k( 300) = ( 0.4186047 -0.1973024 -0.0768150), wk = 0.0028329 k( 301) = ( 0.4302326 -0.2027830 -0.0789487), wk = 0.0028329 k( 302) = ( 0.4418605 -0.2082636 -0.0810825), wk = 0.0028329 k( 303) = ( 0.4534884 -0.2137442 -0.0832162), wk = 0.0028329 k( 304) = ( 0.4651163 -0.2192249 -0.0853499), wk = 0.0028329 k( 305) = ( 0.4767442 -0.2247055 -0.0874837), wk = 0.0028329 k( 306) = ( 0.4883721 -0.2301861 -0.0896174), wk = 0.0028329 k( 307) = ( 0.5000000 -0.2356667 -0.0917512), wk = 0.0028329 k( 308) = ( 0.5000000 -0.2356667 0.1924371), wk = 0.0028329 k( 309) = ( 0.4888889 -0.2304297 0.1881607), wk = 0.0028329 k( 310) = ( 0.4777778 -0.2251926 0.1838844), wk = 0.0028329 k( 311) = ( 0.4666667 -0.2199556 0.1796080), wk = 0.0028329 k( 312) = ( 0.4555556 -0.2147186 0.1753316), wk = 0.0028329 k( 313) = ( 0.4444444 -0.2094815 0.1710552), wk = 0.0028329 k( 314) = ( 0.4333333 -0.2042445 0.1667788), wk = 0.0028329 k( 315) = ( 0.4222222 -0.1990075 0.1625025), wk = 0.0028329 k( 316) = ( 0.4111111 -0.1937704 0.1582261), wk = 0.0028329 k( 317) = ( 0.4000000 -0.1885334 0.1539497), wk = 0.0028329 k( 318) = ( 0.3888889 -0.1832963 0.1496733), wk = 0.0028329 k( 319) = ( 0.3777778 -0.1780593 0.1453969), wk = 0.0028329 k( 320) = ( 0.3666667 -0.1728223 0.1411206), wk = 0.0028329 k( 321) = ( 0.3555556 -0.1675852 0.1368442), wk = 0.0028329 k( 322) = ( 0.3444444 -0.1623482 0.1325678), wk = 0.0028329 k( 323) = ( 0.3333333 -0.1571111 0.1282914), wk = 0.0028329 k( 324) = ( 0.3222222 -0.1518741 0.1240150), wk = 0.0028329 k( 325) = ( 0.3111111 -0.1466371 0.1197387), wk = 0.0028329 k( 326) = ( 0.3000000 -0.1414000 0.1154623), wk = 0.0028329 k( 327) = ( 0.2888889 -0.1361630 0.1111859), wk = 0.0028329 k( 328) = ( 0.2777778 -0.1309260 0.1069095), wk = 0.0028329 k( 329) = ( 0.2666667 -0.1256889 0.1026331), wk = 0.0028329 k( 330) = ( 0.2555556 -0.1204519 0.0983568), wk = 0.0028329 k( 331) = ( 0.2444444 -0.1152148 0.0940804), wk = 0.0028329 k( 332) = ( 0.2333333 -0.1099778 0.0898040), wk = 0.0028329 k( 333) = ( 0.2222222 -0.1047408 0.0855276), wk = 0.0028329 k( 334) = ( 0.2111111 -0.0995037 0.0812512), wk = 0.0028329 k( 335) = ( 0.2000000 -0.0942667 0.0769748), wk = 0.0028329 k( 336) = ( 0.1888889 -0.0890297 0.0726985), wk = 0.0028329 k( 337) = ( 0.1777778 -0.0837926 0.0684221), wk = 0.0028329 k( 338) = ( 0.1666667 -0.0785556 0.0641457), wk = 0.0028329 k( 339) = ( 0.1555556 -0.0733185 0.0598693), wk = 0.0028329 k( 340) = ( 0.1444444 -0.0680815 0.0555929), wk = 0.0028329 k( 341) = ( 0.1333333 -0.0628445 0.0513166), wk = 0.0028329 k( 342) = ( 0.1222222 -0.0576074 0.0470402), wk = 0.0028329 k( 343) = ( 0.1111111 -0.0523704 0.0427638), wk = 0.0028329 k( 344) = ( 0.1000000 -0.0471333 0.0384874), wk = 0.0028329 k( 345) = ( 0.0888889 -0.0418963 0.0342110), wk = 0.0028329 k( 346) = ( 0.0777778 -0.0366593 0.0299347), wk = 0.0028329 k( 347) = ( 0.0666667 -0.0314222 0.0256583), wk = 0.0028329 k( 348) = ( 0.0555556 -0.0261852 0.0213819), wk = 0.0028329 k( 349) = ( 0.0444444 -0.0209482 0.0171055), wk = 0.0028329 k( 350) = ( 0.0333333 -0.0157111 0.0128291), wk = 0.0028329 k( 351) = ( 0.0222222 -0.0104741 0.0085528), wk = 0.0028329 k( 352) = ( 0.0111111 -0.0052370 0.0042764), wk = 0.0028329 k( 353) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 2) = ( 0.0106383 0.0106383 -0.0000000), wk = 0.0028329 k( 3) = ( 0.0212766 0.0212766 -0.0000000), wk = 0.0028329 k( 4) = ( 0.0319149 0.0319149 -0.0000000), wk = 0.0028329 k( 5) = ( 0.0425532 0.0425532 -0.0000000), wk = 0.0028329 k( 6) = ( 0.0531915 0.0531915 -0.0000000), wk = 0.0028329 k( 7) = ( 0.0638298 0.0638298 -0.0000000), wk = 0.0028329 k( 8) = ( 0.0744681 0.0744681 0.0000000), wk = 0.0028329 k( 9) = ( 0.0851064 0.0851064 -0.0000000), wk = 0.0028329 k( 10) = ( 0.0957447 0.0957447 0.0000000), wk = 0.0028329 k( 11) = ( 0.1063830 0.1063830 -0.0000000), wk = 0.0028329 k( 12) = ( 0.1170213 0.1170213 0.0000000), wk = 0.0028329 k( 13) = ( 0.1276596 0.1276596 0.0000000), wk = 0.0028329 k( 14) = ( 0.1382979 0.1382979 -0.0000000), wk = 0.0028329 k( 15) = ( 0.1489362 0.1489362 0.0000000), wk = 0.0028329 k( 16) = ( 0.1595745 0.1595745 -0.0000000), wk = 0.0028329 k( 17) = ( 0.1702128 0.1702128 -0.0000000), wk = 0.0028329 k( 18) = ( 0.1808511 0.1808511 0.0000000), wk = 0.0028329 k( 19) = ( 0.1914894 0.1914894 0.0000000), wk = 0.0028329 k( 20) = ( 0.2021277 0.2021277 -0.0000000), wk = 0.0028329 k( 21) = ( 0.2127660 0.2127660 -0.0000000), wk = 0.0028329 k( 22) = ( 0.2234043 0.2234043 0.0000000), wk = 0.0028329 k( 23) = ( 0.2340425 0.2340425 -0.0000000), wk = 0.0028329 k( 24) = ( 0.2446809 0.2446809 0.0000000), wk = 0.0028329 k( 25) = ( 0.2553191 0.2553191 0.0000000), wk = 0.0028329 k( 26) = ( 0.2659574 0.2659574 -0.0000000), wk = 0.0028329 k( 27) = ( 0.2765957 0.2765957 -0.0000000), wk = 0.0028329 k( 28) = ( 0.2872340 0.2872340 -0.0000000), wk = 0.0028329 k( 29) = ( 0.2978723 0.2978723 0.0000000), wk = 0.0028329 k( 30) = ( 0.3085106 0.3085106 -0.0000000), wk = 0.0028329 k( 31) = ( 0.3191489 0.3191489 -0.0000000), wk = 0.0028329 k( 32) = ( 0.3297872 0.3297872 0.0000000), wk = 0.0028329 k( 33) = ( 0.3404255 0.3404255 -0.0000000), wk = 0.0028329 k( 34) = ( 0.3510638 0.3510638 -0.0000000), wk = 0.0028329 k( 35) = ( 0.3617021 0.3617021 -0.0000000), wk = 0.0028329 k( 36) = ( 0.3723404 0.3723404 -0.0000000), wk = 0.0028329 k( 37) = ( 0.3829787 0.3829787 0.0000000), wk = 0.0028329 k( 38) = ( 0.3936170 0.3936170 0.0000000), wk = 0.0028329 k( 39) = ( 0.4042553 0.4042553 -0.0000000), wk = 0.0028329 k( 40) = ( 0.4148936 0.4148936 -0.0000000), wk = 0.0028329 k( 41) = ( 0.4255319 0.4255319 0.0000000), wk = 0.0028329 k( 42) = ( 0.4361702 0.4361702 -0.0000000), wk = 0.0028329 k( 43) = ( 0.4468085 0.4468085 -0.0000000), wk = 0.0028329 k( 44) = ( 0.4574468 0.4574468 -0.0000000), wk = 0.0028329 k( 45) = ( 0.4680851 0.4680851 -0.0000000), wk = 0.0028329 k( 46) = ( 0.4787234 0.4787234 -0.0000000), wk = 0.0028329 k( 47) = ( 0.4893617 0.4893617 0.0000000), wk = 0.0028329 k( 48) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028329 k( 49) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028329 k( 50) = ( 0.5032942 0.5032942 0.0242704), wk = 0.0028329 k( 51) = ( 0.5065883 0.5065883 0.0485408), wk = 0.0028329 k( 52) = ( 0.5098825 0.5098825 0.0728112), wk = 0.0028329 k( 53) = ( 0.5131767 0.5131767 0.0970815), wk = 0.0028329 k( 54) = ( 0.5164709 0.5164709 0.1213519), wk = 0.0028329 k( 55) = ( 0.5197650 0.5197650 0.1456223), wk = 0.0028329 k( 56) = ( 0.5230592 0.5230592 0.1698927), wk = 0.0028329 k( 57) = ( 0.5263534 0.5263534 0.1941630), wk = 0.0028329 k( 58) = ( 0.5263534 0.5263534 0.1941630), wk = 0.0028329 k( 59) = ( 0.5245965 0.5245965 0.2145522), wk = 0.0028329 k( 60) = ( 0.5228396 0.5228396 0.2349413), wk = 0.0028329 k( 61) = ( 0.5210827 0.5210827 0.2553304), wk = 0.0028329 k( 62) = ( 0.5193258 0.5193258 0.2757196), wk = 0.0028329 k( 63) = ( 0.5175689 0.5175689 0.2961087), wk = 0.0028329 k( 64) = ( 0.5158120 0.5158120 0.3164978), wk = 0.0028329 k( 65) = ( 0.5140551 0.5140551 0.3368870), wk = 0.0028329 k( 66) = ( 0.5122982 0.5122982 0.3572761), wk = 0.0028329 k( 67) = ( 0.5105414 0.5105413 0.3776652), wk = 0.0028329 k( 68) = ( 0.5087845 0.5087845 0.3980543), wk = 0.0028329 k( 69) = ( 0.5070276 0.5070276 0.4184435), wk = 0.0028329 k( 70) = ( 0.5052707 0.5052707 0.4388326), wk = 0.0028329 k( 71) = ( 0.5035138 0.5035138 0.4592217), wk = 0.0028329 k( 72) = ( 0.5017569 0.5017569 0.4796109), wk = 0.0028329 k( 73) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 74) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028329 k( 75) = ( 0.5070713 0.4929287 0.5000000), wk = 0.0028329 k( 76) = ( 0.5141427 0.4858574 0.5000000), wk = 0.0028329 k( 77) = ( 0.5212140 0.4787860 0.5000000), wk = 0.0028329 k( 78) = ( 0.5282853 0.4717147 0.5000000), wk = 0.0028329 k( 79) = ( 0.5353566 0.4646434 0.5000000), wk = 0.0028329 k( 80) = ( 0.5424279 0.4575721 0.5000000), wk = 0.0028329 k( 81) = ( 0.5494993 0.4505007 0.5000000), wk = 0.0028329 k( 82) = ( 0.5565706 0.4434294 0.5000000), wk = 0.0028329 k( 83) = ( 0.5636419 0.4363581 0.5000000), wk = 0.0028329 k( 84) = ( 0.5707132 0.4292868 0.5000000), wk = 0.0028329 k( 85) = ( 0.5777846 0.4222154 0.5000000), wk = 0.0028329 k( 86) = ( 0.5848559 0.4151441 0.5000000), wk = 0.0028329 k( 87) = ( 0.5919272 0.4080728 0.5000000), wk = 0.0028329 k( 88) = ( 0.5989985 0.4010015 0.5000000), wk = 0.0028329 k( 89) = ( 0.6060699 0.3939301 0.5000000), wk = 0.0028329 k( 90) = ( 0.6131412 0.3868588 0.5000000), wk = 0.0028329 k( 91) = ( 0.6202125 0.3797875 0.5000000), wk = 0.0028329 k( 92) = ( 0.6272838 0.3727162 0.5000000), wk = 0.0028329 k( 93) = ( 0.6343551 0.3656449 0.5000000), wk = 0.0028329 k( 94) = ( 0.6414265 0.3585735 0.5000000), wk = 0.0028329 k( 95) = ( 0.6484978 0.3515022 0.5000000), wk = 0.0028329 k( 96) = ( 0.6555691 0.3444309 0.5000000), wk = 0.0028329 k( 97) = ( 0.6626405 0.3373595 0.5000000), wk = 0.0028329 k( 98) = ( 0.6697118 0.3302882 0.5000000), wk = 0.0028329 k( 99) = ( 0.3302882 -0.3302882 0.5000000), wk = 0.0028329 k( 100) = ( 0.3232608 -0.3232608 0.5000000), wk = 0.0028329 k( 101) = ( 0.3162334 -0.3162334 0.5000000), wk = 0.0028329 k( 102) = ( 0.3092060 -0.3092060 0.5000000), wk = 0.0028329 k( 103) = ( 0.3021786 -0.3021786 0.5000000), wk = 0.0028329 k( 104) = ( 0.2951512 -0.2951512 0.5000000), wk = 0.0028329 k( 105) = ( 0.2881238 -0.2881238 0.5000000), wk = 0.0028329 k( 106) = ( 0.2810964 -0.2810964 0.5000000), wk = 0.0028329 k( 107) = ( 0.2740690 -0.2740690 0.5000000), wk = 0.0028329 k( 108) = ( 0.2670416 -0.2670415 0.5000000), wk = 0.0028329 k( 109) = ( 0.2600141 -0.2600141 0.5000000), wk = 0.0028329 k( 110) = ( 0.2529867 -0.2529867 0.5000000), wk = 0.0028329 k( 111) = ( 0.2459593 -0.2459593 0.5000000), wk = 0.0028329 k( 112) = ( 0.2389319 -0.2389319 0.5000000), wk = 0.0028329 k( 113) = ( 0.2319045 -0.2319045 0.5000000), wk = 0.0028329 k( 114) = ( 0.2248771 -0.2248771 0.5000000), wk = 0.0028329 k( 115) = ( 0.2178497 -0.2178497 0.5000000), wk = 0.0028329 k( 116) = ( 0.2108223 -0.2108223 0.5000000), wk = 0.0028329 k( 117) = ( 0.2037949 -0.2037949 0.5000000), wk = 0.0028329 k( 118) = ( 0.1967675 -0.1967675 0.5000000), wk = 0.0028329 k( 119) = ( 0.1897400 -0.1897400 0.5000000), wk = 0.0028329 k( 120) = ( 0.1827126 -0.1827126 0.5000000), wk = 0.0028329 k( 121) = ( 0.1756852 -0.1756852 0.5000000), wk = 0.0028329 k( 122) = ( 0.1686578 -0.1686578 0.5000000), wk = 0.0028329 k( 123) = ( 0.1616304 -0.1616304 0.5000000), wk = 0.0028329 k( 124) = ( 0.1546030 -0.1546030 0.5000000), wk = 0.0028329 k( 125) = ( 0.1475756 -0.1475756 0.5000000), wk = 0.0028329 k( 126) = ( 0.1405482 -0.1405482 0.5000000), wk = 0.0028329 k( 127) = ( 0.1335208 -0.1335208 0.5000000), wk = 0.0028329 k( 128) = ( 0.1264934 -0.1264934 0.5000000), wk = 0.0028329 k( 129) = ( 0.1194660 -0.1194660 0.5000000), wk = 0.0028329 k( 130) = ( 0.1124385 -0.1124385 0.5000000), wk = 0.0028329 k( 131) = ( 0.1054111 -0.1054111 0.5000000), wk = 0.0028329 k( 132) = ( 0.0983837 -0.0983837 0.5000000), wk = 0.0028329 k( 133) = ( 0.0913563 -0.0913563 0.5000000), wk = 0.0028329 k( 134) = ( 0.0843289 -0.0843289 0.5000000), wk = 0.0028329 k( 135) = ( 0.0773015 -0.0773015 0.5000000), wk = 0.0028329 k( 136) = ( 0.0702741 -0.0702741 0.5000000), wk = 0.0028329 k( 137) = ( 0.0632467 -0.0632467 0.5000000), wk = 0.0028329 k( 138) = ( 0.0562193 -0.0562193 0.5000000), wk = 0.0028329 k( 139) = ( 0.0491919 -0.0491919 0.5000000), wk = 0.0028329 k( 140) = ( 0.0421644 -0.0421644 0.5000000), wk = 0.0028329 k( 141) = ( 0.0351371 -0.0351370 0.5000000), wk = 0.0028329 k( 142) = ( 0.0281096 -0.0281096 0.5000000), wk = 0.0028329 k( 143) = ( 0.0210822 -0.0210822 0.5000000), wk = 0.0028329 k( 144) = ( 0.0140548 -0.0140548 0.5000000), wk = 0.0028329 k( 145) = ( 0.0070274 -0.0070274 0.5000000), wk = 0.0028329 k( 146) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028329 k( 147) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028329 k( 148) = ( 0.0110150 0.0110150 0.5071125), wk = 0.0028329 k( 149) = ( 0.0220301 0.0220301 0.5142250), wk = 0.0028329 k( 150) = ( 0.0330451 0.0330451 0.5213375), wk = 0.0028329 k( 151) = ( 0.0440601 0.0440601 0.5284499), wk = 0.0028329 k( 152) = ( 0.0550752 0.0550752 0.5355624), wk = 0.0028329 k( 153) = ( 0.0660902 0.0660902 0.5426749), wk = 0.0028329 k( 154) = ( 0.0771053 0.0771053 0.5497874), wk = 0.0028329 k( 155) = ( 0.0881203 0.0881203 0.5568999), wk = 0.0028329 k( 156) = ( 0.0991353 0.0991353 0.5640124), wk = 0.0028329 k( 157) = ( 0.1101504 0.1101504 0.5711249), wk = 0.0028329 k( 158) = ( 0.1211654 0.1211654 0.5782374), wk = 0.0028329 k( 159) = ( 0.1321805 0.1321804 0.5853498), wk = 0.0028329 k( 160) = ( 0.1431955 0.1431955 0.5924623), wk = 0.0028329 k( 161) = ( 0.1542105 0.1542105 0.5995748), wk = 0.0028329 k( 162) = ( 0.1652256 0.1652256 0.6066873), wk = 0.0028329 k( 163) = ( 0.1762406 0.1762406 0.6137998), wk = 0.0028329 k( 164) = ( 0.1872556 0.1872556 0.6209123), wk = 0.0028329 k( 165) = ( 0.1982707 0.1982707 0.6280248), wk = 0.0028329 k( 166) = ( 0.2092857 0.2092857 0.6351373), wk = 0.0028329 k( 167) = ( 0.2203008 0.2203008 0.6422497), wk = 0.0028329 k( 168) = ( 0.2313158 0.2313158 0.6493622), wk = 0.0028329 k( 169) = ( 0.2423308 0.2423308 0.6564747), wk = 0.0028329 k( 170) = ( 0.2533459 0.2533459 0.6635872), wk = 0.0028329 k( 171) = ( 0.2643609 0.2643609 0.6706997), wk = 0.0028329 k( 172) = ( 0.2753759 0.2753759 0.6778122), wk = 0.0028329 k( 173) = ( 0.2863910 0.2863910 0.6849247), wk = 0.0028329 k( 174) = ( 0.2974060 0.2974060 0.6920371), wk = 0.0028329 k( 175) = ( 0.3084211 0.3084211 0.6991496), wk = 0.0028329 k( 176) = ( 0.3194361 0.3194361 0.7062621), wk = 0.0028329 k( 177) = ( 0.3304511 0.3304511 0.7133746), wk = 0.0028329 k( 178) = ( 0.3414662 0.3414662 0.7204871), wk = 0.0028329 k( 179) = ( 0.3524812 0.3524812 0.7275996), wk = 0.0028329 k( 180) = ( 0.3634963 0.3634962 0.7347121), wk = 0.0028329 k( 181) = ( 0.3745113 0.3745113 0.7418246), wk = 0.0028329 k( 182) = ( 0.3855263 0.3855263 0.7489370), wk = 0.0028329 k( 183) = ( 0.3965414 0.3965414 0.7560495), wk = 0.0028329 k( 184) = ( 0.4075564 0.4075564 0.7631620), wk = 0.0028329 k( 185) = ( 0.4185714 0.4185714 0.7702745), wk = 0.0028329 k( 186) = ( 0.4295865 0.4295865 0.7773870), wk = 0.0028329 k( 187) = ( 0.4406015 0.4406015 0.7844995), wk = 0.0028329 k( 188) = ( 0.4516166 0.4516166 0.7916120), wk = 0.0028329 k( 189) = ( 0.4626316 0.4626316 0.7987245), wk = 0.0028329 k( 190) = ( 0.4736466 0.4736466 0.8058369), wk = 0.0028329 k( 191) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0028329 k( 192) = ( 0.5069898 0.4930102 -0.0000000), wk = 0.0028329 k( 193) = ( 0.5139796 0.4860204 -0.0000000), wk = 0.0028329 k( 194) = ( 0.5209694 0.4790305 -0.0000000), wk = 0.0028329 k( 195) = ( 0.5279593 0.4720407 -0.0000000), wk = 0.0028329 k( 196) = ( 0.5349491 0.4650509 -0.0000000), wk = 0.0028329 k( 197) = ( 0.5419389 0.4580611 -0.0000000), wk = 0.0028329 k( 198) = ( 0.5489287 0.4510713 0.0000000), wk = 0.0028329 k( 199) = ( 0.5559185 0.4440815 -0.0000000), wk = 0.0028329 k( 200) = ( 0.5629083 0.4370917 -0.0000000), wk = 0.0028329 k( 201) = ( 0.5698981 0.4301019 0.0000000), wk = 0.0028329 k( 202) = ( 0.5768880 0.4231120 0.0000000), wk = 0.0028329 k( 203) = ( 0.5838778 0.4161222 -0.0000000), wk = 0.0028329 k( 204) = ( 0.5908676 0.4091324 -0.0000000), wk = 0.0028329 k( 205) = ( 0.5978574 0.4021426 -0.0000000), wk = 0.0028329 k( 206) = ( 0.6048472 0.3951528 -0.0000000), wk = 0.0028329 k( 207) = ( 0.6118370 0.3881630 -0.0000000), wk = 0.0028329 k( 208) = ( 0.6188269 0.3811731 -0.0000000), wk = 0.0028329 k( 209) = ( 0.6258167 0.3741833 -0.0000000), wk = 0.0028329 k( 210) = ( 0.6328065 0.3671935 0.0000000), wk = 0.0028329 k( 211) = ( 0.6397963 0.3602037 0.0000000), wk = 0.0028329 k( 212) = ( 0.3602037 -0.3602037 0.0000000), wk = 0.0028329 k( 213) = ( 0.3531409 -0.3531409 -0.0000000), wk = 0.0028329 k( 214) = ( 0.3460781 -0.3460781 -0.0000000), wk = 0.0028329 k( 215) = ( 0.3390152 -0.3390152 0.0000000), wk = 0.0028329 k( 216) = ( 0.3319524 -0.3319524 0.0000000), wk = 0.0028329 k( 217) = ( 0.3248896 -0.3248896 0.0000000), wk = 0.0028329 k( 218) = ( 0.3178268 -0.3178268 -0.0000000), wk = 0.0028329 k( 219) = ( 0.3107640 -0.3107640 -0.0000000), wk = 0.0028329 k( 220) = ( 0.3037012 -0.3037012 -0.0000000), wk = 0.0028329 k( 221) = ( 0.2966383 -0.2966383 -0.0000000), wk = 0.0028329 k( 222) = ( 0.2895755 -0.2895755 -0.0000000), wk = 0.0028329 k( 223) = ( 0.2825127 -0.2825127 -0.0000000), wk = 0.0028329 k( 224) = ( 0.2754499 -0.2754499 -0.0000000), wk = 0.0028329 k( 225) = ( 0.2683871 -0.2683871 -0.0000000), wk = 0.0028329 k( 226) = ( 0.2613242 -0.2613242 0.0000000), wk = 0.0028329 k( 227) = ( 0.2542614 -0.2542614 0.0000000), wk = 0.0028329 k( 228) = ( 0.2471986 -0.2471986 -0.0000000), wk = 0.0028329 k( 229) = ( 0.2401358 -0.2401358 0.0000000), wk = 0.0028329 k( 230) = ( 0.2330730 -0.2330730 -0.0000000), wk = 0.0028329 k( 231) = ( 0.2260102 -0.2260102 0.0000000), wk = 0.0028329 k( 232) = ( 0.2189474 -0.2189474 -0.0000000), wk = 0.0028329 k( 233) = ( 0.2118845 -0.2118845 -0.0000000), wk = 0.0028329 k( 234) = ( 0.2048217 -0.2048217 0.0000000), wk = 0.0028329 k( 235) = ( 0.1977589 -0.1977589 0.0000000), wk = 0.0028329 k( 236) = ( 0.1906961 -0.1906961 -0.0000000), wk = 0.0028329 k( 237) = ( 0.1836333 -0.1836333 -0.0000000), wk = 0.0028329 k( 238) = ( 0.1765704 -0.1765704 -0.0000000), wk = 0.0028329 k( 239) = ( 0.1695076 -0.1695076 0.0000000), wk = 0.0028329 k( 240) = ( 0.1624448 -0.1624448 0.0000000), wk = 0.0028329 k( 241) = ( 0.1553820 -0.1553820 -0.0000000), wk = 0.0028329 k( 242) = ( 0.1483192 -0.1483192 -0.0000000), wk = 0.0028329 k( 243) = ( 0.1412564 -0.1412564 -0.0000000), wk = 0.0028329 k( 244) = ( 0.1341935 -0.1341935 -0.0000000), wk = 0.0028329 k( 245) = ( 0.1271307 -0.1271307 0.0000000), wk = 0.0028329 k( 246) = ( 0.1200679 -0.1200679 0.0000000), wk = 0.0028329 k( 247) = ( 0.1130051 -0.1130051 0.0000000), wk = 0.0028329 k( 248) = ( 0.1059423 -0.1059423 0.0000000), wk = 0.0028329 k( 249) = ( 0.0988794 -0.0988794 0.0000000), wk = 0.0028329 k( 250) = ( 0.0918166 -0.0918166 -0.0000000), wk = 0.0028329 k( 251) = ( 0.0847538 -0.0847538 0.0000000), wk = 0.0028329 k( 252) = ( 0.0776910 -0.0776910 -0.0000000), wk = 0.0028329 k( 253) = ( 0.0706282 -0.0706282 -0.0000000), wk = 0.0028329 k( 254) = ( 0.0635654 -0.0635654 0.0000000), wk = 0.0028329 k( 255) = ( 0.0565025 -0.0565025 0.0000000), wk = 0.0028329 k( 256) = ( 0.0494397 -0.0494397 0.0000000), wk = 0.0028329 k( 257) = ( 0.0423769 -0.0423769 -0.0000000), wk = 0.0028329 k( 258) = ( 0.0353141 -0.0353141 -0.0000000), wk = 0.0028329 k( 259) = ( 0.0282513 -0.0282513 0.0000000), wk = 0.0028329 k( 260) = ( 0.0211885 -0.0211885 -0.0000000), wk = 0.0028329 k( 261) = ( 0.0141256 -0.0141256 0.0000000), wk = 0.0028329 k( 262) = ( 0.0070628 -0.0070628 0.0000000), wk = 0.0028329 k( 263) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 264) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 k( 265) = ( 0.0116279 -0.0000000 -0.0000000), wk = 0.0028329 k( 266) = ( 0.0232558 0.0000000 0.0000000), wk = 0.0028329 k( 267) = ( 0.0348837 0.0000000 0.0000000), wk = 0.0028329 k( 268) = ( 0.0465116 0.0000000 0.0000000), wk = 0.0028329 k( 269) = ( 0.0581395 0.0000000 -0.0000000), wk = 0.0028329 k( 270) = ( 0.0697674 0.0000000 0.0000000), wk = 0.0028329 k( 271) = ( 0.0813954 0.0000000 -0.0000000), wk = 0.0028329 k( 272) = ( 0.0930233 0.0000000 0.0000000), wk = 0.0028329 k( 273) = ( 0.1046512 0.0000000 -0.0000000), wk = 0.0028329 k( 274) = ( 0.1162791 0.0000000 0.0000000), wk = 0.0028329 k( 275) = ( 0.1279070 0.0000000 0.0000000), wk = 0.0028329 k( 276) = ( 0.1395349 0.0000000 0.0000000), wk = 0.0028329 k( 277) = ( 0.1511628 0.0000000 0.0000000), wk = 0.0028329 k( 278) = ( 0.1627907 0.0000000 -0.0000000), wk = 0.0028329 k( 279) = ( 0.1744186 0.0000000 0.0000000), wk = 0.0028329 k( 280) = ( 0.1860465 0.0000000 0.0000000), wk = 0.0028329 k( 281) = ( 0.1976744 0.0000000 -0.0000000), wk = 0.0028329 k( 282) = ( 0.2093023 0.0000000 -0.0000000), wk = 0.0028329 k( 283) = ( 0.2209302 0.0000000 -0.0000000), wk = 0.0028329 k( 284) = ( 0.2325581 0.0000000 0.0000000), wk = 0.0028329 k( 285) = ( 0.2441860 0.0000000 0.0000000), wk = 0.0028329 k( 286) = ( 0.2558140 0.0000000 -0.0000000), wk = 0.0028329 k( 287) = ( 0.2674419 -0.0000000 -0.0000000), wk = 0.0028329 k( 288) = ( 0.2790698 0.0000000 0.0000000), wk = 0.0028329 k( 289) = ( 0.2906977 -0.0000000 -0.0000000), wk = 0.0028329 k( 290) = ( 0.3023256 0.0000000 0.0000000), wk = 0.0028329 k( 291) = ( 0.3139535 0.0000000 -0.0000000), wk = 0.0028329 k( 292) = ( 0.3255814 0.0000000 -0.0000000), wk = 0.0028329 k( 293) = ( 0.3372093 -0.0000000 -0.0000000), wk = 0.0028329 k( 294) = ( 0.3488372 -0.0000000 -0.0000000), wk = 0.0028329 k( 295) = ( 0.3604651 0.0000000 -0.0000000), wk = 0.0028329 k( 296) = ( 0.3720930 0.0000000 0.0000000), wk = 0.0028329 k( 297) = ( 0.3837209 0.0000000 0.0000000), wk = 0.0028329 k( 298) = ( 0.3953488 0.0000000 -0.0000000), wk = 0.0028329 k( 299) = ( 0.4069767 0.0000000 -0.0000000), wk = 0.0028329 k( 300) = ( 0.4186047 -0.0000000 0.0000000), wk = 0.0028329 k( 301) = ( 0.4302326 0.0000000 0.0000000), wk = 0.0028329 k( 302) = ( 0.4418605 -0.0000000 -0.0000000), wk = 0.0028329 k( 303) = ( 0.4534884 0.0000000 0.0000000), wk = 0.0028329 k( 304) = ( 0.4651163 0.0000000 0.0000000), wk = 0.0028329 k( 305) = ( 0.4767442 0.0000000 -0.0000000), wk = 0.0028329 k( 306) = ( 0.4883721 0.0000000 0.0000000), wk = 0.0028329 k( 307) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0028329 k( 308) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028329 k( 309) = ( 0.4888889 -0.0000000 0.4888889), wk = 0.0028329 k( 310) = ( 0.4777778 0.0000000 0.4777778), wk = 0.0028329 k( 311) = ( 0.4666667 0.0000000 0.4666667), wk = 0.0028329 k( 312) = ( 0.4555556 0.0000000 0.4555556), wk = 0.0028329 k( 313) = ( 0.4444444 -0.0000000 0.4444444), wk = 0.0028329 k( 314) = ( 0.4333333 0.0000000 0.4333333), wk = 0.0028329 k( 315) = ( 0.4222222 0.0000000 0.4222222), wk = 0.0028329 k( 316) = ( 0.4111111 0.0000000 0.4111111), wk = 0.0028329 k( 317) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0028329 k( 318) = ( 0.3888889 -0.0000000 0.3888889), wk = 0.0028329 k( 319) = ( 0.3777778 -0.0000000 0.3777778), wk = 0.0028329 k( 320) = ( 0.3666667 0.0000000 0.3666667), wk = 0.0028329 k( 321) = ( 0.3555556 0.0000000 0.3555556), wk = 0.0028329 k( 322) = ( 0.3444444 -0.0000000 0.3444444), wk = 0.0028329 k( 323) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0028329 k( 324) = ( 0.3222222 0.0000000 0.3222222), wk = 0.0028329 k( 325) = ( 0.3111111 0.0000000 0.3111111), wk = 0.0028329 k( 326) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0028329 k( 327) = ( 0.2888889 0.0000000 0.2888889), wk = 0.0028329 k( 328) = ( 0.2777778 0.0000000 0.2777778), wk = 0.0028329 k( 329) = ( 0.2666667 0.0000000 0.2666667), wk = 0.0028329 k( 330) = ( 0.2555556 0.0000000 0.2555556), wk = 0.0028329 k( 331) = ( 0.2444444 0.0000000 0.2444444), wk = 0.0028329 k( 332) = ( 0.2333333 0.0000000 0.2333333), wk = 0.0028329 k( 333) = ( 0.2222222 -0.0000000 0.2222222), wk = 0.0028329 k( 334) = ( 0.2111111 0.0000000 0.2111111), wk = 0.0028329 k( 335) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0028329 k( 336) = ( 0.1888889 -0.0000000 0.1888889), wk = 0.0028329 k( 337) = ( 0.1777778 0.0000000 0.1777778), wk = 0.0028329 k( 338) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0028329 k( 339) = ( 0.1555556 -0.0000000 0.1555556), wk = 0.0028329 k( 340) = ( 0.1444444 0.0000000 0.1444444), wk = 0.0028329 k( 341) = ( 0.1333333 -0.0000000 0.1333333), wk = 0.0028329 k( 342) = ( 0.1222222 0.0000000 0.1222222), wk = 0.0028329 k( 343) = ( 0.1111111 -0.0000000 0.1111111), wk = 0.0028329 k( 344) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0028329 k( 345) = ( 0.0888889 0.0000000 0.0888889), wk = 0.0028329 k( 346) = ( 0.0777778 -0.0000000 0.0777778), wk = 0.0028329 k( 347) = ( 0.0666667 0.0000000 0.0666667), wk = 0.0028329 k( 348) = ( 0.0555556 0.0000000 0.0555556), wk = 0.0028329 k( 349) = ( 0.0444444 0.0000000 0.0444444), wk = 0.0028329 k( 350) = ( 0.0333333 -0.0000000 0.0333333), wk = 0.0028329 k( 351) = ( 0.0222222 0.0000000 0.0222222), wk = 0.0028329 k( 352) = ( 0.0111111 0.0000000 0.0111111), wk = 0.0028329 k( 353) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028329 Dense grid: 77895 G-vectors FFT dimensions: ( 45, 45, 90) Smooth grid: 27623 G-vectors FFT dimensions: ( 36, 36, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.13 Mb ( 188, 44) NL pseudopotentials 0.18 Mb ( 94, 124) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2167) G-vector shells 0.02 Mb ( 2044) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.50 Mb ( 188, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.17 Mb ( 124, 2, 44) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./SrC2.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.4 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 4.1 secs Computing kpt #: 4 total cpu time spent up to now is 4.4 secs Computing kpt #: 5 total cpu time spent up to now is 4.8 secs Computing kpt #: 6 total cpu time spent up to now is 5.1 secs Computing kpt #: 7 total cpu time spent up to now is 5.4 secs Computing kpt #: 8 total cpu time spent up to now is 5.7 secs Computing kpt #: 9 total cpu time spent up to now is 6.0 secs Computing kpt #: 10 total cpu time spent up to now is 6.2 secs Computing kpt #: 11 total cpu time spent up to now is 6.5 secs Computing kpt #: 12 total cpu time spent up to now is 6.8 secs Computing kpt #: 13 total cpu time spent up to now is 7.1 secs Computing kpt #: 14 total cpu time spent up to now is 7.4 secs Computing kpt #: 15 total cpu time spent up to now is 7.7 secs Computing kpt #: 16 total cpu time spent up to now is 8.0 secs Computing kpt #: 17 total cpu time spent up to now is 8.3 secs Computing kpt #: 18 total cpu time spent up to now is 9.4 secs Computing kpt #: 19 total cpu time spent up to now is 9.7 secs Computing kpt #: 20 total cpu time spent up to now is 10.0 secs Computing kpt #: 21 total cpu time spent up to now is 10.3 secs Computing kpt #: 22 total cpu time spent up to now is 10.6 secs Computing kpt #: 23 total cpu time spent up to now is 10.9 secs Computing kpt #: 24 total cpu time spent up to now is 11.2 secs Computing kpt #: 25 total cpu time spent up to now is 11.5 secs Computing kpt #: 26 total cpu time spent up to now is 11.8 secs Computing kpt #: 27 total cpu time spent up to now is 12.1 secs Computing kpt #: 28 total cpu time spent up to now is 12.4 secs Computing kpt #: 29 total cpu time spent up to now is 12.7 secs Computing kpt #: 30 total cpu time spent up to now is 13.0 secs Computing kpt #: 31 total cpu time spent up to now is 13.3 secs Computing kpt #: 32 total cpu time spent up to now is 13.6 secs Computing kpt #: 33 total cpu time spent up to now is 13.9 secs Computing kpt #: 34 total cpu time spent up to now is 14.2 secs Computing kpt #: 35 total cpu time spent up to now is 14.5 secs Computing kpt #: 36 total cpu time spent up to now is 14.8 secs Computing kpt #: 37 total cpu time spent up to now is 15.1 secs Computing kpt #: 38 total cpu time spent up to now is 15.4 secs Computing kpt #: 39 total cpu time spent up to now is 15.7 secs Computing kpt #: 40 total cpu time spent up to now is 16.1 secs Computing kpt #: 41 total cpu time spent up to now is 16.4 secs Computing kpt #: 42 total cpu time spent up to now is 16.7 secs Computing kpt #: 43 total cpu time spent up to now is 17.0 secs Computing kpt #: 44 total cpu time spent up to now is 17.4 secs Computing kpt #: 45 total cpu time spent up to now is 17.7 secs Computing kpt #: 46 total cpu time spent up to now is 18.1 secs Computing kpt #: 47 total cpu time spent up to now is 18.5 secs Computing kpt #: 48 total cpu time spent up to now is 18.9 secs Computing kpt #: 49 total cpu time spent up to now is 19.2 secs Computing kpt #: 50 total cpu time spent up to now is 19.6 secs Computing kpt #: 51 total cpu time spent up to now is 20.0 secs Computing kpt #: 52 total cpu time spent up to now is 20.3 secs Computing kpt #: 53 total cpu time spent up to now is 20.7 secs Computing kpt #: 54 total cpu time spent up to now is 21.0 secs Computing kpt #: 55 total cpu time spent up to now is 21.3 secs Computing kpt #: 56 total cpu time spent up to now is 21.6 secs Computing kpt #: 57 total cpu time spent up to now is 21.9 secs Computing kpt #: 58 total cpu time spent up to now is 22.2 secs Computing kpt #: 59 total cpu time spent up to now is 22.5 secs Computing kpt #: 60 total cpu time spent up to now is 22.8 secs Computing kpt #: 61 total cpu time spent up to now is 23.1 secs Computing kpt #: 62 total cpu time spent up to now is 23.4 secs Computing kpt #: 63 total cpu time spent up to now is 23.7 secs Computing kpt #: 64 total cpu time spent up to now is 24.0 secs Computing kpt #: 65 total cpu time spent up to now is 24.3 secs Computing kpt #: 66 total cpu time spent up to now is 24.7 secs Computing kpt #: 67 total cpu time spent up to now is 25.0 secs Computing kpt #: 68 total cpu time spent up to now is 25.3 secs Computing kpt #: 69 total cpu time spent up to now is 25.6 secs Computing kpt #: 70 total cpu time spent up to now is 25.9 secs Computing kpt #: 71 total cpu time spent up to now is 26.2 secs Computing kpt #: 72 total cpu time spent up to now is 26.5 secs Computing kpt #: 73 total cpu time spent up to now is 26.8 secs Computing kpt #: 74 total cpu time spent up to now is 27.1 secs Computing kpt #: 75 total cpu time spent up to now is 27.4 secs Computing kpt #: 76 total cpu time spent up to now is 27.7 secs Computing kpt #: 77 total cpu time spent up to now is 28.0 secs Computing kpt #: 78 total cpu time spent up to now is 28.3 secs Computing kpt #: 79 total cpu time spent up to now is 28.6 secs Computing kpt #: 80 total cpu time spent up to now is 28.9 secs Computing kpt #: 81 total cpu time spent up to now is 29.2 secs Computing kpt #: 82 total cpu time spent up to now is 29.5 secs Computing kpt #: 83 total cpu time spent up to now is 29.8 secs Computing kpt #: 84 total cpu time spent up to now is 30.1 secs Computing kpt #: 85 total cpu time spent up to now is 30.4 secs Computing kpt #: 86 total cpu time spent up to now is 30.7 secs Computing kpt #: 87 total cpu time spent up to now is 31.0 secs Computing kpt #: 88 total cpu time spent up to now is 31.3 secs Computing kpt #: 89 total cpu time spent up to now is 31.6 secs Computing kpt #: 90 total cpu time spent up to now is 31.9 secs Computing kpt #: 91 total cpu time spent up to now is 32.2 secs Computing kpt #: 92 total cpu time spent up to now is 32.5 secs Computing kpt #: 93 total cpu time spent up to now is 32.9 secs Computing kpt #: 94 total cpu time spent up to now is 33.2 secs Computing kpt #: 95 total cpu time spent up to now is 33.5 secs Computing kpt #: 96 total cpu time spent up to now is 33.8 secs Computing kpt #: 97 total cpu time spent up to now is 34.1 secs Computing kpt #: 98 total cpu time spent up to now is 34.4 secs Computing kpt #: 99 total cpu time spent up to now is 34.7 secs Computing kpt #: 100 total cpu time spent up to now is 35.1 secs Computing kpt #: 101 total cpu time spent up to now is 35.4 secs Computing kpt #: 102 total cpu time spent up to now is 35.7 secs Computing kpt #: 103 total cpu time spent up to now is 36.0 secs Computing kpt #: 104 total cpu time spent up to now is 36.4 secs Computing kpt #: 105 total cpu time spent up to now is 36.7 secs Computing kpt #: 106 total cpu time spent up to now is 37.0 secs Computing kpt #: 107 total cpu time spent up to now is 37.4 secs Computing kpt #: 108 total cpu time spent up to now is 37.7 secs Computing kpt #: 109 total cpu time spent up to now is 38.0 secs Computing kpt #: 110 total cpu time spent up to now is 38.4 secs Computing kpt #: 111 total cpu time spent up to now is 38.7 secs Computing kpt #: 112 total cpu time spent up to now is 39.1 secs Computing kpt #: 113 total cpu time spent up to now is 39.4 secs Computing kpt #: 114 total cpu time spent up to now is 39.8 secs Computing kpt #: 115 total cpu time spent up to now is 40.1 secs Computing kpt #: 116 total cpu time spent up to now is 40.4 secs Computing kpt #: 117 total cpu time spent up to now is 40.7 secs Computing kpt #: 118 total cpu time spent up to now is 41.1 secs Computing kpt #: 119 total cpu time spent up to now is 41.4 secs Computing kpt #: 120 total cpu time spent up to now is 41.7 secs Computing kpt #: 121 total cpu time spent up to now is 42.0 secs Computing kpt #: 122 total cpu time spent up to now is 42.3 secs Computing kpt #: 123 total cpu time spent up to now is 42.6 secs Computing kpt #: 124 total cpu time spent up to now is 42.9 secs Computing kpt #: 125 total cpu time spent up to now is 43.2 secs Computing kpt #: 126 total cpu time spent up to now is 43.7 secs Computing kpt #: 127 total cpu time spent up to now is 44.0 secs Computing kpt #: 128 total cpu time spent up to now is 44.3 secs Computing kpt #: 129 total cpu time spent up to now is 44.6 secs Computing kpt #: 130 total cpu time spent up to now is 44.9 secs Computing kpt #: 131 total cpu time spent up to now is 45.2 secs Computing kpt #: 132 total cpu time spent up to now is 45.5 secs Computing kpt #: 133 total cpu time spent up to now is 45.9 secs Computing kpt #: 134 total cpu time spent up to now is 46.2 secs Computing kpt #: 135 total cpu time spent up to now is 46.5 secs Computing kpt #: 136 total cpu time spent up to now is 46.8 secs Computing kpt #: 137 total cpu time spent up to now is 47.1 secs Computing kpt #: 138 total cpu time spent up to now is 47.4 secs Computing kpt #: 139 total cpu time spent up to now is 47.7 secs Computing kpt #: 140 total cpu time spent up to now is 48.0 secs Computing kpt #: 141 total cpu time spent up to now is 48.3 secs Computing kpt #: 142 total cpu time spent up to now is 48.6 secs Computing kpt #: 143 total cpu time spent up to now is 48.9 secs Computing kpt #: 144 total cpu time spent up to now is 49.2 secs Computing kpt #: 145 total cpu time spent up to now is 49.5 secs Computing kpt #: 146 total cpu time spent up to now is 49.8 secs Computing kpt #: 147 total cpu time spent up to now is 50.1 secs Computing kpt #: 148 total cpu time spent up to now is 50.4 secs Computing kpt #: 149 total cpu time spent up to now is 50.7 secs Computing kpt #: 150 total cpu time spent up to now is 51.0 secs Computing kpt #: 151 total cpu time spent up to now is 51.3 secs Computing kpt #: 152 total cpu time spent up to now is 51.6 secs Computing kpt #: 153 total cpu time spent up to now is 51.9 secs Computing kpt #: 154 total cpu time spent up to now is 52.2 secs Computing kpt #: 155 total cpu time spent up to now is 52.5 secs Computing kpt #: 156 total cpu time spent up to now is 52.8 secs Computing kpt #: 157 total cpu time spent up to now is 53.1 secs Computing kpt #: 158 total cpu time spent up to now is 53.4 secs Computing kpt #: 159 total cpu time spent up to now is 53.7 secs Computing kpt #: 160 total cpu time spent up to now is 54.1 secs Computing kpt #: 161 total cpu time spent up to now is 54.4 secs Computing kpt #: 162 total cpu time spent up to now is 54.7 secs Computing kpt #: 163 total cpu time spent up to now is 55.0 secs Computing kpt #: 164 total cpu time spent up to now is 55.3 secs Computing kpt #: 165 total cpu time spent up to now is 55.6 secs Computing kpt #: 166 total cpu time spent up to now is 55.9 secs Computing kpt #: 167 total cpu time spent up to now is 56.3 secs Computing kpt #: 168 total cpu time spent up to now is 56.6 secs Computing kpt #: 169 total cpu time spent up to now is 56.9 secs Computing kpt #: 170 total cpu time spent up to now is 57.2 secs Computing kpt #: 171 total cpu time spent up to now is 57.6 secs Computing kpt #: 172 total cpu time spent up to now is 57.9 secs Computing kpt #: 173 total cpu time spent up to now is 58.3 secs Computing kpt #: 174 total cpu time spent up to now is 58.6 secs Computing kpt #: 175 total cpu time spent up to now is 59.0 secs Computing kpt #: 176 total cpu time spent up to now is 59.4 secs Computing kpt #: 177 total cpu time spent up to now is 59.8 secs Computing kpt #: 178 total cpu time spent up to now is 60.1 secs Computing kpt #: 179 total cpu time spent up to now is 60.5 secs Computing kpt #: 180 total cpu time spent up to now is 60.9 secs Computing kpt #: 181 total cpu time spent up to now is 61.2 secs Computing kpt #: 182 total cpu time spent up to now is 61.6 secs Computing kpt #: 183 total cpu time spent up to now is 61.9 secs Computing kpt #: 184 total cpu time spent up to now is 62.2 secs Computing kpt #: 185 total cpu time spent up to now is 62.5 secs Computing kpt #: 186 total cpu time spent up to now is 62.8 secs Computing kpt #: 187 total cpu time spent up to now is 63.1 secs Computing kpt #: 188 total cpu time spent up to now is 63.4 secs Computing kpt #: 189 total cpu time spent up to now is 63.7 secs Computing kpt #: 190 total cpu time spent up to now is 64.0 secs Computing kpt #: 191 total cpu time spent up to now is 64.4 secs Computing kpt #: 192 total cpu time spent up to now is 64.8 secs Computing kpt #: 193 total cpu time spent up to now is 65.1 secs Computing kpt #: 194 total cpu time spent up to now is 65.4 secs Computing kpt #: 195 total cpu time spent up to now is 65.7 secs Computing kpt #: 196 total cpu time spent up to now is 66.0 secs Computing kpt #: 197 total cpu time spent up to now is 66.3 secs Computing kpt #: 198 total cpu time spent up to now is 66.7 secs Computing kpt #: 199 total cpu time spent up to now is 67.0 secs Computing kpt #: 200 total cpu time spent up to now is 67.3 secs Computing kpt #: 201 total cpu time spent up to now is 67.6 secs Computing kpt #: 202 total cpu time spent up to now is 67.9 secs Computing kpt #: 203 total cpu time spent up to now is 68.2 secs Computing kpt #: 204 total cpu time spent up to now is 68.5 secs Computing kpt #: 205 total cpu time spent up to now is 68.8 secs Computing kpt #: 206 total cpu time spent up to now is 69.1 secs Computing kpt #: 207 total cpu time spent up to now is 69.4 secs Computing kpt #: 208 total cpu time spent up to now is 69.7 secs Computing kpt #: 209 total cpu time spent up to now is 70.0 secs Computing kpt #: 210 total cpu time spent up to now is 70.3 secs Computing kpt #: 211 total cpu time spent up to now is 70.7 secs Computing kpt #: 212 total cpu time spent up to now is 71.0 secs Computing kpt #: 213 total cpu time spent up to now is 71.3 secs Computing kpt #: 214 total cpu time spent up to now is 71.6 secs Computing kpt #: 215 total cpu time spent up to now is 71.9 secs Computing kpt #: 216 total cpu time spent up to now is 72.2 secs Computing kpt #: 217 total cpu time spent up to now is 72.5 secs Computing kpt #: 218 total cpu time spent up to now is 72.8 secs Computing kpt #: 219 total cpu time spent up to now is 73.1 secs Computing kpt #: 220 total cpu time spent up to now is 73.5 secs Computing kpt #: 221 total cpu time spent up to now is 73.8 secs Computing kpt #: 222 total cpu time spent up to now is 74.1 secs Computing kpt #: 223 total cpu time spent up to now is 74.4 secs Computing kpt #: 224 total cpu time spent up to now is 74.7 secs Computing kpt #: 225 total cpu time spent up to now is 75.0 secs Computing kpt #: 226 total cpu time spent up to now is 75.3 secs Computing kpt #: 227 total cpu time spent up to now is 75.6 secs Computing kpt #: 228 total cpu time spent up to now is 75.9 secs Computing kpt #: 229 total cpu time spent up to now is 76.2 secs Computing kpt #: 230 total cpu time spent up to now is 76.5 secs Computing kpt #: 231 total cpu time spent up to now is 76.8 secs Computing kpt #: 232 total cpu time spent up to now is 77.1 secs Computing kpt #: 233 total cpu time spent up to now is 77.4 secs Computing kpt #: 234 total cpu time spent up to now is 77.8 secs Computing kpt #: 235 total cpu time spent up to now is 78.1 secs Computing kpt #: 236 total cpu time spent up to now is 78.7 secs Computing kpt #: 237 total cpu time spent up to now is 79.0 secs Computing kpt #: 238 total cpu time spent up to now is 79.3 secs Computing kpt #: 239 total cpu time spent up to now is 79.6 secs Computing kpt #: 240 total cpu time spent up to now is 80.0 secs Computing kpt #: 241 total cpu time spent up to now is 80.3 secs Computing kpt #: 242 total cpu time spent up to now is 80.6 secs Computing kpt #: 243 total cpu time spent up to now is 80.9 secs Computing kpt #: 244 total cpu time spent up to now is 81.2 secs Computing kpt #: 245 total cpu time spent up to now is 81.5 secs Computing kpt #: 246 total cpu time spent up to now is 81.8 secs Computing kpt #: 247 total cpu time spent up to now is 82.1 secs Computing kpt #: 248 total cpu time spent up to now is 82.5 secs Computing kpt #: 249 total cpu time spent up to now is 82.8 secs Computing kpt #: 250 total cpu time spent up to now is 83.1 secs Computing kpt #: 251 total cpu time spent up to now is 83.4 secs Computing kpt #: 252 total cpu time spent up to now is 83.8 secs Computing kpt #: 253 total cpu time spent up to now is 84.1 secs Computing kpt #: 254 total cpu time spent up to now is 84.4 secs Computing kpt #: 255 total cpu time spent up to now is 84.8 secs Computing kpt #: 256 total cpu time spent up to now is 85.1 secs Computing kpt #: 257 total cpu time spent up to now is 85.4 secs Computing kpt #: 258 total cpu time spent up to now is 85.7 secs Computing kpt #: 259 total cpu time spent up to now is 86.1 secs Computing kpt #: 260 total cpu time spent up to now is 86.4 secs Computing kpt #: 261 total cpu time spent up to now is 86.7 secs Computing kpt #: 262 total cpu time spent up to now is 87.1 secs Computing kpt #: 263 total cpu time spent up to now is 87.4 secs Computing kpt #: 264 total cpu time spent up to now is 87.7 secs Computing kpt #: 265 total cpu time spent up to now is 88.1 secs Computing kpt #: 266 total cpu time spent up to now is 88.4 secs Computing kpt #: 267 total cpu time spent up to now is 88.8 secs Computing kpt #: 268 total cpu time spent up to now is 89.1 secs Computing kpt #: 269 total cpu time spent up to now is 89.4 secs Computing kpt #: 270 total cpu time spent up to now is 89.7 secs Computing kpt #: 271 total cpu time spent up to now is 90.0 secs Computing kpt #: 272 total cpu time spent up to now is 90.4 secs Computing kpt #: 273 total cpu time spent up to now is 90.7 secs Computing kpt #: 274 total cpu time spent up to now is 91.0 secs Computing kpt #: 275 total cpu time spent up to now is 91.3 secs Computing kpt #: 276 total cpu time spent up to now is 91.6 secs Computing kpt #: 277 total cpu time spent up to now is 91.9 secs Computing kpt #: 278 total cpu time spent up to now is 92.2 secs Computing kpt #: 279 total cpu time spent up to now is 92.5 secs Computing kpt #: 280 total cpu time spent up to now is 92.8 secs Computing kpt #: 281 total cpu time spent up to now is 93.1 secs Computing kpt #: 282 total cpu time spent up to now is 93.4 secs Computing kpt #: 283 total cpu time spent up to now is 93.7 secs Computing kpt #: 284 total cpu time spent up to now is 94.0 secs Computing kpt #: 285 total cpu time spent up to now is 94.3 secs Computing kpt #: 286 total cpu time spent up to now is 94.6 secs Computing kpt #: 287 total cpu time spent up to now is 94.9 secs Computing kpt #: 288 total cpu time spent up to now is 95.2 secs Computing kpt #: 289 total cpu time spent up to now is 95.5 secs Computing kpt #: 290 total cpu time spent up to now is 95.8 secs Computing kpt #: 291 total cpu time spent up to now is 96.1 secs Computing kpt #: 292 total cpu time spent up to now is 96.5 secs Computing kpt #: 293 total cpu time spent up to now is 96.8 secs Computing kpt #: 294 total cpu time spent up to now is 97.1 secs Computing kpt #: 295 total cpu time spent up to now is 97.4 secs Computing kpt #: 296 total cpu time spent up to now is 97.7 secs Computing kpt #: 297 total cpu time spent up to now is 98.0 secs Computing kpt #: 298 total cpu time spent up to now is 98.3 secs Computing kpt #: 299 total cpu time spent up to now is 98.6 secs Computing kpt #: 300 total cpu time spent up to now is 98.9 secs Computing kpt #: 301 total cpu time spent up to now is 99.2 secs Computing kpt #: 302 total cpu time spent up to now is 99.5 secs Computing kpt #: 303 total cpu time spent up to now is 99.9 secs Computing kpt #: 304 total cpu time spent up to now is 100.2 secs Computing kpt #: 305 total cpu time spent up to now is 100.5 secs Computing kpt #: 306 total cpu time spent up to now is 100.8 secs Computing kpt #: 307 total cpu time spent up to now is 101.1 secs Computing kpt #: 308 total cpu time spent up to now is 101.5 secs Computing kpt #: 309 total cpu time spent up to now is 101.9 secs Computing kpt #: 310 total cpu time spent up to now is 102.3 secs Computing kpt #: 311 total cpu time spent up to now is 102.6 secs Computing kpt #: 312 total cpu time spent up to now is 103.0 secs Computing kpt #: 313 total cpu time spent up to now is 103.4 secs Computing kpt #: 314 total cpu time spent up to now is 103.8 secs Computing kpt #: 315 total cpu time spent up to now is 104.1 secs Computing kpt #: 316 total cpu time spent up to now is 104.5 secs Computing kpt #: 317 total cpu time spent up to now is 104.8 secs Computing kpt #: 318 total cpu time spent up to now is 105.2 secs Computing kpt #: 319 total cpu time spent up to now is 105.6 secs Computing kpt #: 320 total cpu time spent up to now is 106.0 secs Computing kpt #: 321 total cpu time spent up to now is 106.3 secs Computing kpt #: 322 total cpu time spent up to now is 106.7 secs Computing kpt #: 323 total cpu time spent up to now is 107.0 secs Computing kpt #: 324 total cpu time spent up to now is 107.3 secs Computing kpt #: 325 total cpu time spent up to now is 107.7 secs Computing kpt #: 326 total cpu time spent up to now is 108.0 secs Computing kpt #: 327 total cpu time spent up to now is 108.3 secs Computing kpt #: 328 total cpu time spent up to now is 108.6 secs Computing kpt #: 329 total cpu time spent up to now is 108.9 secs Computing kpt #: 330 total cpu time spent up to now is 109.2 secs Computing kpt #: 331 total cpu time spent up to now is 109.5 secs Computing kpt #: 332 total cpu time spent up to now is 109.8 secs Computing kpt #: 333 total cpu time spent up to now is 110.1 secs Computing kpt #: 334 total cpu time spent up to now is 110.4 secs Computing kpt #: 335 total cpu time spent up to now is 110.7 secs Computing kpt #: 336 total cpu time spent up to now is 111.0 secs Computing kpt #: 337 total cpu time spent up to now is 111.3 secs Computing kpt #: 338 total cpu time spent up to now is 111.6 secs Computing kpt #: 339 total cpu time spent up to now is 111.9 secs Computing kpt #: 340 total cpu time spent up to now is 112.2 secs Computing kpt #: 341 total cpu time spent up to now is 112.5 secs Computing kpt #: 342 total cpu time spent up to now is 112.8 secs Computing kpt #: 343 total cpu time spent up to now is 113.2 secs Computing kpt #: 344 total cpu time spent up to now is 113.9 secs Computing kpt #: 345 total cpu time spent up to now is 114.2 secs Computing kpt #: 346 total cpu time spent up to now is 114.5 secs Computing kpt #: 347 total cpu time spent up to now is 114.8 secs Computing kpt #: 348 total cpu time spent up to now is 115.1 secs Computing kpt #: 349 total cpu time spent up to now is 115.5 secs Computing kpt #: 350 total cpu time spent up to now is 115.8 secs Computing kpt #: 351 total cpu time spent up to now is 116.1 secs Computing kpt #: 352 total cpu time spent up to now is 116.5 secs Computing kpt #: 353 total cpu time spent up to now is 116.8 secs ethr = 2.78E-08, avg # of iterations = 18.3 total cpu time spent up to now is 116.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3433 PWs) bands (ev): -28.5643 -28.5643 -28.5519 -28.5519 -11.4478 -11.4478 -11.3095 -11.3095 -10.4334 -10.4334 -10.1876 -10.1876 -10.1371 -10.1371 -10.1232 -10.1232 -8.0254 -8.0254 -7.5910 -7.5910 0.8337 0.8337 2.2372 2.2372 2.6606 2.6606 2.9086 2.9086 3.1814 3.1814 3.3124 3.3124 3.5990 3.5990 4.3108 4.3108 8.1287 8.1287 8.7517 8.7517 9.2101 9.2101 9.3121 9.3121 k = 0.0106 0.0067-0.0039 ( 3434 PWs) bands (ev): -28.5642 -28.5642 -28.5519 -28.5519 -11.4477 -11.4477 -11.3096 -11.3096 -10.4333 -10.4333 -10.1877 -10.1877 -10.1373 -10.1373 -10.1235 -10.1235 -8.0249 -8.0249 -7.5913 -7.5913 0.8350 0.8350 2.2365 2.2365 2.6588 2.6588 2.9084 2.9084 3.1822 3.1822 3.3113 3.3113 3.5994 3.5994 4.3108 4.3108 8.1304 8.1304 8.7532 8.7532 9.2091 9.2091 9.3123 9.3123 k = 0.0213 0.0135-0.0078 ( 3430 PWs) bands (ev): -28.5642 -28.5642 -28.5518 -28.5518 -11.4476 -11.4476 -11.3101 -11.3101 -10.4331 -10.4331 -10.1881 -10.1881 -10.1379 -10.1379 -10.1245 -10.1245 -8.0231 -8.0231 -7.5922 -7.5922 0.8388 0.8388 2.2345 2.2345 2.6536 2.6536 2.9076 2.9076 3.1845 3.1845 3.3081 3.3081 3.6008 3.6008 4.3107 4.3107 8.1354 8.1354 8.7578 8.7578 9.2057 9.2057 9.3132 9.3132 k = 0.0319 0.0202-0.0117 ( 3436 PWs) bands (ev): -28.5641 -28.5641 -28.5518 -28.5518 -11.4474 -11.4474 -11.3108 -11.3108 -10.4328 -10.4328 -10.1888 -10.1888 -10.1390 -10.1390 -10.1260 -10.1260 -8.0202 -8.0202 -7.5936 -7.5936 0.8450 0.8450 2.2311 2.2311 2.6452 2.6452 2.9062 2.9062 3.1880 3.1880 3.3027 3.3027 3.6033 3.6033 4.3105 4.3105 8.1438 8.1438 8.7654 8.7654 9.1987 9.1987 9.3161 9.3161 k = 0.0426 0.0270-0.0156 ( 3438 PWs) bands (ev): -28.5639 -28.5639 -28.5517 -28.5517 -11.4471 -11.4471 -11.3118 -11.3118 -10.4324 -10.4324 -10.1898 -10.1898 -10.1404 -10.1404 -10.1281 -10.1281 -8.0162 -8.0162 -7.5956 -7.5956 0.8538 0.8538 2.2262 2.2262 2.6340 2.6340 2.9044 2.9044 3.1921 3.1921 3.2952 3.2952 3.6069 3.6069 4.3102 4.3102 8.1554 8.1554 8.7760 8.7760 9.1867 9.1867 9.3221 9.3221 k = 0.0532 0.0337-0.0195 ( 3440 PWs) bands (ev): -28.5637 -28.5637 -28.5516 -28.5516 -11.4467 -11.4467 -11.3132 -11.3132 -10.4318 -10.4318 -10.1911 -10.1911 -10.1423 -10.1423 -10.1307 -10.1307 -8.0111 -8.0111 -7.5982 -7.5982 0.8650 0.8650 2.2198 2.2198 2.6207 2.6207 2.9021 2.9021 3.1964 3.1964 3.2858 3.2858 3.6120 3.6120 4.3097 4.3097 8.1704 8.1704 8.7894 8.7894 9.1688 9.1688 9.3323 9.3323 k = 0.0638 0.0405-0.0234 ( 3445 PWs) bands (ev): -28.5635 -28.5635 -28.5514 -28.5514 -11.4462 -11.4462 -11.3148 -11.3148 -10.4311 -10.4311 -10.1928 -10.1928 -10.1447 -10.1447 -10.1337 -10.1337 -8.0049 -8.0049 -7.6014 -7.6014 0.8787 0.8787 2.2116 2.2116 2.6058 2.6058 2.8993 2.8993 3.2003 3.2003 3.2746 3.2746 3.6186 3.6186 4.3090 4.3090 8.1885 8.1885 8.8055 8.8055 9.1447 9.1447 9.3466 9.3466 k = 0.0745 0.0472-0.0273 ( 3447 PWs) bands (ev): -28.5632 -28.5632 -28.5513 -28.5513 -11.4457 -11.4457 -11.3166 -11.3166 -10.4303 -10.4303 -10.1950 -10.1950 -10.1475 -10.1475 -10.1370 -10.1370 -7.9977 -7.9977 -7.6050 -7.6050 0.8947 0.8947 2.2016 2.2016 2.5897 2.5897 2.8961 2.8961 3.2033 3.2033 3.2616 3.2616 3.6270 3.6270 4.3079 4.3079 8.2098 8.2098 8.8241 8.8241 9.1144 9.1144 9.3649 9.3649 k = 0.0851 0.0540-0.0312 ( 3448 PWs) bands (ev): -28.5629 -28.5629 -28.5511 -28.5511 -11.4451 -11.4451 -11.3188 -11.3188 -10.4293 -10.4293 -10.1976 -10.1976 -10.1506 -10.1506 -10.1404 -10.1404 -7.9896 -7.9896 -7.6093 -7.6093 0.9130 0.9130 2.1898 2.1898 2.5731 2.5731 2.8926 2.8926 3.2048 3.2048 3.2472 3.2472 3.6372 3.6372 4.3064 4.3064 8.2342 8.2342 8.8451 8.8451 9.0783 9.0783 9.3869 9.3869 k = 0.0957 0.0607-0.0351 ( 3454 PWs) bands (ev): -28.5626 -28.5626 -28.5509 -28.5509 -11.4445 -11.4445 -11.3212 -11.3212 -10.4282 -10.4282 -10.2009 -10.2009 -10.1541 -10.1541 -10.1440 -10.1440 -7.9805 -7.9805 -7.6140 -7.6140 0.9336 0.9336 2.1758 2.1758 2.5563 2.5563 2.8887 2.8887 3.2046 3.2046 3.2316 3.2316 3.6492 3.6492 4.3044 4.3044 8.2615 8.2615 8.8682 8.8682 9.0366 9.0366 9.4123 9.4123 k = 0.1064 0.0675-0.0390 ( 3460 PWs) bands (ev): -28.5622 -28.5622 -28.5506 -28.5506 -11.4438 -11.4438 -11.3238 -11.3238 -10.4270 -10.4270 -10.2049 -10.2049 -10.1577 -10.1577 -10.1476 -10.1476 -7.9706 -7.9706 -7.6193 -7.6193 0.9563 0.9563 2.1598 2.1598 2.5397 2.5397 2.8845 2.8845 3.2015 3.2015 3.2159 3.2159 3.6630 3.6630 4.3019 4.3019 8.2918 8.2918 8.8932 8.8932 8.9896 8.9896 9.4407 9.4407 k = 0.1170 0.0742-0.0429 ( 3461 PWs) bands (ev): -28.5618 -28.5618 -28.5504 -28.5504 -11.4430 -11.4430 -11.3268 -11.3268 -10.4256 -10.4256 -10.2096 -10.2096 -10.1614 -10.1614 -10.1513 -10.1513 -7.9599 -7.9599 -7.6250 -7.6250 0.9811 0.9811 2.1416 2.1416 2.5237 2.5237 2.8801 2.8801 3.1911 3.1911 3.2048 3.2048 3.6786 3.6786 4.2987 4.2987 8.3249 8.3249 8.9186 8.9186 8.9389 8.9389 9.4719 9.4719 k = 0.1277 0.0810-0.0469 ( 3463 PWs) bands (ev): -28.5614 -28.5614 -28.5501 -28.5501 -11.4423 -11.4423 -11.3299 -11.3299 -10.4241 -10.4241 -10.2151 -10.2151 -10.1650 -10.1650 -10.1551 -10.1551 -7.9485 -7.9485 -7.6312 -7.6312 1.0080 1.0080 2.1214 2.1214 2.5082 2.5082 2.8756 2.8756 3.1735 3.1735 3.1984 3.1984 3.6956 3.6956 4.2948 4.2948 8.3606 8.3606 8.8793 8.8793 8.9496 8.9496 9.5056 9.5056 k = 0.1383 0.0877-0.0508 ( 3462 PWs) bands (ev): -28.5609 -28.5609 -28.5499 -28.5499 -11.4415 -11.4415 -11.3333 -11.3333 -10.4224 -10.4224 -10.2214 -10.2214 -10.1685 -10.1685 -10.1588 -10.1588 -7.9364 -7.9364 -7.6378 -7.6378 1.0368 1.0368 2.0992 2.0992 2.4935 2.4935 2.8710 2.8710 3.1538 3.1538 3.1919 3.1919 3.7139 3.7139 4.2901 4.2901 8.3990 8.3990 8.8181 8.8181 8.9792 8.9792 9.5417 9.5417 k = 0.1489 0.0945-0.0547 ( 3465 PWs) bands (ev): -28.5604 -28.5604 -28.5496 -28.5496 -11.4407 -11.4407 -11.3369 -11.3369 -10.4206 -10.4206 -10.2284 -10.2284 -10.1719 -10.1719 -10.1626 -10.1626 -7.9238 -7.9238 -7.6448 -7.6448 1.0673 1.0673 2.0751 2.0751 2.4795 2.4795 2.8663 2.8663 3.1332 3.1332 3.1847 3.1847 3.7331 3.7331 4.2846 4.2846 8.4399 8.4399 8.7526 8.7526 9.0104 9.0104 9.5798 9.5798 k = 0.1596 0.1012-0.0586 ( 3467 PWs) bands (ev): -28.5599 -28.5599 -28.5492 -28.5492 -11.4400 -11.4400 -11.3407 -11.3407 -10.4186 -10.4186 -10.2361 -10.2361 -10.1753 -10.1753 -10.1662 -10.1662 -7.9106 -7.9106 -7.6522 -7.6522 1.0996 1.0996 2.0495 2.0495 2.4662 2.4662 2.8617 2.8617 3.1120 3.1120 3.1767 3.1767 3.7532 3.7532 4.2781 4.2781 8.4832 8.4832 8.6833 8.6833 9.0427 9.0427 9.6198 9.6198 k = 0.1702 0.1079-0.0625 ( 3466 PWs) bands (ev): -28.5594 -28.5594 -28.5489 -28.5489 -11.4392 -11.4392 -11.3447 -11.3447 -10.4165 -10.4165 -10.2443 -10.2443 -10.1788 -10.1788 -10.1697 -10.1697 -7.8971 -7.8971 -7.6600 -7.6600 1.1334 1.1334 2.0224 2.0224 2.4533 2.4533 2.8572 2.8572 3.0905 3.0905 3.1682 3.1682 3.7737 3.7737 4.2708 4.2708 8.5288 8.5288 8.6108 8.6108 9.0761 9.0761 9.6614 9.6614 k = 0.1809 0.1147-0.0664 ( 3461 PWs) bands (ev): -28.5588 -28.5588 -28.5486 -28.5486 -11.4385 -11.4385 -11.3488 -11.3488 -10.4143 -10.4143 -10.2530 -10.2530 -10.1824 -10.1824 -10.1729 -10.1729 -7.8832 -7.8832 -7.6680 -7.6680 1.1686 1.1686 1.9941 1.9941 2.4409 2.4409 2.8528 2.8528 3.0689 3.0689 3.1594 3.1594 3.7947 3.7947 4.2625 4.2625 8.5356 8.5356 8.5766 8.5766 9.1105 9.1105 9.7043 9.7043 k = 0.1915 0.1214-0.0703 ( 3461 PWs) bands (ev): -28.5582 -28.5582 -28.5482 -28.5482 -11.4378 -11.4378 -11.3531 -11.3531 -10.4120 -10.4120 -10.2620 -10.2620 -10.1863 -10.1863 -10.1758 -10.1758 -7.8690 -7.8690 -7.6764 -7.6764 1.2051 1.2051 1.9649 1.9649 2.4286 2.4286 2.8487 2.8487 3.0472 3.0472 3.1506 3.1506 3.8157 3.8157 4.2531 4.2531 8.4582 8.4582 8.6265 8.6265 9.1459 9.1459 9.7483 9.7483 k = 0.2021 0.1282-0.0742 ( 3462 PWs) bands (ev): -28.5576 -28.5576 -28.5479 -28.5479 -11.4371 -11.4371 -11.3576 -11.3576 -10.4095 -10.4095 -10.2712 -10.2712 -10.1903 -10.1903 -10.1783 -10.1783 -7.8546 -7.8546 -7.6850 -7.6850 1.2427 1.2427 1.9350 1.9350 2.4165 2.4165 2.8449 2.8449 3.0258 3.0258 3.1420 3.1420 3.8366 3.8366 4.2428 4.2428 8.3789 8.3789 8.6782 8.6782 9.1824 9.1824 9.7931 9.7931 k = 0.2128 0.1349-0.0781 ( 3462 PWs) bands (ev): -28.5570 -28.5570 -28.5475 -28.5475 -11.4365 -11.4365 -11.3621 -11.3621 -10.4069 -10.4069 -10.2806 -10.2806 -10.1946 -10.1946 -10.1807 -10.1807 -7.8401 -7.8401 -7.6939 -7.6939 1.2812 1.2812 1.9046 1.9046 2.4043 2.4043 2.8414 2.8414 3.0046 3.0046 3.1337 3.1337 3.8575 3.8575 4.2314 4.2314 8.2984 8.2984 8.7319 8.7319 9.2199 9.2199 9.8382 9.8382 k = 0.2234 0.1417-0.0820 ( 3470 PWs) bands (ev): -28.5564 -28.5564 -28.5471 -28.5471 -11.4359 -11.4359 -11.3668 -11.3668 -10.4043 -10.4043 -10.2901 -10.2901 -10.1988 -10.1988 -10.1829 -10.1829 -7.8255 -7.8255 -7.7029 -7.7029 1.3206 1.3206 1.8739 1.8739 2.3920 2.3920 2.8382 2.8382 2.9840 2.9840 3.1260 3.1260 3.8779 3.8779 4.2191 4.2191 8.2170 8.2170 8.7872 8.7872 9.2586 9.2586 9.8835 9.8835 k = 0.2340 0.1484-0.0859 ( 3470 PWs) bands (ev): -28.5558 -28.5558 -28.5467 -28.5467 -11.4354 -11.4354 -11.3715 -11.3715 -10.4016 -10.4016 -10.2995 -10.2995 -10.2031 -10.2031 -10.1849 -10.1849 -7.8110 -7.8110 -7.7120 -7.7120 1.3604 1.3604 1.8431 1.8431 2.3795 2.3795 2.8354 2.8354 2.9640 2.9640 3.1189 3.1189 3.8979 3.8979 4.2057 4.2057 8.1352 8.1352 8.8442 8.8442 9.2986 9.2986 9.9285 9.9285 k = 0.2447 0.1552-0.0898 ( 3471 PWs) bands (ev): -28.5552 -28.5552 -28.5463 -28.5463 -11.4350 -11.4350 -11.3763 -11.3763 -10.3988 -10.3988 -10.3090 -10.3090 -10.2074 -10.2074 -10.1868 -10.1868 -7.7966 -7.7966 -7.7212 -7.7212 1.4007 1.4007 1.8124 1.8124 2.3668 2.3668 2.8331 2.8331 2.9449 2.9449 3.1126 3.1126 3.9173 3.9173 4.1913 4.1913 8.0534 8.0534 8.9026 8.9026 9.3399 9.3399 9.9727 9.9727 k = 0.2553 0.1619-0.0937 ( 3470 PWs) bands (ev): -28.5545 -28.5545 -28.5460 -28.5460 -11.4346 -11.4346 -11.3812 -11.3812 -10.3960 -10.3960 -10.3183 -10.3183 -10.2116 -10.2116 -10.1886 -10.1886 -7.7825 -7.7825 -7.7303 -7.7303 1.4411 1.4411 1.7818 1.7818 2.3538 2.3538 2.8311 2.8311 2.9269 2.9269 3.1072 3.1072 3.9362 3.9362 4.1760 4.1760 7.9721 7.9721 8.9624 8.9624 9.3826 9.3826 10.0158 10.0158 k = 0.2660 0.1687-0.0976 ( 3475 PWs) bands (ev): -28.5539 -28.5539 -28.5456 -28.5456 -11.4343 -11.4343 -11.3860 -11.3860 -10.3933 -10.3933 -10.3274 -10.3274 -10.2157 -10.2157 -10.1904 -10.1904 -7.7692 -7.7692 -7.7388 -7.7388 1.4814 1.4814 1.7517 1.7517 2.3405 2.3405 2.8292 2.8292 2.9105 2.9105 3.1026 3.1026 3.9543 3.9543 4.1597 4.1597 7.8916 7.8916 9.0236 9.0236 9.4268 9.4268 10.0571 10.0571 k = 0.2766 0.1754-0.1015 ( 3467 PWs) bands (ev): -28.5533 -28.5533 -28.5452 -28.5452 -11.4341 -11.4341 -11.3909 -11.3909 -10.3906 -10.3906 -10.3363 -10.3363 -10.2197 -10.2197 -10.1921 -10.1921 -7.7596 -7.7596 -7.7438 -7.7438 1.5215 1.5215 1.7221 1.7221 2.3270 2.3270 2.8271 2.8271 2.8961 2.8961 3.0990 3.0990 3.9718 3.9718 4.1426 4.1426 7.8122 7.8122 9.0858 9.0858 9.4725 9.4725 10.0964 10.0964 k = 0.2872 0.1822-0.1054 ( 3465 PWs) bands (ev): -28.5527 -28.5527 -28.5448 -28.5448 -11.4339 -11.4339 -11.3957 -11.3957 -10.3880 -10.3880 -10.3449 -10.3449 -10.2234 -10.2234 -10.1937 -10.1937 -7.7624 -7.7624 -7.7367 -7.7367 1.5609 1.5609 1.6931 1.6931 2.3133 2.3133 2.8242 2.8242 2.8845 2.8845 3.0963 3.0963 3.9883 3.9883 4.1246 4.1246 7.7344 7.7344 9.1491 9.1491 9.5199 9.5199 10.1330 10.1330 k = 0.2979 0.1889-0.1093 ( 3463 PWs) bands (ev): -28.5521 -28.5521 -28.5445 -28.5445 -11.4339 -11.4339 -11.4004 -11.4004 -10.3857 -10.3857 -10.3531 -10.3531 -10.2269 -10.2269 -10.1953 -10.1953 -7.7705 -7.7705 -7.7246 -7.7246 1.5994 1.5994 1.6651 1.6651 2.2995 2.2995 2.8195 2.8195 2.8768 2.8768 3.0944 3.0944 4.0040 4.0040 4.1059 4.1059 7.6583 7.6583 9.2134 9.2134 9.5688 9.5688 10.1664 10.1664 k = 0.3085 0.1957-0.1132 ( 3471 PWs) bands (ev): -28.5515 -28.5515 -28.5441 -28.5441 -11.4339 -11.4339 -11.4051 -11.4051 -10.3838 -10.3838 -10.3606 -10.3606 -10.2302 -10.2302 -10.1968 -10.1968 -7.7792 -7.7792 -7.7120 -7.7120 1.6316 1.6316 1.6431 1.6431 2.2856 2.2856 2.8127 2.8127 2.8734 2.8734 3.0934 3.0934 4.0187 4.0187 4.0865 4.0865 7.5844 7.5844 9.2783 9.2783 9.6192 9.6192 10.1964 10.1964 k = 0.3191 0.2024-0.1171 ( 3469 PWs) bands (ev): -28.5509 -28.5509 -28.5437 -28.5437 -11.4339 -11.4339 -11.4096 -11.4096 -10.3830 -10.3830 -10.3668 -10.3668 -10.2332 -10.2332 -10.1983 -10.1983 -7.7880 -7.7880 -7.6997 -7.6997 1.6100 1.6100 1.6745 1.6745 2.2717 2.2717 2.8042 2.8042 2.8741 2.8741 3.0932 3.0932 4.0317 4.0317 4.0672 4.0672 7.5128 7.5128 9.3439 9.3439 9.6712 9.6712 10.2226 10.2226 k = 0.3298 0.2091-0.1210 ( 3470 PWs) bands (ev): -28.5503 -28.5503 -28.5434 -28.5434 -11.4341 -11.4341 -11.4140 -11.4140 -10.3846 -10.3846 -10.3704 -10.3704 -10.2359 -10.2359 -10.1997 -10.1997 -7.7967 -7.7967 -7.6878 -7.6878 1.5848 1.5848 1.7092 1.7092 2.2580 2.2580 2.7951 2.7951 2.8780 2.8780 3.0936 3.0936 4.0369 4.0369 4.0542 4.0542 7.4440 7.4440 9.4099 9.4099 9.7247 9.7247 10.2448 10.2448 k = 0.3404 0.2159-0.1249 ( 3469 PWs) bands (ev): -28.5498 -28.5498 -28.5431 -28.5431 -11.4343 -11.4343 -11.4182 -11.4182 -10.3891 -10.3891 -10.3710 -10.3710 -10.2383 -10.2383 -10.2011 -10.2011 -7.8051 -7.8051 -7.6763 -7.6763 1.5605 1.5605 1.7422 1.7422 2.2445 2.2445 2.7859 2.7859 2.8845 2.8845 3.0947 3.0947 4.0206 4.0206 4.0614 4.0614 7.3780 7.3780 9.4760 9.4760 9.7797 9.7797 10.2630 10.2630 k = 0.3511 0.2226-0.1288 ( 3464 PWs) bands (ev): -28.5493 -28.5493 -28.5428 -28.5428 -11.4347 -11.4347 -11.4222 -11.4222 -10.3948 -10.3948 -10.3702 -10.3702 -10.2404 -10.2404 -10.2024 -10.2024 -7.8132 -7.8132 -7.6654 -7.6654 1.5374 1.5374 1.7734 1.7734 2.2314 2.2314 2.7771 2.7771 2.8930 2.8930 3.0963 3.0963 3.9994 3.9994 4.0720 4.0720 7.3151 7.3151 9.5419 9.5419 9.8361 9.8361 10.2772 10.2772 k = 0.3617 0.2294-0.1327 ( 3464 PWs) bands (ev): -28.5488 -28.5488 -28.5425 -28.5425 -11.4353 -11.4353 -11.4258 -11.4258 -10.4006 -10.4006 -10.3690 -10.3690 -10.2421 -10.2421 -10.2036 -10.2036 -7.8210 -7.8210 -7.6551 -7.6551 1.5155 1.5155 1.8025 1.8025 2.2186 2.2186 2.7690 2.7690 2.9033 2.9033 3.0983 3.0983 3.9773 3.9773 4.0823 4.0823 7.2556 7.2556 9.6073 9.6073 9.8939 9.8939 10.2878 10.2878 k = 0.3723 0.2361-0.1367 ( 3462 PWs) bands (ev): -28.5483 -28.5483 -28.5422 -28.5422 -11.4362 -11.4362 -11.4288 -11.4288 -10.4063 -10.4063 -10.3677 -10.3677 -10.2435 -10.2435 -10.2048 -10.2048 -7.8284 -7.8284 -7.6454 -7.6454 1.4950 1.4950 1.8294 1.8294 2.2064 2.2064 2.7617 2.7617 2.9153 2.9153 3.1007 3.1007 3.9549 3.9549 4.0918 4.0918 7.1996 7.1996 9.6716 9.6716 9.9532 9.9532 10.2950 10.2950 k = 0.3830 0.2429-0.1406 ( 3466 PWs) bands (ev): -28.5479 -28.5479 -28.5419 -28.5419 -11.4378 -11.4378 -11.4310 -11.4310 -10.4117 -10.4117 -10.3666 -10.3666 -10.2446 -10.2446 -10.2060 -10.2060 -7.8354 -7.8354 -7.6363 -7.6363 1.4759 1.4759 1.8539 1.8539 2.1948 2.1948 2.7551 2.7551 2.9285 2.9285 3.1033 3.1033 3.9324 3.9324 4.1006 4.1006 7.1474 7.1474 9.7342 9.7342 10.0141 10.0141 10.2994 10.2994 k = 0.3936 0.2496-0.1445 ( 3460 PWs) bands (ev): -28.5474 -28.5474 -28.5417 -28.5417 -11.4400 -11.4400 -11.4324 -11.4324 -10.4167 -10.4167 -10.3656 -10.3656 -10.2454 -10.2454 -10.2070 -10.2070 -7.8419 -7.8419 -7.6279 -7.6279 1.4583 1.4583 1.8760 1.8760 2.1839 2.1839 2.7494 2.7494 2.9429 2.9429 3.1062 3.1062 3.9100 3.9100 4.1085 4.1085 7.0991 7.0991 9.7945 9.7945 10.0767 10.0767 10.3013 10.3013 k = 0.4043 0.2564-0.1484 ( 3461 PWs) bands (ev): -28.5471 -28.5471 -28.5414 -28.5414 -11.4425 -11.4425 -11.4332 -11.4332 -10.4212 -10.4212 -10.3648 -10.3648 -10.2460 -10.2460 -10.2080 -10.2080 -7.8479 -7.8479 -7.6203 -7.6203 1.4421 1.4421 1.8956 1.8956 2.1738 2.1738 2.7445 2.7445 2.9581 2.9581 3.1090 3.1090 3.8881 3.8881 4.1156 4.1156 7.0550 7.0550 9.8517 9.8517 10.1411 10.1411 10.3013 10.3013 k = 0.4149 0.2631-0.1523 ( 3465 PWs) bands (ev): -28.5467 -28.5467 -28.5412 -28.5412 -11.4449 -11.4449 -11.4338 -11.4338 -10.4254 -10.4254 -10.3642 -10.3642 -10.2463 -10.2463 -10.2090 -10.2090 -7.8534 -7.8534 -7.6134 -7.6134 1.4275 1.4275 1.9129 1.9129 2.1646 2.1646 2.7403 2.7403 2.9737 2.9737 3.1119 3.1119 3.8667 3.8667 4.1218 4.1218 7.0150 7.0150 9.9051 9.9051 10.2073 10.2073 10.2998 10.2998 k = 0.4255 0.2699-0.1562 ( 3460 PWs) bands (ev): -28.5464 -28.5464 -28.5410 -28.5410 -11.4472 -11.4472 -11.4342 -11.4342 -10.4290 -10.4290 -10.3637 -10.3637 -10.2464 -10.2464 -10.2098 -10.2098 -7.8583 -7.8583 -7.6073 -7.6073 1.4146 1.4146 1.9278 1.9278 2.1563 2.1563 2.7368 2.7368 2.9894 2.9894 3.1147 3.1147 3.8464 3.8464 4.1273 4.1273 6.9794 6.9794 9.9538 9.9538 10.2753 10.2753 10.2975 10.2975 k = 0.4362 0.2766-0.1601 ( 3468 PWs) bands (ev): -28.5462 -28.5462 -28.5409 -28.5409 -11.4493 -11.4493 -11.4345 -11.4345 -10.4322 -10.4322 -10.3633 -10.3633 -10.2465 -10.2465 -10.2106 -10.2106 -7.8627 -7.8627 -7.6020 -7.6020 1.4032 1.4032 1.9405 1.9405 2.1489 2.1489 2.7339 2.7339 3.0045 3.0045 3.1173 3.1173 3.8275 3.8275 4.1321 4.1321 6.9483 6.9483 9.9972 9.9972 10.2941 10.2941 10.3454 10.3454 k = 0.4468 0.2834-0.1640 ( 3472 PWs) bands (ev): -28.5459 -28.5459 -28.5407 -28.5407 -11.4511 -11.4511 -11.4348 -11.4348 -10.4349 -10.4349 -10.3630 -10.3630 -10.2464 -10.2464 -10.2112 -10.2112 -7.8664 -7.8664 -7.5974 -7.5974 1.3936 1.3936 1.9510 1.9510 2.1426 2.1426 2.7315 2.7315 3.0186 3.0186 3.1198 3.1198 3.8103 3.8103 4.1360 4.1360 6.9218 6.9218 10.0349 10.0349 10.2910 10.2910 10.4165 10.4165 k = 0.4574 0.2901-0.1679 ( 3474 PWs) bands (ev): -28.5458 -28.5458 -28.5406 -28.5406 -11.4526 -11.4526 -11.4350 -11.4350 -10.4371 -10.4371 -10.3628 -10.3628 -10.2463 -10.2463 -10.2118 -10.2118 -7.8694 -7.8694 -7.5937 -7.5937 1.3857 1.3857 1.9594 1.9594 2.1374 2.1374 2.7297 2.7297 3.0311 3.0311 3.1219 3.1219 3.7954 3.7954 4.1392 4.1392 6.9000 6.9000 10.0663 10.0663 10.2880 10.2880 10.4884 10.4884 k = 0.4681 0.2968-0.1718 ( 3475 PWs) bands (ev): -28.5456 -28.5456 -28.5405 -28.5405 -11.4537 -11.4537 -11.4352 -11.4352 -10.4389 -10.4389 -10.3627 -10.3627 -10.2461 -10.2461 -10.2122 -10.2122 -7.8718 -7.8718 -7.5908 -7.5908 1.3795 1.3795 1.9659 1.9659 2.1333 2.1333 2.7283 2.7283 3.0415 3.0415 3.1237 3.1237 3.7832 3.7832 4.1417 4.1417 6.8830 6.8830 10.0911 10.0911 10.2853 10.2853 10.5604 10.5604 k = 0.4787 0.3036-0.1757 ( 3473 PWs) bands (ev): -28.5455 -28.5455 -28.5405 -28.5405 -11.4546 -11.4546 -11.4353 -11.4353 -10.4401 -10.4401 -10.3626 -10.3626 -10.2460 -10.2460 -10.2125 -10.2125 -7.8735 -7.8735 -7.5887 -7.5887 1.3751 1.3751 1.9704 1.9704 2.1303 2.1303 2.7274 2.7274 3.0493 3.0493 3.1251 3.1251 3.7742 3.7742 4.1434 4.1434 6.8707 6.8707 10.1090 10.1090 10.2833 10.2833 10.6316 10.6316 k = 0.4894 0.3103-0.1796 ( 3470 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4551 -11.4551 -11.4353 -11.4353 -10.4409 -10.4409 -10.3626 -10.3626 -10.2459 -10.2459 -10.2127 -10.2127 -7.8746 -7.8746 -7.5874 -7.5874 1.3724 1.3724 1.9731 1.9731 2.1286 2.1286 2.7268 2.7268 3.0542 3.0542 3.1260 3.1260 3.7686 3.7686 4.1445 4.1445 6.8634 6.8634 10.1198 10.1198 10.2820 10.2820 10.7010 10.7010 k = 0.5000 0.3171-0.1835 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4553 -11.4553 -11.4354 -11.4354 -10.4411 -10.4411 -10.3626 -10.3626 -10.2459 -10.2459 -10.2128 -10.2128 -7.8749 -7.8749 -7.5870 -7.5870 1.3715 1.3715 1.9740 1.9740 2.1280 2.1280 2.7266 2.7266 3.0558 3.0558 3.1263 3.1263 3.7667 3.7667 4.1449 4.1449 6.8610 6.8610 10.1235 10.1235 10.2816 10.2816 10.7624 10.7731 k = 0.5000 0.3171-0.1835 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4553 -11.4553 -11.4354 -11.4354 -10.4411 -10.4411 -10.3626 -10.3626 -10.2459 -10.2459 -10.2128 -10.2128 -7.8749 -7.8749 -7.5870 -7.5870 1.3715 1.3715 1.9740 1.9740 2.1280 2.1280 2.7266 2.7266 3.0558 3.0558 3.1263 3.1263 3.7667 3.7667 4.1449 4.1449 6.8610 6.8610 10.1235 10.1235 10.2816 10.2816 10.7731 10.7731 k = 0.5033 0.3192-0.1709 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4552 -11.4552 -11.4354 -11.4354 -10.4410 -10.4410 -10.3626 -10.3626 -10.2459 -10.2459 -10.2129 -10.2129 -7.8745 -7.8745 -7.5874 -7.5874 1.3722 1.3722 1.9735 1.9735 2.1290 2.1290 2.7259 2.7259 3.0543 3.0543 3.1260 3.1260 3.7678 3.7678 4.1448 4.1448 6.8630 6.8630 10.1159 10.1159 10.2838 10.2838 10.7315 10.7315 k = 0.5066 0.3213-0.1583 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5405 -28.5405 -11.4551 -11.4551 -11.4353 -11.4353 -10.4408 -10.4408 -10.3627 -10.3627 -10.2460 -10.2460 -10.2131 -10.2131 -7.8732 -7.8732 -7.5886 -7.5886 1.3741 1.3741 1.9721 1.9721 2.1320 2.1320 2.7239 2.7239 3.0499 3.0499 3.1250 3.1250 3.7713 3.7713 4.1447 4.1447 6.8690 6.8690 10.0934 10.0934 10.2903 10.2903 10.6929 10.6929 k = 0.5099 0.3234-0.1457 ( 3468 PWs) bands (ev): -28.5453 -28.5453 -28.5405 -28.5405 -11.4549 -11.4549 -11.4353 -11.4353 -10.4403 -10.4403 -10.3629 -10.3629 -10.2461 -10.2461 -10.2135 -10.2135 -7.8711 -7.8711 -7.5906 -7.5906 1.3772 1.3772 1.9697 1.9697 2.1370 2.1370 2.7204 2.7204 3.0429 3.0429 3.1234 3.1234 3.7769 3.7769 4.1446 4.1446 6.8790 6.8790 10.0568 10.0568 10.3011 10.3011 10.6521 10.6521 k = 0.5132 0.3254-0.1332 ( 3468 PWs) bands (ev): -28.5453 -28.5453 -28.5406 -28.5406 -11.4546 -11.4546 -11.4352 -11.4352 -10.4397 -10.4397 -10.3632 -10.3632 -10.2463 -10.2463 -10.2140 -10.2140 -7.8681 -7.8681 -7.5934 -7.5934 1.3815 1.3815 1.9664 1.9664 2.1439 2.1439 2.7152 2.7152 3.0336 3.0336 3.1213 3.1213 3.7845 3.7845 4.1443 4.1443 6.8930 6.8930 10.0075 10.0075 10.3160 10.3160 10.6101 10.6101 k = 0.5165 0.3275-0.1206 ( 3466 PWs) bands (ev): -28.5452 -28.5452 -28.5407 -28.5407 -11.4543 -11.4543 -11.4351 -11.4351 -10.4389 -10.4389 -10.3635 -10.3635 -10.2465 -10.2465 -10.2147 -10.2147 -7.8644 -7.8644 -7.5970 -7.5970 1.3871 1.3871 1.9622 1.9622 2.1528 2.1528 2.7082 2.7082 3.0226 3.0226 3.1187 3.1187 3.7937 3.7937 4.1440 4.1440 6.9110 6.9110 9.9470 9.9470 10.3348 10.3348 10.5681 10.5681 k = 0.5198 0.3296-0.1080 ( 3466 PWs) bands (ev): -28.5451 -28.5451 -28.5408 -28.5408 -11.4539 -11.4539 -11.4350 -11.4350 -10.4379 -10.4379 -10.3640 -10.3640 -10.2466 -10.2466 -10.2156 -10.2156 -7.8599 -7.8599 -7.6013 -7.6013 1.3938 1.3938 1.9571 1.9571 2.1635 2.1635 2.6990 2.6990 3.0104 3.0104 3.1155 3.1155 3.8043 3.8043 4.1437 4.1437 6.9330 6.9330 9.8771 9.8771 10.3574 10.3574 10.5268 10.5268 k = 0.5231 0.3317-0.0954 ( 3462 PWs) bands (ev): -28.5450 -28.5450 -28.5410 -28.5410 -11.4534 -11.4534 -11.4349 -11.4349 -10.4368 -10.4368 -10.3646 -10.3646 -10.2467 -10.2467 -10.2166 -10.2166 -7.8546 -7.8546 -7.6063 -7.6063 1.4016 1.4016 1.9513 1.9513 2.1760 2.1760 2.6874 2.6874 2.9977 2.9977 3.1120 3.1120 3.8161 3.8161 4.1433 4.1433 6.9588 6.9588 9.7995 9.7995 10.3833 10.3833 10.4867 10.4867 k = 0.5264 0.3338-0.0828 ( 3460 PWs) bands (ev): -28.5449 -28.5449 -28.5411 -28.5411 -11.4529 -11.4529 -11.4348 -11.4348 -10.4354 -10.4354 -10.3653 -10.3653 -10.2467 -10.2467 -10.2178 -10.2178 -7.8487 -7.8487 -7.6119 -7.6119 1.4105 1.4105 1.9446 1.9446 2.1901 2.1901 2.6730 2.6730 2.9854 2.9854 3.1080 3.1080 3.8287 3.8287 4.1429 4.1429 6.9885 6.9885 9.7160 9.7160 10.4122 10.4122 10.4482 10.4482 k = 0.5264 0.3338-0.0828 ( 3460 PWs) bands (ev): -28.5449 -28.5449 -28.5411 -28.5411 -11.4529 -11.4529 -11.4348 -11.4348 -10.4354 -10.4354 -10.3653 -10.3653 -10.2467 -10.2467 -10.2178 -10.2178 -7.8487 -7.8487 -7.6119 -7.6119 1.4105 1.4105 1.9446 1.9446 2.1901 2.1901 2.6730 2.6730 2.9854 2.9854 3.1080 3.1080 3.8287 3.8287 4.1429 4.1429 6.9885 6.9885 9.7160 9.7160 10.4122 10.4122 10.4482 10.4482 k = 0.5246 0.3327-0.0706 ( 3462 PWs) bands (ev): -28.5448 -28.5448 -28.5412 -28.5412 -11.4524 -11.4524 -11.4350 -11.4350 -10.4342 -10.4342 -10.3662 -10.3662 -10.2472 -10.2472 -10.2189 -10.2189 -7.8432 -7.8432 -7.6169 -7.6169 1.4236 1.4236 1.9389 1.9389 2.1959 2.1959 2.6598 2.6598 2.9690 2.9690 3.1017 3.1017 3.8486 3.8486 4.1429 4.1429 7.0263 7.0263 9.6191 9.6191 10.4208 10.4208 10.4284 10.4284 k = 0.5228 0.3316-0.0583 ( 3460 PWs) bands (ev): -28.5447 -28.5447 -28.5413 -28.5413 -11.4519 -11.4519 -11.4352 -11.4352 -10.4328 -10.4328 -10.3673 -10.3673 -10.2478 -10.2478 -10.2200 -10.2200 -7.8372 -7.8372 -7.6223 -7.6223 1.4385 1.4385 1.9322 1.9322 2.2018 2.2018 2.6438 2.6438 2.9542 2.9542 3.0947 3.0947 3.8695 3.8695 4.1427 4.1427 7.0693 7.0693 9.5141 9.5141 10.4074 10.4074 10.4391 10.4391 k = 0.5211 0.3305-0.0461 ( 3463 PWs) bands (ev): -28.5446 -28.5446 -28.5414 -28.5414 -11.4514 -11.4514 -11.4354 -11.4354 -10.4312 -10.4312 -10.3685 -10.3685 -10.2482 -10.2482 -10.2213 -10.2213 -7.8307 -7.8307 -7.6282 -7.6282 1.4550 1.4550 1.9246 1.9246 2.2079 2.2079 2.6248 2.6248 2.9420 2.9420 3.0871 3.0871 3.8908 3.8908 4.1422 4.1422 7.1175 7.1175 9.4034 9.4034 10.3991 10.3991 10.4512 10.4512 k = 0.5193 0.3293-0.0339 ( 3461 PWs) bands (ev): -28.5444 -28.5444 -28.5415 -28.5415 -11.4507 -11.4507 -11.4357 -11.4357 -10.4294 -10.4294 -10.3700 -10.3700 -10.2486 -10.2486 -10.2226 -10.2226 -7.8237 -7.8237 -7.6346 -7.6346 1.4731 1.4731 1.9159 1.9159 2.2143 2.2143 2.6031 2.6031 2.9326 2.9326 3.0788 3.0788 3.9121 3.9121 4.1415 4.1415 7.1706 7.1706 9.2891 9.2891 10.3963 10.3963 10.4626 10.4626 k = 0.5176 0.3282-0.0216 ( 3466 PWs) bands (ev): -28.5443 -28.5443 -28.5416 -28.5416 -11.4500 -11.4500 -11.4361 -11.4361 -10.4273 -10.4273 -10.3718 -10.3718 -10.2488 -10.2488 -10.2240 -10.2240 -7.8163 -7.8163 -7.6414 -7.6414 1.4928 1.4928 1.9061 1.9061 2.2210 2.2210 2.5790 2.5790 2.9261 2.9261 3.0699 3.0699 3.9331 3.9331 4.1403 4.1403 7.2287 7.2287 9.1725 9.1725 10.3978 10.3978 10.4731 10.4731 k = 0.5158 0.3271-0.0094 ( 3468 PWs) bands (ev): -28.5442 -28.5442 -28.5417 -28.5417 -11.4493 -11.4493 -11.4365 -11.4365 -10.4252 -10.4252 -10.3737 -10.3737 -10.2488 -10.2488 -10.2256 -10.2256 -7.8085 -7.8085 -7.6487 -7.6487 1.5137 1.5137 1.8950 1.8950 2.2283 2.2283 2.5532 2.5532 2.9225 2.9225 3.0606 3.0606 3.9535 3.9535 4.1387 4.1387 7.2916 7.2916 9.0548 9.0548 10.4026 10.4026 10.4824 10.4824 k = 0.5141 0.3260 0.0028 ( 3469 PWs) bands (ev): -28.5440 -28.5440 -28.5419 -28.5419 -11.4486 -11.4486 -11.4369 -11.4369 -10.4228 -10.4228 -10.3759 -10.3759 -10.2486 -10.2486 -10.2271 -10.2271 -7.8003 -7.8003 -7.6563 -7.6563 1.5359 1.5359 1.8827 1.8827 2.2361 2.2361 2.5262 2.5262 2.9215 2.9215 3.0509 3.0509 3.9731 3.9731 4.1365 4.1365 7.3592 7.3592 8.9370 8.9370 10.4099 10.4099 10.4903 10.4903 k = 0.5123 0.3249 0.0151 ( 3471 PWs) bands (ev): -28.5439 -28.5439 -28.5420 -28.5420 -11.4478 -11.4478 -11.4374 -11.4374 -10.4203 -10.4203 -10.3783 -10.3783 -10.2482 -10.2482 -10.2288 -10.2288 -7.7918 -7.7918 -7.6643 -7.6643 1.5591 1.5591 1.8689 1.8689 2.2445 2.2445 2.4989 2.4989 2.9226 2.9226 3.0409 3.0409 3.9918 3.9918 4.1337 4.1337 7.4313 7.4313 8.8198 8.8198 10.4190 10.4190 10.4967 10.4967 k = 0.5105 0.3238 0.0273 ( 3469 PWs) bands (ev): -28.5438 -28.5438 -28.5421 -28.5421 -11.4469 -11.4469 -11.4379 -11.4379 -10.4176 -10.4176 -10.3809 -10.3809 -10.2476 -10.2476 -10.2305 -10.2305 -7.7831 -7.7831 -7.6726 -7.6726 1.5831 1.5831 1.8537 1.8537 2.2538 2.2538 2.4718 2.4718 2.9256 2.9256 3.0306 3.0306 4.0094 4.0094 4.1301 4.1301 7.5077 7.5077 8.7035 8.7035 10.4293 10.4293 10.5014 10.5014 k = 0.5088 0.3227 0.0395 ( 3473 PWs) bands (ev): -28.5436 -28.5436 -28.5422 -28.5422 -11.4461 -11.4461 -11.4385 -11.4385 -10.4147 -10.4147 -10.3837 -10.3837 -10.2469 -10.2469 -10.2322 -10.2322 -7.7741 -7.7741 -7.6812 -7.6812 1.6078 1.6078 1.8369 1.8369 2.2640 2.2640 2.4453 2.4453 2.9302 2.9302 3.0201 3.0201 4.0259 4.0259 4.1258 4.1258 7.5884 7.5884 8.5888 8.5888 10.4402 10.4402 10.5043 10.5043 k = 0.5070 0.3215 0.0518 ( 3471 PWs) bands (ev): -28.5435 -28.5435 -28.5424 -28.5424 -11.4453 -11.4453 -11.4391 -11.4391 -10.4118 -10.4118 -10.3866 -10.3866 -10.2459 -10.2459 -10.2340 -10.2340 -7.7649 -7.7649 -7.6901 -7.6901 1.6329 1.6329 1.8187 1.8187 2.2753 2.2753 2.4200 2.4200 2.9361 2.9361 3.0096 3.0096 4.0411 4.0411 4.1206 4.1206 7.6732 7.6732 8.4760 8.4760 10.4514 10.4514 10.5053 10.5053 k = 0.5053 0.3204 0.0640 ( 3460 PWs) bands (ev): -28.5433 -28.5433 -28.5425 -28.5425 -11.4444 -11.4444 -11.4398 -11.4398 -10.4087 -10.4087 -10.3896 -10.3896 -10.2448 -10.2448 -10.2357 -10.2357 -7.7555 -7.7555 -7.6992 -7.6992 1.6581 1.6581 1.7990 1.7990 2.2879 2.2879 2.3960 2.3960 2.9431 2.9431 2.9992 2.9992 4.0552 4.0552 4.1146 4.1146 7.7618 7.7618 8.3654 8.3654 10.4624 10.4624 10.5043 10.5043 k = 0.5035 0.3193 0.0762 ( 3458 PWs) bands (ev): -28.5432 -28.5432 -28.5426 -28.5426 -11.4436 -11.4436 -11.4405 -11.4405 -10.4056 -10.4056 -10.3928 -10.3928 -10.2436 -10.2436 -10.2374 -10.2374 -7.7461 -7.7461 -7.7084 -7.7084 1.6832 1.6832 1.7779 1.7779 2.3018 2.3018 2.3737 2.3737 2.9510 2.9510 2.9888 2.9888 4.0680 4.0680 4.1075 4.1075 7.8542 7.8542 8.2573 8.2573 10.4727 10.4727 10.5014 10.5014 k = 0.5018 0.3182 0.0885 ( 3459 PWs) bands (ev): -28.5431 -28.5431 -28.5428 -28.5428 -11.4428 -11.4428 -11.4412 -11.4412 -10.4024 -10.4024 -10.3959 -10.3959 -10.2422 -10.2422 -10.2391 -10.2391 -7.7366 -7.7366 -7.7177 -7.7177 1.7080 1.7080 1.7556 1.7556 2.3172 2.3172 2.3532 2.3532 2.9597 2.9597 2.9787 2.9787 4.0797 4.0797 4.0993 4.0993 7.9502 7.9502 8.1519 8.1519 10.4821 10.4821 10.4966 10.4966 k = 0.5000 0.3171 0.1007 ( 3466 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4420 -11.4420 -11.4420 -11.4420 -10.3992 -10.3992 -10.3992 -10.3992 -10.2407 -10.2407 -10.2407 -10.2407 -7.7273 -7.7273 -7.7270 -7.7270 1.7322 1.7322 1.7323 1.7323 2.3342 2.3342 2.3344 2.3344 2.9689 2.9689 2.9691 2.9691 4.0900 4.0900 4.0901 4.0901 8.0494 8.0494 8.0495 8.0495 10.4900 10.4900 10.4902 10.4902 k = 0.5000 0.3171 0.1007 ( 3466 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4420 -11.4420 -11.4420 -11.4420 -10.3992 -10.3992 -10.3992 -10.3992 -10.2407 -10.2407 -10.2407 -10.2407 -7.7273 -7.7273 -7.7270 -7.7270 1.7322 1.7322 1.7323 1.7323 2.3342 2.3342 2.3344 2.3344 2.9689 2.9689 2.9691 2.9691 4.0900 4.0900 4.0901 4.0901 8.0494 8.0494 8.0495 8.0495 10.4900 10.4900 10.4902 10.4902 k = 0.5071 0.3059 0.1007 ( 3464 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4423 -11.4423 -11.4416 -11.4416 -10.4001 -10.4001 -10.3982 -10.3982 -10.2411 -10.2411 -10.2404 -10.2404 -7.7276 -7.7276 -7.7267 -7.7267 1.7318 1.7318 1.7320 1.7320 2.3340 2.3340 2.3357 2.3357 2.9680 2.9680 2.9691 2.9691 4.0901 4.0901 4.0903 4.0903 8.0522 8.0522 8.0523 8.0523 10.4874 10.4874 10.4880 10.4880 k = 0.5141 0.2948 0.1007 ( 3466 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4426 -11.4426 -11.4413 -11.4413 -10.4008 -10.4008 -10.3970 -10.3970 -10.2418 -10.2418 -10.2405 -10.2405 -7.7278 -7.7278 -7.7262 -7.7262 1.7309 1.7309 1.7311 1.7311 2.3349 2.3349 2.3383 2.3383 2.9660 2.9660 2.9683 2.9683 4.0904 4.0904 4.0907 4.0907 8.0607 8.0607 8.0608 8.0608 10.4800 10.4800 10.4810 10.4810 k = 0.5212 0.2836 0.1007 ( 3462 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4429 -11.4429 -11.4409 -11.4409 -10.4014 -10.4014 -10.3957 -10.3957 -10.2427 -10.2427 -10.2407 -10.2407 -7.7280 -7.7280 -7.7257 -7.7257 1.7293 1.7293 1.7295 1.7295 2.3369 2.3369 2.3419 2.3419 2.9632 2.9632 2.9666 2.9666 4.0910 4.0910 4.0913 4.0913 8.0748 8.0748 8.0749 8.0749 10.4679 10.4679 10.4693 10.4693 k = 0.5283 0.2725 0.1007 ( 3464 PWs) bands (ev): -28.5429 -28.5429 -28.5429 -28.5429 -11.4432 -11.4432 -11.4405 -11.4405 -10.4019 -10.4019 -10.3943 -10.3943 -10.2439 -10.2439 -10.2412 -10.2412 -7.7282 -7.7282 -7.7251 -7.7251 1.7271 1.7271 1.7273 1.7273 2.3400 2.3400 2.3466 2.3466 2.9596 2.9596 2.9640 2.9640 4.0919 4.0919 4.0922 4.0922 8.0945 8.0945 8.0946 8.0946 10.4512 10.4512 10.4530 10.4530 k = 0.5354 0.2613 0.1007 ( 3466 PWs) bands (ev): -28.5430 -28.5430 -28.5430 -28.5430 -11.4434 -11.4434 -11.4400 -11.4400 -10.4023 -10.4023 -10.3928 -10.3928 -10.2453 -10.2453 -10.2419 -10.2419 -7.7283 -7.7283 -7.7244 -7.7244 1.7243 1.7243 1.7245 1.7245 2.3443 2.3443 2.3523 2.3523 2.9551 2.9551 2.9607 2.9607 4.0930 4.0930 4.0933 4.0933 8.1195 8.1195 8.1197 8.1197 10.4301 10.4301 10.4323 10.4323 k = 0.5424 0.2502 0.1007 ( 3476 PWs) bands (ev): -28.5430 -28.5430 -28.5430 -28.5430 -11.4436 -11.4436 -11.4396 -11.4396 -10.4026 -10.4026 -10.3911 -10.3911 -10.2469 -10.2469 -10.2427 -10.2427 -7.7283 -7.7283 -7.7237 -7.7237 1.7208 1.7208 1.7213 1.7213 2.3496 2.3496 2.3589 2.3589 2.9498 2.9498 2.9565 2.9565 4.0943 4.0943 4.0946 4.0946 8.1499 8.1499 8.1500 8.1500 10.4050 10.4050 10.4074 10.4074 k = 0.5495 0.2390 0.1007 ( 3480 PWs) bands (ev): -28.5430 -28.5430 -28.5430 -28.5430 -11.4438 -11.4438 -11.4391 -11.4391 -10.4027 -10.4027 -10.3893 -10.3893 -10.2486 -10.2486 -10.2438 -10.2438 -7.7283 -7.7283 -7.7230 -7.7230 1.7167 1.7167 1.7175 1.7175 2.3559 2.3559 2.3665 2.3665 2.9439 2.9439 2.9517 2.9517 4.0960 4.0960 4.0962 4.0962 8.1853 8.1853 8.1855 8.1855 10.3761 10.3761 10.3787 10.3787 k = 0.5566 0.2279 0.1007 ( 3482 PWs) bands (ev): -28.5430 -28.5430 -28.5430 -28.5430 -11.4440 -11.4440 -11.4387 -11.4387 -10.4028 -10.4028 -10.3874 -10.3874 -10.2506 -10.2506 -10.2449 -10.2449 -7.7283 -7.7283 -7.7222 -7.7222 1.7120 1.7120 1.7132 1.7132 2.3633 2.3633 2.3750 2.3750 2.9374 2.9374 2.9463 2.9463 4.0979 4.0979 4.0981 4.0981 8.2257 8.2257 8.2259 8.2259 10.3439 10.3439 10.3466 10.3466 k = 0.5636 0.2167 0.1007 ( 3480 PWs) bands (ev): -28.5430 -28.5430 -28.5430 -28.5430 -11.4441 -11.4441 -11.4382 -11.4382 -10.4027 -10.4027 -10.3854 -10.3854 -10.2526 -10.2526 -10.2462 -10.2462 -7.7282 -7.7282 -7.7214 -7.7214 1.7068 1.7068 1.7084 1.7084 2.3716 2.3716 2.3842 2.3842 2.9304 2.9304 2.9404 2.9404 4.1000 4.1000 4.1002 4.1002 8.2707 8.2707 8.2709 8.2709 10.3087 10.3087 10.3114 10.3114 k = 0.5707 0.2056 0.1007 ( 3478 PWs) bands (ev): -28.5431 -28.5431 -28.5431 -28.5431 -11.4443 -11.4443 -11.4377 -11.4377 -10.4026 -10.4026 -10.3834 -10.3834 -10.2548 -10.2548 -10.2476 -10.2476 -7.7281 -7.7281 -7.7206 -7.7206 1.7010 1.7010 1.7032 1.7032 2.3808 2.3808 2.3942 2.3942 2.9229 2.9229 2.9340 2.9340 4.1024 4.1024 4.1027 4.1027 8.3200 8.3200 8.3202 8.3202 10.2713 10.2713 10.2739 10.2739 k = 0.5778 0.1944 0.1007 ( 3480 PWs) bands (ev): -28.5431 -28.5431 -28.5431 -28.5431 -11.4444 -11.4444 -11.4372 -11.4372 -10.4024 -10.4024 -10.3812 -10.3812 -10.2571 -10.2571 -10.2490 -10.2490 -7.7280 -7.7280 -7.7197 -7.7197 1.6948 1.6948 1.6976 1.6976 2.3908 2.3908 2.4049 2.4049 2.9151 2.9151 2.9272 2.9272 4.1049 4.1049 4.1054 4.1054 8.3734 8.3734 8.3735 8.3735 10.2320 10.2320 10.2345 10.2345 k = 0.5849 0.1833 0.1007 ( 3482 PWs) bands (ev): -28.5432 -28.5432 -28.5432 -28.5432 -11.4444 -11.4444 -11.4366 -11.4366 -10.4021 -10.4021 -10.3790 -10.3790 -10.2594 -10.2594 -10.2504 -10.2504 -7.7279 -7.7279 -7.7189 -7.7189 1.6881 1.6881 1.6916 1.6916 2.4016 2.4016 2.4162 2.4162 2.9072 2.9072 2.9202 2.9202 4.1076 4.1076 4.1083 4.1083 8.4303 8.4303 8.4305 8.4305 10.1917 10.1917 10.1939 10.1939 k = 0.5919 0.1721 0.1007 ( 3482 PWs) bands (ev): -28.5432 -28.5432 -28.5432 -28.5432 -11.4445 -11.4445 -11.4361 -11.4361 -10.4018 -10.4018 -10.3767 -10.3767 -10.2617 -10.2617 -10.2518 -10.2518 -7.7278 -7.7278 -7.7182 -7.7182 1.6809 1.6809 1.6852 1.6852 2.4131 2.4131 2.4281 2.4281 2.8991 2.8991 2.9131 2.9131 4.1105 4.1105 4.1115 4.1115 8.4903 8.4903 8.4904 8.4904 10.1510 10.1510 10.1529 10.1529 k = 0.5990 0.1610 0.1007 ( 3484 PWs) bands (ev): -28.5433 -28.5433 -28.5433 -28.5433 -11.4445 -11.4445 -11.4355 -11.4355 -10.4014 -10.4014 -10.3744 -10.3744 -10.2640 -10.2640 -10.2532 -10.2532 -7.7277 -7.7277 -7.7174 -7.7174 1.6734 1.6734 1.6785 1.6785 2.4252 2.4252 2.4404 2.4404 2.8911 2.8911 2.9059 2.9059 4.1135 4.1135 4.1149 4.1149 8.5528 8.5528 8.5529 8.5529 10.1107 10.1107 10.1122 10.1122 k = 0.6061 0.1498 0.1007 ( 3482 PWs) bands (ev): -28.5434 -28.5434 -28.5434 -28.5434 -11.4444 -11.4444 -11.4350 -11.4350 -10.4010 -10.4010 -10.3721 -10.3721 -10.2663 -10.2663 -10.2545 -10.2545 -7.7276 -7.7276 -7.7167 -7.7167 1.6655 1.6655 1.6715 1.6715 2.4379 2.4379 2.4531 2.4531 2.8832 2.8832 2.8988 2.8988 4.1166 4.1166 4.1184 4.1184 8.6171 8.6171 8.6172 8.6172 10.0718 10.0718 10.0729 10.0729 k = 0.6131 0.1387 0.1007 ( 3484 PWs) bands (ev): -28.5434 -28.5434 -28.5434 -28.5434 -11.4444 -11.4444 -11.4344 -11.4344 -10.4006 -10.4006 -10.3698 -10.3698 -10.2684 -10.2684 -10.2557 -10.2557 -7.7275 -7.7275 -7.7160 -7.7160 1.6574 1.6574 1.6642 1.6642 2.4510 2.4510 2.4661 2.4661 2.8755 2.8755 2.8919 2.8919 4.1199 4.1199 4.1220 4.1220 8.6821 8.6821 8.6824 8.6824 10.0353 10.0353 10.0359 10.0359 k = 0.6202 0.1275 0.1007 ( 3484 PWs) bands (ev): -28.5435 -28.5435 -28.5435 -28.5435 -11.4443 -11.4443 -11.4338 -11.4338 -10.4002 -10.4002 -10.3676 -10.3676 -10.2704 -10.2704 -10.2568 -10.2568 -7.7275 -7.7275 -7.7154 -7.7154 1.6489 1.6489 1.6566 1.6566 2.4645 2.4645 2.4794 2.4794 2.8683 2.8683 2.8852 2.8852 4.1231 4.1231 4.1257 4.1257 8.7469 8.7469 8.7473 8.7473 10.0025 10.0025 10.0026 10.0026 k = 0.6273 0.1164 0.1007 ( 3484 PWs) bands (ev): -28.5436 -28.5436 -28.5436 -28.5436 -11.4442 -11.4442 -11.4332 -11.4332 -10.3997 -10.3997 -10.3654 -10.3654 -10.2721 -10.2721 -10.2578 -10.2578 -7.7276 -7.7276 -7.7149 -7.7149 1.6402 1.6402 1.6488 1.6488 2.4782 2.4782 2.4928 2.4928 2.8616 2.8616 2.8790 2.8790 4.1263 4.1263 4.1293 4.1293 8.8100 8.8100 8.8106 8.8106 9.9743 9.9743 9.9748 9.9748 k = 0.6344 0.1052 0.1007 ( 3476 PWs) bands (ev): -28.5437 -28.5437 -28.5437 -28.5437 -11.4440 -11.4440 -11.4326 -11.4326 -10.3992 -10.3992 -10.3632 -10.3632 -10.2737 -10.2737 -10.2585 -10.2585 -7.7277 -7.7277 -7.7144 -7.7144 1.6314 1.6314 1.6408 1.6408 2.4922 2.4922 2.5062 2.5062 2.8556 2.8556 2.8733 2.8733 4.1294 4.1294 4.1329 4.1329 8.8696 8.8696 8.8705 8.8705 9.9529 9.9529 9.9540 9.9540 k = 0.6414 0.0941 0.1007 ( 3476 PWs) bands (ev): -28.5439 -28.5439 -28.5439 -28.5439 -11.4438 -11.4438 -11.4319 -11.4319 -10.3988 -10.3988 -10.3612 -10.3612 -10.2750 -10.2750 -10.2591 -10.2591 -7.7278 -7.7278 -7.7141 -7.7141 1.6223 1.6223 1.6326 1.6326 2.5064 2.5064 2.5197 2.5197 2.8504 2.8504 2.8683 2.8683 4.1323 4.1323 4.1362 4.1362 8.9239 8.9239 8.9250 8.9250 9.9403 9.9403 9.9420 9.9420 k = 0.6485 0.0829 0.1007 ( 3478 PWs) bands (ev): -28.5440 -28.5440 -28.5440 -28.5440 -11.4435 -11.4435 -11.4313 -11.4313 -10.3983 -10.3983 -10.3594 -10.3594 -10.2760 -10.2760 -10.2594 -10.2594 -7.7281 -7.7281 -7.7138 -7.7138 1.6131 1.6131 1.6242 1.6242 2.5205 2.5205 2.5331 2.5331 2.8461 2.8461 2.8640 2.8640 4.1349 4.1349 4.1393 4.1393 8.9705 8.9705 8.9719 8.9719 9.9386 9.9386 9.9410 9.9410 k = 0.6556 0.0718 0.1007 ( 3478 PWs) bands (ev): -28.5441 -28.5441 -28.5441 -28.5441 -11.4432 -11.4432 -11.4306 -11.4306 -10.3978 -10.3978 -10.3576 -10.3576 -10.2766 -10.2766 -10.2595 -10.2595 -7.7284 -7.7284 -7.7136 -7.7136 1.6038 1.6038 1.6156 1.6156 2.5347 2.5347 2.5463 2.5463 2.8429 2.8429 2.8605 2.8605 4.1372 4.1372 4.1421 4.1421 9.0076 9.0076 9.0093 9.0093 9.9497 9.9497 9.9528 9.9528 k = 0.6626 0.0606 0.1007 ( 3476 PWs) bands (ev): -28.5443 -28.5443 -28.5443 -28.5443 -11.4428 -11.4428 -11.4298 -11.4298 -10.3973 -10.3973 -10.3561 -10.3561 -10.2769 -10.2769 -10.2594 -10.2594 -7.7287 -7.7287 -7.7136 -7.7136 1.5944 1.5944 1.6069 1.6069 2.5488 2.5488 2.5593 2.5593 2.8408 2.8408 2.8581 2.8581 4.1390 4.1390 4.1444 4.1444 9.0338 9.0338 9.0357 9.0357 9.9749 9.9749 9.9784 9.9784 k = 0.6697 0.0495 0.1007 ( 3472 PWs) bands (ev): -28.5445 -28.5445 -28.5445 -28.5445 -11.4424 -11.4424 -11.4291 -11.4291 -10.3968 -10.3968 -10.3547 -10.3547 -10.2767 -10.2767 -10.2590 -10.2590 -7.7292 -7.7292 -7.7136 -7.7136 1.5850 1.5850 1.5981 1.5981 2.5628 2.5628 2.5720 2.5720 2.8400 2.8400 2.8567 2.8567 4.1404 4.1404 4.1462 4.1462 9.0488 9.0488 9.0508 9.0508 10.0141 10.0141 10.0180 10.0180 k = 0.3303-0.5208 0.2842 ( 3472 PWs) bands (ev): -28.5445 -28.5445 -28.5445 -28.5445 -11.4424 -11.4424 -11.4291 -11.4291 -10.3968 -10.3968 -10.3547 -10.3547 -10.2767 -10.2767 -10.2590 -10.2590 -7.7292 -7.7292 -7.7136 -7.7136 1.5850 1.5850 1.5981 1.5981 2.5628 2.5628 2.5720 2.5720 2.8400 2.8400 2.8567 2.8567 4.1404 4.1404 4.1462 4.1462 9.0488 9.0488 9.0508 9.0508 10.0141 10.0141 10.0180 10.0180 k = 0.3233-0.5097 0.2842 ( 3472 PWs) bands (ev): -28.5446 -28.5446 -28.5446 -28.5446 -11.4419 -11.4419 -11.4283 -11.4283 -10.3963 -10.3963 -10.3535 -10.3535 -10.2763 -10.2763 -10.2584 -10.2584 -7.7297 -7.7297 -7.7138 -7.7138 1.5756 1.5756 1.5892 1.5892 2.5765 2.5765 2.5844 2.5844 2.8405 2.8405 2.8564 2.8564 4.1411 4.1411 4.1473 4.1473 9.0534 9.0534 9.0553 9.0553 10.0659 10.0659 10.0701 10.0701 k = 0.3162-0.4987 0.2842 ( 3464 PWs) bands (ev): -28.5448 -28.5448 -28.5448 -28.5448 -11.4413 -11.4413 -11.4274 -11.4274 -10.3958 -10.3958 -10.3524 -10.3524 -10.2754 -10.2754 -10.2576 -10.2576 -7.7303 -7.7303 -7.7140 -7.7140 1.5661 1.5661 1.5802 1.5802 2.5900 2.5900 2.5965 2.5965 2.8423 2.8423 2.8573 2.8573 4.1412 4.1412 4.1478 4.1478 9.0490 9.0490 9.0509 9.0509 10.1285 10.1285 10.1329 10.1329 k = 0.3092-0.4876 0.2842 ( 3464 PWs) bands (ev): -28.5451 -28.5451 -28.5451 -28.5451 -11.4406 -11.4406 -11.4265 -11.4265 -10.3952 -10.3952 -10.3515 -10.3515 -10.2741 -10.2741 -10.2565 -10.2565 -7.7310 -7.7310 -7.7144 -7.7144 1.5567 1.5567 1.5711 1.5711 2.6033 2.6033 2.6083 2.6083 2.8455 2.8455 2.8593 2.8593 4.1406 4.1406 4.1476 4.1476 9.0376 9.0376 9.0394 9.0394 10.1995 10.1995 10.2041 10.2041 k = 0.3022-0.4765 0.2842 ( 3454 PWs) bands (ev): -28.5453 -28.5453 -28.5453 -28.5453 -11.4399 -11.4399 -11.4256 -11.4256 -10.3946 -10.3946 -10.3508 -10.3508 -10.2725 -10.2725 -10.2551 -10.2551 -7.7318 -7.7318 -7.7149 -7.7149 1.5473 1.5473 1.5620 1.5620 2.6164 2.6164 2.6198 2.6198 2.8499 2.8499 2.8627 2.8627 4.1393 4.1393 4.1466 4.1466 9.0209 9.0209 9.0225 9.0225 10.2765 10.2765 10.2811 10.2811 k = 0.2952-0.4654 0.2842 ( 3454 PWs) bands (ev): -28.5455 -28.5455 -28.5455 -28.5455 -11.4391 -11.4391 -11.4246 -11.4246 -10.3940 -10.3940 -10.3501 -10.3501 -10.2706 -10.2706 -10.2536 -10.2536 -7.7327 -7.7327 -7.7155 -7.7155 1.5379 1.5379 1.5528 1.5528 2.6292 2.6292 2.6312 2.6312 2.8557 2.8557 2.8671 2.8671 4.1371 4.1371 4.1447 4.1447 9.0002 9.0002 9.0017 9.0017 10.3566 10.3566 10.3613 10.3613 k = 0.2881-0.4543 0.2842 ( 3456 PWs) bands (ev): -28.5458 -28.5458 -28.5458 -28.5458 -11.4382 -11.4382 -11.4235 -11.4235 -10.3933 -10.3933 -10.3495 -10.3495 -10.2684 -10.2684 -10.2518 -10.2518 -7.7337 -7.7337 -7.7162 -7.7162 1.5286 1.5286 1.5436 1.5436 2.6418 2.6418 2.6424 2.6424 2.8626 2.8626 2.8727 2.8727 4.1341 4.1341 4.1420 4.1420 8.9768 8.9768 8.9783 8.9783 10.4369 10.4369 10.4418 10.4418 k = 0.2811-0.4432 0.2842 ( 3448 PWs) bands (ev): -28.5460 -28.5460 -28.5460 -28.5460 -11.4373 -11.4373 -11.4224 -11.4224 -10.3925 -10.3925 -10.3489 -10.3489 -10.2659 -10.2659 -10.2498 -10.2498 -7.7347 -7.7347 -7.7171 -7.7171 1.5194 1.5194 1.5344 1.5344 2.6537 2.6537 2.6544 2.6544 2.8705 2.8705 2.8794 2.8794 4.1303 4.1303 4.1384 4.1384 8.9516 8.9516 8.9530 8.9530 10.5136 10.5136 10.5187 10.5187 k = 0.2741-0.4322 0.2842 ( 3444 PWs) bands (ev): -28.5463 -28.5463 -28.5463 -28.5463 -11.4362 -11.4362 -11.4212 -11.4212 -10.3917 -10.3917 -10.3484 -10.3484 -10.2632 -10.2632 -10.2477 -10.2477 -7.7358 -7.7358 -7.7180 -7.7180 1.5102 1.5102 1.5252 1.5252 2.6650 2.6650 2.6668 2.6668 2.8794 2.8794 2.8871 2.8871 4.1257 4.1257 4.1340 4.1340 8.9254 8.9254 8.9267 8.9267 10.5812 10.5812 10.5869 10.5869 k = 0.2670-0.4211 0.2842 ( 3444 PWs) bands (ev): -28.5466 -28.5466 -28.5466 -28.5466 -11.4350 -11.4350 -11.4200 -11.4200 -10.3908 -10.3908 -10.3479 -10.3479 -10.2603 -10.2603 -10.2453 -10.2453 -7.7370 -7.7370 -7.7191 -7.7191 1.5013 1.5013 1.5161 1.5161 2.6763 2.6763 2.6792 2.6792 2.8891 2.8891 2.8956 2.8956 4.1203 4.1203 4.1287 4.1287 8.8986 8.8986 8.8999 8.8999 10.6328 10.6328 10.6396 10.6396 k = 0.2600-0.4100 0.2842 ( 3444 PWs) bands (ev): -28.5469 -28.5469 -28.5469 -28.5469 -11.4338 -11.4338 -11.4187 -11.4187 -10.3898 -10.3898 -10.3473 -10.3473 -10.2572 -10.2572 -10.2428 -10.2428 -7.7383 -7.7383 -7.7203 -7.7203 1.4924 1.4924 1.5070 1.5070 2.6879 2.6879 2.6916 2.6916 2.8994 2.8994 2.9049 2.9049 4.1142 4.1142 4.1227 4.1227 8.8716 8.8716 8.8729 8.8729 10.6635 10.6635 10.6718 10.6718 k = 0.2530-0.3989 0.2842 ( 3442 PWs) bands (ev): -28.5473 -28.5473 -28.5473 -28.5473 -11.4325 -11.4325 -11.4173 -11.4173 -10.3887 -10.3887 -10.3467 -10.3467 -10.2539 -10.2539 -10.2400 -10.2400 -7.7397 -7.7397 -7.7216 -7.7216 1.4838 1.4838 1.4981 1.4981 2.6997 2.6997 2.7039 2.7039 2.9103 2.9103 2.9149 2.9149 4.1075 4.1075 4.1160 4.1160 8.8448 8.8448 8.8462 8.8462 10.6740 10.6740 10.6839 10.6839 k = 0.2460-0.3878 0.2842 ( 3450 PWs) bands (ev): -28.5476 -28.5476 -28.5476 -28.5476 -11.4311 -11.4311 -11.4159 -11.4159 -10.3875 -10.3875 -10.3460 -10.3460 -10.2505 -10.2505 -10.2372 -10.2372 -7.7412 -7.7412 -7.7231 -7.7231 1.4754 1.4754 1.4893 1.4893 2.7116 2.7116 2.7162 2.7162 2.9217 2.9217 2.9255 2.9255 4.1001 4.1001 4.1086 4.1086 8.8185 8.8185 8.8199 8.8199 10.6694 10.6694 10.6806 10.6806 k = 0.2389-0.3768 0.2842 ( 3448 PWs) bands (ev): -28.5479 -28.5479 -28.5479 -28.5479 -11.4296 -11.4296 -11.4144 -11.4144 -10.3862 -10.3862 -10.3453 -10.3453 -10.2469 -10.2469 -10.2342 -10.2342 -7.7427 -7.7427 -7.7246 -7.7246 1.4672 1.4672 1.4807 1.4807 2.7237 2.7237 2.7286 2.7286 2.9335 2.9335 2.9366 2.9366 4.0923 4.0923 4.1007 4.1007 8.7928 8.7928 8.7943 8.7943 10.6541 10.6541 10.6662 10.6662 k = 0.2319-0.3657 0.2842 ( 3450 PWs) bands (ev): -28.5483 -28.5483 -28.5483 -28.5483 -11.4280 -11.4280 -11.4129 -11.4129 -10.3849 -10.3849 -10.3445 -10.3445 -10.2433 -10.2433 -10.2310 -10.2310 -7.7443 -7.7443 -7.7263 -7.7263 1.4592 1.4592 1.4724 1.4724 2.7359 2.7359 2.7408 2.7408 2.9456 2.9456 2.9481 2.9481 4.0841 4.0841 4.0923 4.0923 8.7679 8.7679 8.7696 8.7696 10.6309 10.6309 10.6436 10.6436 k = 0.2249-0.3546 0.2842 ( 3452 PWs) bands (ev): -28.5487 -28.5487 -28.5487 -28.5487 -11.4263 -11.4263 -11.4113 -11.4113 -10.3834 -10.3834 -10.3437 -10.3437 -10.2395 -10.2395 -10.2277 -10.2277 -7.7460 -7.7460 -7.7280 -7.7280 1.4516 1.4516 1.4642 1.4642 2.7480 2.7480 2.7528 2.7528 2.9580 2.9580 2.9601 2.9601 4.0757 4.0757 4.0837 4.0837 8.7441 8.7441 8.7458 8.7458 10.6011 10.6011 10.6141 10.6141 k = 0.2178-0.3435 0.2842 ( 3450 PWs) bands (ev): -28.5490 -28.5490 -28.5490 -28.5490 -11.4246 -11.4246 -11.4097 -11.4097 -10.3819 -10.3819 -10.3428 -10.3428 -10.2356 -10.2356 -10.2243 -10.2243 -7.7477 -7.7477 -7.7299 -7.7299 1.4443 1.4443 1.4564 1.4564 2.7601 2.7601 2.7645 2.7645 2.9707 2.9707 2.9724 2.9724 4.0672 4.0672 4.0750 4.0750 8.7213 8.7213 8.7232 8.7232 10.5656 10.5656 10.5788 10.5788 k = 0.2108-0.3324 0.2842 ( 3452 PWs) bands (ev): -28.5494 -28.5494 -28.5494 -28.5494 -11.4228 -11.4228 -11.4080 -11.4080 -10.3803 -10.3803 -10.3419 -10.3419 -10.2316 -10.2316 -10.2208 -10.2208 -7.7495 -7.7495 -7.7319 -7.7319 1.4373 1.4373 1.4488 1.4488 2.7718 2.7718 2.7758 2.7758 2.9836 2.9836 2.9851 2.9851 4.0587 4.0587 4.0662 4.0662 8.6997 8.6997 8.7018 8.7018 10.5250 10.5250 10.5380 10.5380 k = 0.2038-0.3214 0.2842 ( 3454 PWs) bands (ev): -28.5498 -28.5498 -28.5498 -28.5498 -11.4209 -11.4209 -11.4063 -11.4063 -10.3786 -10.3786 -10.3409 -10.3409 -10.2276 -10.2276 -10.2172 -10.2172 -7.7514 -7.7514 -7.7339 -7.7339 1.4306 1.4306 1.4416 1.4416 2.7832 2.7832 2.7866 2.7866 2.9968 2.9968 2.9980 2.9980 4.0504 4.0504 4.0576 4.0576 8.6795 8.6795 8.6818 8.6818 10.4795 10.4795 10.4922 10.4922 k = 0.1968-0.3103 0.2842 ( 3454 PWs) bands (ev): -28.5502 -28.5502 -28.5502 -28.5502 -11.4190 -11.4190 -11.4045 -11.4045 -10.3768 -10.3768 -10.3399 -10.3399 -10.2235 -10.2235 -10.2135 -10.2135 -7.7533 -7.7533 -7.7361 -7.7361 1.4244 1.4244 1.4347 1.4347 2.7939 2.7939 2.7967 2.7967 3.0102 3.0102 3.0113 3.0113 4.0424 4.0424 4.0492 4.0492 8.6606 8.6606 8.6631 8.6631 10.4296 10.4296 10.4419 10.4419 k = 0.1897-0.2992 0.2842 ( 3464 PWs) bands (ev): -28.5506 -28.5506 -28.5506 -28.5506 -11.4170 -11.4170 -11.4028 -11.4028 -10.3749 -10.3749 -10.3388 -10.3388 -10.2192 -10.2192 -10.2096 -10.2096 -7.7553 -7.7553 -7.7383 -7.7383 1.4184 1.4184 1.4282 1.4282 2.8039 2.8039 2.8060 2.8060 3.0238 3.0238 3.0249 3.0249 4.0349 4.0349 4.0413 4.0413 8.6432 8.6432 8.6459 8.6459 10.3757 10.3757 10.3875 10.3875 k = 0.1827-0.2881 0.2842 ( 3468 PWs) bands (ev): -28.5510 -28.5510 -28.5510 -28.5510 -11.4150 -11.4150 -11.4010 -11.4010 -10.3730 -10.3730 -10.3377 -10.3377 -10.2150 -10.2150 -10.2058 -10.2058 -7.7573 -7.7573 -7.7406 -7.7406 1.4129 1.4129 1.4221 1.4221 2.8130 2.8130 2.8143 2.8143 3.0377 3.0377 3.0388 3.0388 4.0281 4.0281 4.0340 4.0340 8.6274 8.6274 8.6302 8.6302 10.3184 10.3184 10.3295 10.3295 k = 0.1757-0.2770 0.2842 ( 3464 PWs) bands (ev): -28.5514 -28.5514 -28.5514 -28.5514 -11.4130 -11.4130 -11.3992 -11.3992 -10.3711 -10.3711 -10.3366 -10.3366 -10.2106 -10.2106 -10.2018 -10.2018 -7.7594 -7.7594 -7.7430 -7.7430 1.4078 1.4078 1.4164 1.4164 2.8212 2.8212 2.8216 2.8216 3.0517 3.0517 3.0528 3.0528 4.0220 4.0220 4.0275 4.0275 8.6130 8.6130 8.6160 8.6160 10.2582 10.2582 10.2686 10.2686 k = 0.1687-0.2659 0.2842 ( 3460 PWs) bands (ev): -28.5519 -28.5519 -28.5519 -28.5519 -11.4109 -11.4109 -11.3975 -11.3975 -10.3691 -10.3691 -10.3355 -10.3355 -10.2063 -10.2063 -10.1978 -10.1978 -7.7615 -7.7615 -7.7455 -7.7455 1.4031 1.4031 1.4111 1.4111 2.8279 2.8279 2.8283 2.8283 3.0658 3.0658 3.0670 3.0670 4.0168 4.0168 4.0218 4.0218 8.6002 8.6002 8.6034 8.6034 10.1959 10.1959 10.2055 10.2055 k = 0.1616-0.2549 0.2842 ( 3460 PWs) bands (ev): -28.5523 -28.5523 -28.5523 -28.5523 -11.4088 -11.4088 -11.3957 -11.3957 -10.3670 -10.3670 -10.3345 -10.3345 -10.2018 -10.2018 -10.1937 -10.1937 -7.7636 -7.7636 -7.7480 -7.7480 1.3988 1.3988 1.4061 1.4061 2.8330 2.8330 2.8342 2.8342 3.0800 3.0800 3.0812 3.0812 4.0126 4.0126 4.0171 4.0171 8.5888 8.5888 8.5923 8.5923 10.1320 10.1320 10.1409 10.1409 k = 0.1546-0.2438 0.2842 ( 3454 PWs) bands (ev): -28.5527 -28.5527 -28.5527 -28.5527 -11.4068 -11.4068 -11.3940 -11.3940 -10.3650 -10.3650 -10.3334 -10.3334 -10.1974 -10.1974 -10.1896 -10.1896 -7.7658 -7.7658 -7.7506 -7.7506 1.3949 1.3949 1.4016 1.4016 2.8371 2.8371 2.8391 2.8391 3.0941 3.0941 3.0953 3.0953 4.0095 4.0095 4.0134 4.0134 8.5790 8.5790 8.5826 8.5826 10.0675 10.0675 10.0756 10.0756 k = 0.1476-0.2327 0.2842 ( 3450 PWs) bands (ev): -28.5531 -28.5531 -28.5531 -28.5531 -11.4047 -11.4047 -11.3923 -11.3923 -10.3629 -10.3629 -10.3324 -10.3324 -10.1929 -10.1929 -10.1854 -10.1854 -7.7679 -7.7679 -7.7532 -7.7532 1.3913 1.3913 1.3974 1.3974 2.8402 2.8402 2.8428 2.8428 3.1080 3.1080 3.1092 3.1092 4.0075 4.0075 4.0110 4.0110 8.5705 8.5705 8.5743 8.5743 10.0028 10.0028 10.0103 10.0103 k = 0.1405-0.2216 0.2842 ( 3444 PWs) bands (ev): -28.5535 -28.5535 -28.5535 -28.5535 -11.4026 -11.4026 -11.3907 -11.3907 -10.3608 -10.3608 -10.3314 -10.3314 -10.1884 -10.1884 -10.1813 -10.1813 -7.7701 -7.7701 -7.7559 -7.7559 1.3881 1.3881 1.3937 1.3937 2.8422 2.8422 2.8455 2.8455 3.1216 3.1216 3.1228 3.1228 4.0067 4.0067 4.0098 4.0098 8.5633 8.5633 8.5672 8.5672 9.9390 9.9390 9.9457 9.9457 k = 0.1335-0.2105 0.2842 ( 3444 PWs) bands (ev): -28.5538 -28.5538 -28.5538 -28.5538 -11.4006 -11.4006 -11.3891 -11.3891 -10.3588 -10.3588 -10.3305 -10.3305 -10.1839 -10.1839 -10.1771 -10.1771 -7.7723 -7.7723 -7.7586 -7.7586 1.3852 1.3852 1.3903 1.3903 2.8434 2.8434 2.8473 2.8473 3.1347 3.1347 3.1359 3.1359 4.0072 4.0072 4.0097 4.0097 8.5571 8.5571 8.5612 8.5612 9.8765 9.8765 9.8826 9.8826 k = 0.1265-0.1995 0.2842 ( 3438 PWs) bands (ev): -28.5542 -28.5542 -28.5542 -28.5542 -11.3986 -11.3986 -11.3875 -11.3875 -10.3567 -10.3567 -10.3296 -10.3296 -10.1794 -10.1794 -10.1730 -10.1730 -7.7744 -7.7744 -7.7613 -7.7613 1.3827 1.3827 1.3872 1.3872 2.8437 2.8437 2.8481 2.8481 3.1472 3.1472 3.1484 3.1484 4.0089 4.0089 4.0110 4.0110 8.5519 8.5519 8.5561 8.5561 9.8162 9.8162 9.8217 9.8217 k = 0.1195-0.1884 0.2842 ( 3440 PWs) bands (ev): -28.5546 -28.5546 -28.5546 -28.5546 -11.3967 -11.3967 -11.3860 -11.3860 -10.3546 -10.3546 -10.3288 -10.3288 -10.1749 -10.1749 -10.1689 -10.1689 -7.7766 -7.7766 -7.7640 -7.7640 1.3805 1.3805 1.3845 1.3845 2.8433 2.8433 2.8481 2.8481 3.1590 3.1590 3.1602 3.1602 4.0117 4.0117 4.0134 4.0134 8.5474 8.5474 8.5517 8.5517 9.7585 9.7585 9.7636 9.7636 k = 0.1124-0.1773 0.2842 ( 3436 PWs) bands (ev): -28.5550 -28.5550 -28.5550 -28.5550 -11.3948 -11.3948 -11.3846 -11.3846 -10.3526 -10.3526 -10.3281 -10.3281 -10.1706 -10.1706 -10.1649 -10.1649 -7.7787 -7.7787 -7.7667 -7.7667 1.3785 1.3785 1.3821 1.3821 2.8424 2.8424 2.8475 2.8475 3.1700 3.1700 3.1712 3.1712 4.0156 4.0156 4.0170 4.0170 8.5434 8.5434 8.5477 8.5477 9.7043 9.7043 9.7088 9.7088 k = 0.1054-0.1662 0.2842 ( 3440 PWs) bands (ev): -28.5553 -28.5553 -28.5553 -28.5553 -11.3929 -11.3929 -11.3833 -11.3833 -10.3506 -10.3506 -10.3274 -10.3274 -10.1663 -10.1663 -10.1610 -10.1610 -7.7807 -7.7807 -7.7693 -7.7693 1.3768 1.3768 1.3800 1.3800 2.8410 2.8410 2.8463 2.8463 3.1802 3.1802 3.1813 3.1813 4.0205 4.0205 4.0215 4.0215 8.5397 8.5397 8.5439 8.5439 9.6538 9.6538 9.6578 9.6578 k = 0.0984-0.1551 0.2842 ( 3442 PWs) bands (ev): -28.5556 -28.5556 -28.5556 -28.5556 -11.3912 -11.3912 -11.3821 -11.3821 -10.3487 -10.3487 -10.3268 -10.3268 -10.1621 -10.1621 -10.1572 -10.1572 -7.7827 -7.7827 -7.7720 -7.7720 1.3753 1.3753 1.3781 1.3781 2.8392 2.8392 2.8447 2.8447 3.1895 3.1895 3.1906 3.1906 4.0263 4.0263 4.0270 4.0270 8.5359 8.5359 8.5401 8.5401 9.6077 9.6077 9.6113 9.6113 k = 0.0914-0.1441 0.2842 ( 3440 PWs) bands (ev): -28.5559 -28.5559 -28.5559 -28.5559 -11.3895 -11.3895 -11.3809 -11.3809 -10.3468 -10.3468 -10.3264 -10.3264 -10.1580 -10.1580 -10.1535 -10.1535 -7.7846 -7.7846 -7.7745 -7.7745 1.3741 1.3741 1.3765 1.3765 2.8371 2.8371 2.8427 2.8427 3.1979 3.1979 3.1989 3.1989 4.0327 4.0327 4.0333 4.0333 8.5318 8.5318 8.5359 8.5359 9.5664 9.5664 9.5694 9.5694 k = 0.0843-0.1330 0.2842 ( 3444 PWs) bands (ev): -28.5562 -28.5562 -28.5562 -28.5562 -11.3878 -11.3878 -11.3799 -11.3799 -10.3450 -10.3450 -10.3260 -10.3260 -10.1541 -10.1541 -10.1500 -10.1500 -7.7864 -7.7864 -7.7770 -7.7770 1.3730 1.3730 1.3751 1.3751 2.8349 2.8349 2.8405 2.8405 3.2053 3.2053 3.2063 3.2063 4.0398 4.0398 4.0401 4.0401 8.5273 8.5273 8.5313 8.5313 9.5299 9.5299 9.5326 9.5326 k = 0.0773-0.1219 0.2842 ( 3448 PWs) bands (ev): -28.5565 -28.5565 -28.5565 -28.5565 -11.3863 -11.3863 -11.3789 -11.3789 -10.3432 -10.3432 -10.3257 -10.3257 -10.1504 -10.1504 -10.1466 -10.1466 -7.7881 -7.7881 -7.7794 -7.7794 1.3721 1.3721 1.3739 1.3739 2.8327 2.8327 2.8381 2.8381 3.2119 3.2119 3.2129 3.2129 4.0472 4.0472 4.0474 4.0474 8.5223 8.5223 8.5260 8.5260 9.4986 9.4986 9.5008 9.5008 k = 0.0703-0.1108 0.2842 ( 3452 PWs) bands (ev): -28.5568 -28.5568 -28.5568 -28.5568 -11.3848 -11.3848 -11.3781 -11.3781 -10.3415 -10.3415 -10.3255 -10.3255 -10.1469 -10.1469 -10.1434 -10.1434 -7.7897 -7.7897 -7.7817 -7.7817 1.3713 1.3713 1.3728 1.3728 2.8305 2.8305 2.8357 2.8357 3.2176 3.2176 3.2185 3.2185 4.0547 4.0547 4.0548 4.0548 8.5166 8.5166 8.5201 8.5201 9.4723 9.4723 9.4741 9.4741 k = 0.0632-0.0997 0.2842 ( 3458 PWs) bands (ev): -28.5570 -28.5570 -28.5570 -28.5570 -11.3835 -11.3835 -11.3773 -11.3773 -10.3399 -10.3399 -10.3254 -10.3254 -10.1436 -10.1436 -10.1405 -10.1405 -7.7911 -7.7911 -7.7839 -7.7839 1.3707 1.3707 1.3719 1.3719 2.8283 2.8283 2.8333 2.8333 3.2225 3.2225 3.2234 3.2234 4.0623 4.0623 4.0624 4.0624 8.5104 8.5104 8.5136 8.5136 9.4510 9.4510 9.4524 9.4524 k = 0.0562-0.0886 0.2842 ( 3456 PWs) bands (ev): -28.5572 -28.5572 -28.5572 -28.5572 -11.3822 -11.3822 -11.3767 -11.3767 -10.3383 -10.3383 -10.3254 -10.3254 -10.1406 -10.1406 -10.1378 -10.1378 -7.7924 -7.7924 -7.7860 -7.7860 1.3702 1.3702 1.3712 1.3712 2.8263 2.8263 2.8309 2.8309 3.2267 3.2267 3.2275 3.2275 4.0696 4.0696 4.0698 4.0698 8.5038 8.5038 8.5067 8.5067 9.4341 9.4341 9.4352 9.4352 k = 0.0492-0.0776 0.2842 ( 3456 PWs) bands (ev): -28.5574 -28.5574 -28.5574 -28.5574 -11.3810 -11.3810 -11.3762 -11.3762 -10.3368 -10.3368 -10.3254 -10.3254 -10.1378 -10.1378 -10.1354 -10.1354 -7.7935 -7.7935 -7.7878 -7.7878 1.3697 1.3697 1.3706 1.3706 2.8245 2.8245 2.8287 2.8287 3.2302 3.2302 3.2309 3.2309 4.0766 4.0766 4.0768 4.0768 8.4969 8.4969 8.4995 8.4995 9.4214 9.4214 9.4222 9.4222 k = 0.0422-0.0665 0.2842 ( 3458 PWs) bands (ev): -28.5576 -28.5576 -28.5576 -28.5576 -11.3799 -11.3799 -11.3758 -11.3758 -10.3354 -10.3354 -10.3256 -10.3256 -10.1354 -10.1354 -10.1333 -10.1333 -7.7945 -7.7945 -7.7896 -7.7896 1.3694 1.3694 1.3700 1.3700 2.8229 2.8229 2.8267 2.8267 3.2331 3.2331 3.2337 3.2337 4.0830 4.0830 4.0832 4.0832 8.4901 8.4901 8.4923 8.4923 9.4122 9.4122 9.4127 9.4127 k = 0.0351-0.0554 0.2842 ( 3456 PWs) bands (ev): -28.5577 -28.5577 -28.5577 -28.5577 -11.3790 -11.3790 -11.3755 -11.3755 -10.3341 -10.3341 -10.3259 -10.3259 -10.1332 -10.1332 -10.1316 -10.1316 -7.7952 -7.7952 -7.7911 -7.7911 1.3691 1.3691 1.3696 1.3696 2.8216 2.8216 2.8248 2.8248 3.2354 3.2354 3.2360 3.2360 4.0888 4.0888 4.0890 4.0890 8.4837 8.4837 8.4855 8.4855 9.4059 9.4059 9.4062 9.4062 k = 0.0281-0.0443 0.2842 ( 3454 PWs) bands (ev): -28.5579 -28.5579 -28.5579 -28.5579 -11.3781 -11.3781 -11.3753 -11.3753 -10.3329 -10.3329 -10.3263 -10.3263 -10.1314 -10.1314 -10.1301 -10.1301 -7.7957 -7.7957 -7.7925 -7.7925 1.3689 1.3689 1.3693 1.3693 2.8206 2.8206 2.8232 2.8232 3.2372 3.2372 3.2377 3.2377 4.0937 4.0937 4.0939 4.0939 8.4779 8.4779 8.4794 8.4794 9.4018 9.4018 9.4020 9.4020 k = 0.0211-0.0332 0.2842 ( 3458 PWs) bands (ev): -28.5580 -28.5580 -28.5580 -28.5580 -11.3774 -11.3774 -11.3753 -11.3753 -10.3317 -10.3317 -10.3268 -10.3268 -10.1300 -10.1300 -10.1290 -10.1290 -7.7961 -7.7961 -7.7936 -7.7936 1.3687 1.3687 1.3690 1.3690 2.8198 2.8198 2.8218 2.8218 3.2386 3.2386 3.2390 3.2390 4.0976 4.0976 4.0978 4.0978 8.4732 8.4732 8.4743 8.4743 9.3994 9.3994 9.3995 9.3995 k = 0.0141-0.0222 0.2842 ( 3468 PWs) bands (ev): -28.5580 -28.5580 -28.5580 -28.5580 -11.3767 -11.3767 -11.3753 -11.3753 -10.3307 -10.3307 -10.3274 -10.3274 -10.1289 -10.1289 -10.1282 -10.1282 -7.7963 -7.7963 -7.7946 -7.7946 1.3686 1.3686 1.3688 1.3688 2.8194 2.8194 2.8207 2.8207 3.2395 3.2395 3.2399 3.2399 4.1005 4.1005 4.1006 4.1006 8.4696 8.4696 8.4704 8.4704 9.3980 9.3980 9.3981 9.3981 k = 0.0070-0.0111 0.2842 ( 3470 PWs) bands (ev): -28.5581 -28.5581 -28.5581 -28.5581 -11.3762 -11.3762 -11.3755 -11.3755 -10.3297 -10.3297 -10.3281 -10.3281 -10.1282 -10.1282 -10.1278 -10.1278 -7.7962 -7.7962 -7.7953 -7.7953 1.3686 1.3686 1.3687 1.3687 2.8192 2.8192 2.8199 2.8199 3.2401 3.2401 3.2404 3.2404 4.1023 4.1023 4.1024 4.1024 8.4675 8.4675 8.4679 8.4679 9.3974 9.3974 9.3975 9.3975 k = 0.0000 0.0000 0.2842 ( 3472 PWs) bands (ev): -28.5581 -28.5581 -28.5581 -28.5581 -11.3758 -11.3758 -11.3758 -11.3758 -10.3288 -10.3288 -10.3288 -10.3288 -10.1278 -10.1278 -10.1278 -10.1278 -7.7960 -7.7960 -7.7957 -7.7957 1.3686 1.3686 1.3687 1.3687 2.8194 2.8194 2.8195 2.8195 3.2403 3.2403 3.2405 3.2405 4.1029 4.1029 4.1030 4.1030 8.4668 8.4668 8.4669 8.4669 9.3972 9.3972 9.3973 9.3973 k = 0.0000 0.0000 0.2842 ( 3472 PWs) bands (ev): -28.5581 -28.5581 -28.5581 -28.5581 -11.3758 -11.3758 -11.3758 -11.3758 -10.3288 -10.3288 -10.3288 -10.3288 -10.1278 -10.1278 -10.1278 -10.1278 -7.7960 -7.7960 -7.7957 -7.7957 1.3686 1.3686 1.3687 1.3687 2.8194 2.8194 2.8195 2.8195 3.2403 3.2403 3.2405 3.2405 4.1029 4.1029 4.1030 4.1030 8.4668 8.4668 8.4669 8.4669 9.3972 9.3972 9.3973 9.3973 k = 0.0110 0.0070 0.2842 ( 3467 PWs) bands (ev): -28.5581 -28.5581 -28.5580 -28.5580 -11.3765 -11.3765 -11.3753 -11.3753 -10.3302 -10.3302 -10.3275 -10.3275 -10.1286 -10.1286 -10.1275 -10.1275 -7.7987 -7.7987 -7.7928 -7.7928 1.3684 1.3684 1.3695 1.3695 2.8144 2.8144 2.8245 2.8245 3.2283 3.2283 3.2519 3.2519 4.0978 4.0978 4.1069 4.1069 8.4402 8.4402 8.4900 8.4900 9.3938 9.3938 9.4053 9.4053 k = 0.0220 0.0140 0.2842 ( 3459 PWs) bands (ev): -28.5580 -28.5580 -28.5580 -28.5580 -11.3772 -11.3772 -11.3749 -11.3749 -10.3317 -10.3317 -10.3263 -10.3263 -10.1298 -10.1298 -10.1276 -10.1276 -7.8012 -7.8012 -7.7895 -7.7895 1.3686 1.3686 1.3711 1.3711 2.8093 2.8093 2.8294 2.8294 3.2158 3.2158 3.2627 3.2627 4.0916 4.0916 4.1097 4.1097 8.4101 8.4101 8.5097 8.5097 9.3947 9.3947 9.4176 9.4176 k = 0.0330 0.0210 0.2842 ( 3459 PWs) bands (ev): -28.5580 -28.5580 -28.5579 -28.5579 -11.3781 -11.3781 -11.3746 -11.3746 -10.3332 -10.3332 -10.3253 -10.3253 -10.1314 -10.1314 -10.1282 -10.1282 -7.8034 -7.8034 -7.7862 -7.7862 1.3694 1.3694 1.3733 1.3733 2.8042 2.8042 2.8342 2.8342 3.2029 3.2029 3.2727 3.2727 4.0842 4.0842 4.1113 4.1113 8.3764 8.3764 8.5264 8.5264 9.4001 9.4001 9.4340 9.4340 k = 0.0441 0.0279 0.2842 ( 3459 PWs) bands (ev): -28.5579 -28.5579 -28.5577 -28.5577 -11.3791 -11.3791 -11.3745 -11.3745 -10.3348 -10.3348 -10.3243 -10.3243 -10.1334 -10.1334 -10.1292 -10.1292 -7.8053 -7.8053 -7.7827 -7.7827 1.3706 1.3706 1.3764 1.3764 2.7991 2.7991 2.8388 2.8388 3.1898 3.1898 3.2816 3.2816 4.0756 4.0756 4.1119 4.1119 8.3396 8.3396 8.5403 8.5403 9.4095 9.4095 9.4542 9.4542 k = 0.0551 0.0349 0.2842 ( 3458 PWs) bands (ev): -28.5577 -28.5577 -28.5575 -28.5575 -11.3802 -11.3802 -11.3746 -11.3746 -10.3364 -10.3364 -10.3235 -10.3235 -10.1359 -10.1359 -10.1306 -10.1306 -7.8067 -7.8067 -7.7793 -7.7793 1.3721 1.3721 1.3803 1.3803 2.7941 2.7941 2.8431 2.8431 3.1767 3.1767 3.2895 3.2895 4.0660 4.0660 4.1114 4.1114 8.2998 8.2998 8.5520 8.5520 9.4227 9.4227 9.4777 9.4777 k = 0.0661 0.0419 0.2842 ( 3458 PWs) bands (ev): -28.5575 -28.5575 -28.5573 -28.5573 -11.3814 -11.3814 -11.3748 -11.3748 -10.3381 -10.3381 -10.3228 -10.3228 -10.1388 -10.1388 -10.1323 -10.1323 -7.8077 -7.8077 -7.7758 -7.7758 1.3739 1.3739 1.3850 1.3850 2.7891 2.7891 2.8472 2.8472 3.1635 3.1635 3.2960 3.2960 4.0554 4.0554 4.1099 4.1099 8.2573 8.2573 8.5620 8.5620 9.4393 9.4393 9.5043 9.5043 k = 0.0771 0.0489 0.2842 ( 3456 PWs) bands (ev): -28.5573 -28.5573 -28.5571 -28.5571 -11.3827 -11.3827 -11.3751 -11.3751 -10.3398 -10.3398 -10.3222 -10.3222 -10.1420 -10.1420 -10.1345 -10.1345 -7.8082 -7.8082 -7.7725 -7.7725 1.3759 1.3759 1.3907 1.3907 2.7843 2.7843 2.8509 2.8509 3.1506 3.1506 3.3013 3.3013 4.0438 4.0438 4.1076 4.1076 8.2125 8.2125 8.5709 8.5709 9.4589 9.4589 9.5335 9.5335 k = 0.0881 0.0559 0.2842 ( 3457 PWs) bands (ev): -28.5571 -28.5571 -28.5568 -28.5568 -11.3841 -11.3841 -11.3756 -11.3756 -10.3415 -10.3415 -10.3219 -10.3219 -10.1455 -10.1455 -10.1370 -10.1370 -7.8082 -7.8082 -7.7693 -7.7693 1.3780 1.3780 1.3973 1.3973 2.7795 2.7795 2.8541 2.8541 3.1380 3.1380 3.3050 3.3050 4.0313 4.0313 4.1046 4.1046 8.1655 8.1655 8.5794 8.5794 9.4812 9.4812 9.5649 9.5649 k = 0.0991 0.0629 0.2842 ( 3461 PWs) bands (ev): -28.5568 -28.5568 -28.5565 -28.5565 -11.3856 -11.3856 -11.3763 -11.3763 -10.3432 -10.3432 -10.3217 -10.3217 -10.1494 -10.1494 -10.1397 -10.1397 -7.8078 -7.8078 -7.7663 -7.7663 1.3802 1.3802 1.4049 1.4049 2.7747 2.7747 2.8569 2.8569 3.1258 3.1258 3.3073 3.3073 4.0180 4.0180 4.1009 4.1009 8.1168 8.1168 8.5878 8.5878 9.5060 9.5060 9.5984 9.5984 k = 0.1102 0.0699 0.2842 ( 3462 PWs) bands (ev): -28.5565 -28.5565 -28.5562 -28.5562 -11.3871 -11.3871 -11.3771 -11.3771 -10.3450 -10.3450 -10.3217 -10.3217 -10.1535 -10.1535 -10.1428 -10.1428 -7.8068 -7.8068 -7.7635 -7.7635 1.3824 1.3824 1.4136 1.4136 2.7699 2.7699 2.8590 2.8590 3.1142 3.1142 3.3078 3.3078 4.0039 4.0039 4.0967 4.0967 8.0667 8.0667 8.5968 8.5968 9.5331 9.5331 9.6336 9.6336 k = 0.1212 0.0768 0.2842 ( 3469 PWs) bands (ev): -28.5562 -28.5562 -28.5558 -28.5558 -11.3888 -11.3888 -11.3781 -11.3781 -10.3468 -10.3468 -10.3220 -10.3220 -10.1578 -10.1578 -10.1461 -10.1461 -7.8052 -7.8052 -7.7610 -7.7610 1.3846 1.3846 1.4232 1.4232 2.7651 2.7651 2.8605 2.8605 3.1033 3.1033 3.3068 3.3068 3.9891 3.9891 4.0922 4.0922 8.0154 8.0154 8.6066 8.6066 9.5624 9.5624 9.6705 9.6705 k = 0.1322 0.0838 0.2842 ( 3465 PWs) bands (ev): -28.5558 -28.5558 -28.5554 -28.5554 -11.3904 -11.3904 -11.3793 -11.3793 -10.3485 -10.3485 -10.3225 -10.3225 -10.1622 -10.1622 -10.1497 -10.1497 -7.8032 -7.8032 -7.7588 -7.7588 1.3866 1.3866 1.4339 1.4339 2.7602 2.7602 2.8611 2.8611 3.0933 3.0933 3.3041 3.3041 3.9738 3.9738 4.0876 4.0876 7.9632 7.9632 8.6178 8.6178 9.5939 9.5939 9.7089 9.7089 k = 0.1432 0.0908 0.2842 ( 3467 PWs) bands (ev): -28.5555 -28.5555 -28.5550 -28.5550 -11.3922 -11.3922 -11.3806 -11.3806 -10.3503 -10.3503 -10.3232 -10.3232 -10.1668 -10.1668 -10.1534 -10.1534 -7.8006 -7.8006 -7.7569 -7.7569 1.3885 1.3885 1.4457 1.4457 2.7551 2.7551 2.8608 2.8608 3.0842 3.0842 3.2998 3.2998 3.9580 3.9580 4.0829 4.0829 7.9103 7.9103 8.6305 8.6305 9.6275 9.6275 9.7489 9.7489 k = 0.1542 0.0978 0.2842 ( 3471 PWs) bands (ev): -28.5551 -28.5551 -28.5545 -28.5545 -11.3940 -11.3940 -11.3821 -11.3821 -10.3522 -10.3522 -10.3242 -10.3242 -10.1714 -10.1714 -10.1573 -10.1573 -7.7974 -7.7974 -7.7554 -7.7554 1.3901 1.3901 1.4584 1.4584 2.7499 2.7499 2.8593 2.8593 3.0761 3.0761 3.2939 3.2939 3.9418 3.9418 4.0784 4.0784 7.8571 7.8571 8.6452 8.6452 9.6633 9.6633 9.7903 9.7903 k = 0.1652 0.1048 0.2842 ( 3471 PWs) bands (ev): -28.5546 -28.5546 -28.5541 -28.5541 -11.3959 -11.3959 -11.3837 -11.3837 -10.3540 -10.3540 -10.3255 -10.3255 -10.1760 -10.1760 -10.1613 -10.1613 -7.7938 -7.7938 -7.7543 -7.7543 1.3916 1.3916 1.4722 1.4722 2.7444 2.7444 2.8566 2.8566 3.0693 3.0693 3.2867 3.2867 3.9253 3.9253 4.0742 4.0742 7.8037 7.8037 8.6620 8.6620 9.7014 9.7014 9.8333 9.8333 k = 0.1762 0.1118 0.2842 ( 3475 PWs) bands (ev): -28.5542 -28.5542 -28.5536 -28.5536 -11.3979 -11.3979 -11.3855 -11.3855 -10.3558 -10.3558 -10.3270 -10.3270 -10.1806 -10.1806 -10.1653 -10.1653 -7.7897 -7.7897 -7.7536 -7.7536 1.3927 1.3927 1.4871 1.4871 2.7387 2.7387 2.8524 2.8524 3.0636 3.0636 3.2781 3.2781 3.9086 3.9086 4.0704 4.0704 7.7504 7.7504 8.6811 8.6811 9.7418 9.7418 9.8778 9.8778 k = 0.1873 0.1188 0.2842 ( 3473 PWs) bands (ev): -28.5538 -28.5538 -28.5531 -28.5531 -11.3999 -11.3999 -11.3874 -11.3874 -10.3577 -10.3577 -10.3288 -10.3288 -10.1850 -10.1850 -10.1695 -10.1695 -7.7852 -7.7852 -7.7533 -7.7533 1.3936 1.3936 1.5029 1.5029 2.7326 2.7326 2.8465 2.8465 3.0593 3.0593 3.2686 3.2686 3.8918 3.8918 4.0672 4.0672 7.6975 7.6975 8.7028 8.7028 9.7845 9.7845 9.9240 9.9240 k = 0.1983 0.1257 0.2842 ( 3473 PWs) bands (ev): -28.5533 -28.5533 -28.5525 -28.5525 -11.4019 -11.4019 -11.3895 -11.3895 -10.3597 -10.3597 -10.3308 -10.3308 -10.1893 -10.1893 -10.1736 -10.1736 -7.7803 -7.7803 -7.7533 -7.7533 1.3941 1.3941 1.5196 1.5196 2.7262 2.7262 2.8386 2.8386 3.0562 3.0562 3.2584 3.2584 3.8751 3.8751 4.0646 4.0646 7.6451 7.6451 8.7270 8.7270 9.8294 9.8294 9.9718 9.9718 k = 0.2093 0.1327 0.2842 ( 3471 PWs) bands (ev): -28.5528 -28.5528 -28.5520 -28.5520 -11.4040 -11.4040 -11.3916 -11.3916 -10.3617 -10.3617 -10.3331 -10.3331 -10.1934 -10.1934 -10.1777 -10.1777 -7.7753 -7.7753 -7.7534 -7.7534 1.3943 1.3943 1.5372 1.5372 2.7194 2.7194 2.8287 2.8287 3.0544 3.0544 3.2477 3.2477 3.8585 3.8585 4.0627 4.0627 7.5935 7.5935 8.7541 8.7541 9.8765 9.8765 10.0211 10.0211 k = 0.2203 0.1397 0.2842 ( 3472 PWs) bands (ev): -28.5524 -28.5524 -28.5515 -28.5515 -11.4061 -11.4061 -11.3939 -11.3939 -10.3638 -10.3638 -10.3356 -10.3356 -10.1973 -10.1973 -10.1818 -10.1818 -7.7706 -7.7706 -7.7534 -7.7534 1.3942 1.3942 1.5557 1.5557 2.7124 2.7124 2.8164 2.8164 3.0537 3.0537 3.2369 3.2369 3.8422 3.8422 4.0615 4.0615 7.5428 7.5428 8.7839 8.7839 9.9256 9.9256 10.0721 10.0721 k = 0.2313 0.1467 0.2842 ( 3466 PWs) bands (ev): -28.5519 -28.5519 -28.5509 -28.5509 -11.4083 -11.4083 -11.3962 -11.3962 -10.3661 -10.3661 -10.3382 -10.3382 -10.2009 -10.2009 -10.1858 -10.1858 -7.7670 -7.7670 -7.7522 -7.7522 1.3939 1.3939 1.5750 1.5750 2.7052 2.7052 2.8017 2.8017 3.0540 3.0540 3.2263 3.2263 3.8264 3.8264 4.0611 4.0611 7.4934 7.4934 8.8167 8.8167 9.9765 9.9765 10.1246 10.1246 k = 0.2423 0.1537 0.2842 ( 3466 PWs) bands (ev): -28.5514 -28.5514 -28.5503 -28.5503 -11.4106 -11.4106 -11.3987 -11.3987 -10.3686 -10.3686 -10.3409 -10.3409 -10.2043 -10.2043 -10.1897 -10.1897 -7.7660 -7.7660 -7.7487 -7.7487 1.3933 1.3933 1.5949 1.5949 2.6978 2.6978 2.7844 2.7844 3.0553 3.0553 3.2161 3.2161 3.8111 3.8111 4.0614 4.0614 7.4453 7.4453 8.8524 8.8524 10.0290 10.0290 10.1783 10.1783 k = 0.2533 0.1607 0.2842 ( 3466 PWs) bands (ev): -28.5509 -28.5509 -28.5498 -28.5498 -11.4129 -11.4129 -11.4011 -11.4011 -10.3713 -10.3713 -10.3435 -10.3435 -10.2074 -10.2074 -10.1934 -10.1934 -7.7670 -7.7670 -7.7432 -7.7432 1.3924 1.3924 1.6154 1.6154 2.6903 2.6903 2.7646 2.7646 3.0573 3.0573 3.2065 3.2065 3.7966 3.7966 4.0625 4.0625 7.3987 7.3987 8.8909 8.8909 10.0828 10.0828 10.2330 10.2330 k = 0.2644 0.1677 0.2842 ( 3464 PWs) bands (ev): -28.5504 -28.5504 -28.5492 -28.5492 -11.4152 -11.4152 -11.4036 -11.4036 -10.3743 -10.3743 -10.3461 -10.3461 -10.2103 -10.2103 -10.1970 -10.1970 -7.7693 -7.7693 -7.7366 -7.7366 1.3914 1.3914 1.6364 1.6364 2.6828 2.6828 2.7423 2.7423 3.0598 3.0598 3.1977 3.1977 3.7830 3.7830 4.0643 4.0643 7.3539 7.3539 8.9324 8.9324 10.1376 10.1376 10.2883 10.2883 k = 0.2754 0.1746 0.2842 ( 3465 PWs) bands (ev): -28.5500 -28.5500 -28.5486 -28.5486 -11.4176 -11.4176 -11.4061 -11.4061 -10.3776 -10.3776 -10.3486 -10.3486 -10.2129 -10.2129 -10.2004 -10.2004 -7.7724 -7.7724 -7.7294 -7.7294 1.3901 1.3901 1.6578 1.6578 2.6754 2.6754 2.7179 2.7179 3.0626 3.0626 3.1897 3.1897 3.7704 3.7704 4.0668 4.0668 7.3109 7.3109 8.9767 8.9767 10.1929 10.1929 10.3438 10.3438 k = 0.2864 0.1816 0.2842 ( 3467 PWs) bands (ev): -28.5495 -28.5495 -28.5481 -28.5481 -11.4200 -11.4200 -11.4085 -11.4085 -10.3812 -10.3812 -10.3508 -10.3508 -10.2154 -10.2154 -10.2035 -10.2035 -7.7760 -7.7760 -7.7218 -7.7218 1.3888 1.3888 1.6795 1.6795 2.6678 2.6678 2.6918 2.6918 3.0655 3.0655 3.1824 3.1824 3.7591 3.7591 4.0699 4.0699 7.2700 7.2700 9.0237 9.0237 10.2483 10.2483 10.3987 10.3987 k = 0.2974 0.1886 0.2842 ( 3466 PWs) bands (ev): -28.5490 -28.5490 -28.5475 -28.5475 -11.4225 -11.4225 -11.4109 -11.4109 -10.3850 -10.3850 -10.3529 -10.3529 -10.2177 -10.2177 -10.2063 -10.2063 -7.7800 -7.7800 -7.7140 -7.7140 1.3875 1.3875 1.7013 1.7013 2.6562 2.6562 2.6681 2.6681 3.0682 3.0682 3.1760 3.1760 3.7491 3.7491 4.0737 4.0737 7.2312 7.2312 9.0732 9.0732 10.3033 10.3033 10.4520 10.4520 k = 0.3084 0.1956 0.2842 ( 3466 PWs) bands (ev): -28.5486 -28.5486 -28.5470 -28.5470 -11.4250 -11.4250 -11.4132 -11.4132 -10.3890 -10.3890 -10.3547 -10.3547 -10.2199 -10.2199 -10.2089 -10.2089 -7.7843 -7.7843 -7.7061 -7.7061 1.3862 1.3862 1.7231 1.7231 2.6300 2.6300 2.6581 2.6581 3.0705 3.0705 3.1702 3.1702 3.7408 3.7408 4.0778 4.0778 7.1947 7.1947 9.1252 9.1252 10.3574 10.3574 10.5028 10.5028 k = 0.3194 0.2026 0.2842 ( 3467 PWs) bands (ev): -28.5482 -28.5482 -28.5464 -28.5464 -11.4276 -11.4276 -11.4154 -11.4154 -10.3932 -10.3932 -10.3564 -10.3564 -10.2220 -10.2220 -10.2112 -10.2112 -7.7889 -7.7889 -7.6981 -7.6981 1.3849 1.3849 1.7447 1.7447 2.5992 2.5992 2.6520 2.6520 3.0722 3.0722 3.1650 3.1650 3.7342 3.7342 4.0824 4.0824 7.1607 7.1607 9.1793 9.1793 10.4099 10.4099 10.5494 10.5494 k = 0.3305 0.2096 0.2842 ( 3463 PWs) bands (ev): -28.5478 -28.5478 -28.5459 -28.5459 -11.4301 -11.4301 -11.4175 -11.4175 -10.3974 -10.3974 -10.3578 -10.3578 -10.2240 -10.2240 -10.2131 -10.2131 -7.7937 -7.7937 -7.6901 -7.6901 1.3838 1.3838 1.7660 1.7660 2.5672 2.5672 2.6471 2.6471 3.0730 3.0730 3.1602 3.1602 3.7295 3.7295 4.0874 4.0874 7.1292 7.1292 9.2352 9.2352 10.4599 10.4599 10.5904 10.5904 k = 0.3415 0.2166 0.2842 ( 3465 PWs) bands (ev): -28.5474 -28.5474 -28.5454 -28.5454 -11.4326 -11.4326 -11.4195 -11.4195 -10.4016 -10.4016 -10.3591 -10.3591 -10.2260 -10.2260 -10.2147 -10.2147 -7.7986 -7.7986 -7.6822 -7.6822 1.3829 1.3829 1.7868 1.7868 2.5344 2.5344 2.6431 2.6431 3.0729 3.0729 3.1558 3.1558 3.7267 3.7267 4.0926 4.0926 7.1004 7.1004 9.2925 9.2925 10.5056 10.5056 10.6239 10.6239 k = 0.3525 0.2235 0.2842 ( 3468 PWs) bands (ev): -28.5470 -28.5470 -28.5449 -28.5449 -11.4351 -11.4351 -11.4214 -11.4214 -10.4058 -10.4058 -10.3603 -10.3603 -10.2280 -10.2280 -10.2160 -10.2160 -7.8037 -7.8037 -7.6744 -7.6744 1.3823 1.3823 1.8070 1.8070 2.5014 2.5014 2.6400 2.6400 3.0715 3.0715 3.1516 3.1516 3.7260 3.7260 4.0979 4.0979 7.0744 7.0744 9.3508 9.3508 10.5436 10.5436 10.6482 10.6482 k = 0.3635 0.2305 0.2842 ( 3467 PWs) bands (ev): -28.5467 -28.5467 -28.5444 -28.5444 -11.4376 -11.4376 -11.4232 -11.4232 -10.4098 -10.4098 -10.3613 -10.3613 -10.2299 -10.2299 -10.2171 -10.2171 -7.8088 -7.8088 -7.6668 -7.6668 1.3820 1.3820 1.8263 1.8263 2.4683 2.4683 2.6379 2.6379 3.0690 3.0690 3.1475 3.1475 3.7273 3.7273 4.1033 4.1033 7.0511 7.0511 9.4094 9.4094 10.5659 10.5659 10.6623 10.6623 k = 0.3745 0.2375 0.2842 ( 3467 PWs) bands (ev): -28.5463 -28.5463 -28.5440 -28.5440 -11.4399 -11.4399 -11.4249 -11.4249 -10.4137 -10.4137 -10.3622 -10.3622 -10.2318 -10.2318 -10.2179 -10.2179 -7.8138 -7.8138 -7.6594 -7.6594 1.3821 1.3821 1.8447 1.8447 2.4356 2.4356 2.6368 2.6368 3.0653 3.0653 3.1436 3.1436 3.7306 3.7306 4.1087 4.1087 7.0308 7.0308 9.4674 9.4674 10.5635 10.5635 10.6659 10.6659 k = 0.3855 0.2445 0.2842 ( 3465 PWs) bands (ev): -28.5461 -28.5461 -28.5435 -28.5435 -11.4421 -11.4421 -11.4265 -11.4265 -10.4174 -10.4174 -10.3629 -10.3629 -10.2336 -10.2336 -10.2185 -10.2185 -7.8187 -7.8187 -7.6523 -7.6523 1.3826 1.3826 1.8619 1.8619 2.4034 2.4034 2.6369 2.6369 3.0603 3.0603 3.1396 3.1396 3.7359 3.7359 4.1140 4.1140 7.0135 7.0135 9.5239 9.5239 10.5417 10.5417 10.6595 10.6595 k = 0.3965 0.2515 0.2842 ( 3465 PWs) bands (ev): -28.5458 -28.5458 -28.5431 -28.5431 -11.4442 -11.4442 -11.4279 -11.4279 -10.4208 -10.4208 -10.3636 -10.3636 -10.2353 -10.2353 -10.2189 -10.2189 -7.8235 -7.8235 -7.6455 -7.6455 1.3838 1.3838 1.8779 1.8779 2.3720 2.3720 2.6380 2.6380 3.0541 3.0541 3.1357 3.1357 3.7429 3.7429 4.1191 4.1191 6.9993 6.9993 9.5774 9.5774 10.5121 10.5121 10.6439 10.6439 k = 0.4076 0.2585 0.2842 ( 3465 PWs) bands (ev): -28.5456 -28.5456 -28.5428 -28.5428 -11.4461 -11.4461 -11.4292 -11.4292 -10.4240 -10.4240 -10.3641 -10.3641 -10.2371 -10.2371 -10.2192 -10.2192 -7.8281 -7.8281 -7.6392 -7.6392 1.3854 1.3854 1.8924 1.8924 2.3415 2.3415 2.6402 2.6402 3.0467 3.0467 3.1318 3.1318 3.7517 3.7517 4.1240 4.1240 6.9882 6.9882 9.6262 9.6262 10.4821 10.4821 10.6209 10.6209 k = 0.4186 0.2654 0.2842 ( 3461 PWs) bands (ev): -28.5454 -28.5454 -28.5424 -28.5424 -11.4478 -11.4478 -11.4305 -11.4305 -10.4268 -10.4268 -10.3646 -10.3646 -10.2387 -10.2387 -10.2193 -10.2193 -7.8325 -7.8325 -7.6333 -7.6333 1.3878 1.3878 1.9054 1.9054 2.3123 2.3123 2.6434 2.6434 3.0383 3.0383 3.1278 3.1278 3.7619 3.7619 4.1284 4.1284 6.9802 6.9802 9.6683 9.6683 10.4559 10.4559 10.5920 10.5920 k = 0.4296 0.2724 0.2842 ( 3461 PWs) bands (ev): -28.5452 -28.5452 -28.5421 -28.5421 -11.4493 -11.4493 -11.4316 -11.4316 -10.4293 -10.4293 -10.3649 -10.3649 -10.2404 -10.2404 -10.2192 -10.2192 -7.8365 -7.8365 -7.6278 -7.6278 1.3908 1.3908 1.9168 1.9168 2.2845 2.2845 2.6476 2.6476 3.0290 3.0290 3.1238 3.1238 3.7734 3.7734 4.1325 4.1325 6.9754 6.9754 9.7014 9.7014 10.4364 10.4364 10.5591 10.5591 k = 0.4406 0.2794 0.2842 ( 3461 PWs) bands (ev): -28.5451 -28.5451 -28.5418 -28.5418 -11.4506 -11.4506 -11.4325 -11.4325 -10.4314 -10.4314 -10.3652 -10.3652 -10.2420 -10.2420 -10.2190 -10.2190 -7.8402 -7.8402 -7.6229 -7.6229 1.3945 1.3945 1.9265 1.9265 2.2582 2.2582 2.6528 2.6528 3.0189 3.0189 3.1199 3.1199 3.7860 3.7860 4.1360 4.1360 6.9738 6.9738 9.7233 9.7233 10.4259 10.4259 10.5235 10.5235 k = 0.4516 0.2864 0.2842 ( 3458 PWs) bands (ev): -28.5450 -28.5450 -28.5415 -28.5415 -11.4516 -11.4516 -11.4334 -11.4334 -10.4332 -10.4332 -10.3653 -10.3653 -10.2436 -10.2436 -10.2187 -10.2187 -7.8435 -7.8435 -7.6186 -7.6186 1.3990 1.3990 1.9344 1.9344 2.2337 2.2337 2.6589 2.6589 3.0081 3.0081 3.1159 3.1159 3.7996 3.7996 4.1389 4.1389 6.9755 6.9755 9.7328 9.7328 10.4250 10.4250 10.4866 10.4866 k = 0.4626 0.2934 0.2842 ( 3458 PWs) bands (ev): -28.5449 -28.5449 -28.5413 -28.5413 -11.4524 -11.4524 -11.4342 -11.4342 -10.4345 -10.4345 -10.3654 -10.3654 -10.2451 -10.2451 -10.2183 -10.2183 -7.8463 -7.8463 -7.6149 -7.6149 1.4044 1.4044 1.9405 1.9405 2.2110 2.2110 2.6657 2.6657 2.9969 2.9969 3.1119 3.1119 3.8138 3.8138 4.1412 4.1412 6.9804 6.9804 9.7299 9.7299 10.4326 10.4326 10.4500 10.4500 k = 0.4736 0.3004 0.2842 ( 3460 PWs) bands (ev): -28.5449 -28.5449 -28.5411 -28.5411 -11.4529 -11.4529 -11.4348 -11.4348 -10.4354 -10.4354 -10.3653 -10.3653 -10.2467 -10.2467 -10.2178 -10.2178 -7.8487 -7.8487 -7.6119 -7.6119 1.4105 1.4105 1.9446 1.9446 2.1901 2.1901 2.6730 2.6730 2.9854 2.9854 3.1080 3.1080 3.8287 3.8287 4.1429 4.1429 6.9885 6.9885 9.7160 9.7160 10.4122 10.4122 10.4482 10.4482 k = 0.5000 0.3171-0.1835 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4553 -11.4553 -11.4354 -11.4354 -10.4411 -10.4411 -10.3626 -10.3626 -10.2459 -10.2459 -10.2128 -10.2128 -7.8749 -7.8749 -7.5870 -7.5870 1.3715 1.3715 1.9740 1.9740 2.1280 2.1280 2.7266 2.7266 3.0558 3.0558 3.1263 3.1263 3.7667 3.7667 4.1449 4.1449 6.8610 6.8610 10.1235 10.1235 10.2816 10.2816 10.7624 10.7731 k = 0.5070 0.3061-0.1835 ( 3472 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4552 -11.4552 -11.4354 -11.4354 -10.4410 -10.4410 -10.3625 -10.3625 -10.2461 -10.2461 -10.2129 -10.2129 -7.8746 -7.8746 -7.5872 -7.5872 1.3723 1.3723 1.9737 1.9737 2.1279 2.1279 2.7267 2.7267 3.0553 3.0553 3.1241 3.1241 3.7682 3.7682 4.1452 4.1452 6.8646 6.8646 10.1248 10.1248 10.2785 10.2785 10.7647 10.7647 k = 0.5140 0.2950-0.1835 ( 3472 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4551 -11.4551 -11.4354 -11.4354 -10.4408 -10.4408 -10.3624 -10.3624 -10.2467 -10.2467 -10.2131 -10.2131 -7.8736 -7.8736 -7.5880 -7.5880 1.3747 1.3747 1.9727 1.9727 2.1277 2.1277 2.7270 2.7270 3.0539 3.0539 3.1174 3.1174 3.7727 3.7727 4.1462 4.1462 6.8754 6.8754 10.1289 10.1289 10.2693 10.2693 10.7667 10.7667 k = 0.5210 0.2840-0.1835 ( 3468 PWs) bands (ev): -28.5454 -28.5454 -28.5404 -28.5404 -11.4549 -11.4549 -11.4354 -11.4354 -10.4403 -10.4403 -10.3622 -10.3622 -10.2476 -10.2476 -10.2136 -10.2136 -7.8720 -7.8720 -7.5892 -7.5892 1.3785 1.3785 1.9710 1.9710 2.1274 2.1274 2.7275 2.7275 3.0514 3.0514 3.1068 3.1068 3.7799 3.7799 4.1479 4.1479 6.8933 6.8933 10.1356 10.1356 10.2546 10.2546 10.7596 10.7596 k = 0.5280 0.2730-0.1835 ( 3476 PWs) bands (ev): -28.5454 -28.5454 -28.5405 -28.5405 -11.4546 -11.4546 -11.4354 -11.4354 -10.4397 -10.4397 -10.3619 -10.3619 -10.2489 -10.2489 -10.2142 -10.2142 -7.8698 -7.8698 -7.5908 -7.5908 1.3837 1.3837 1.9687 1.9687 2.1270 2.1270 2.7281 2.7281 3.0478 3.0478 3.0927 3.0927 3.7895 3.7895 4.1501 4.1501 6.9182 6.9182 10.1445 10.1445 10.2352 10.2352 10.7497 10.7497 k = 0.5349 0.2620-0.1835 ( 3478 PWs) bands (ev): -28.5454 -28.5454 -28.5405 -28.5405 -11.4543 -11.4543 -11.4355 -11.4355 -10.4388 -10.4388 -10.3616 -10.3616 -10.2506 -10.2506 -10.2151 -10.2151 -7.8669 -7.8669 -7.5930 -7.5930 1.3902 1.3902 1.9657 1.9657 2.1266 2.1266 2.7290 2.7290 3.0427 3.0427 3.0763 3.0763 3.8010 3.8010 4.1529 4.1529 6.9499 6.9499 10.1553 10.1553 10.2121 10.2121 10.7376 10.7376 k = 0.5419 0.2510-0.1835 ( 3478 PWs) bands (ev): -28.5455 -28.5455 -28.5405 -28.5405 -11.4538 -11.4538 -11.4355 -11.4355 -10.4378 -10.4378 -10.3611 -10.3611 -10.2525 -10.2525 -10.2161 -10.2161 -7.8635 -7.8635 -7.5955 -7.5955 1.3978 1.3978 1.9621 1.9621 2.1262 2.1262 2.7302 2.7302 3.0344 3.0344 3.0599 3.0599 3.8140 3.8140 4.1563 4.1563 6.9882 6.9882 10.1671 10.1671 10.1860 10.1860 10.7237 10.7237 k = 0.5489 0.2399-0.1835 ( 3474 PWs) bands (ev): -28.5455 -28.5455 -28.5405 -28.5405 -11.4534 -11.4534 -11.4355 -11.4355 -10.4367 -10.4367 -10.3607 -10.3607 -10.2546 -10.2546 -10.2173 -10.2173 -7.8596 -7.8596 -7.5985 -7.5985 1.4062 1.4062 1.9579 1.9579 2.1260 2.1260 2.7316 2.7316 3.0199 3.0199 3.0471 3.0471 3.8282 3.8282 4.1601 4.1601 7.0329 7.0329 10.1571 10.1571 10.1799 10.1799 10.7089 10.7089 k = 0.5559 0.2289-0.1835 ( 3476 PWs) bands (ev): -28.5455 -28.5455 -28.5405 -28.5405 -11.4528 -11.4528 -11.4355 -11.4355 -10.4353 -10.4353 -10.3602 -10.3602 -10.2570 -10.2570 -10.2187 -10.2187 -7.8551 -7.8551 -7.6019 -7.6019 1.4154 1.4154 1.9531 1.9531 2.1261 2.1261 2.7334 2.7334 2.9994 2.9994 3.0385 3.0385 3.8431 3.8431 4.1643 4.1643 7.0837 7.0837 10.1270 10.1270 10.1914 10.1914 10.6941 10.6941 k = 0.5629 0.2179-0.1835 ( 3474 PWs) bands (ev): -28.5455 -28.5455 -28.5406 -28.5406 -11.4522 -11.4522 -11.4356 -11.4356 -10.4338 -10.4338 -10.3596 -10.3596 -10.2595 -10.2595 -10.2202 -10.2202 -7.8502 -7.8502 -7.6057 -7.6057 1.4249 1.4249 1.9477 1.9477 2.1267 2.1267 2.7354 2.7354 2.9760 2.9760 3.0315 3.0315 3.8583 3.8583 4.1688 4.1688 7.1402 7.1402 10.0955 10.0955 10.2009 10.2009 10.6807 10.6807 k = 0.5699 0.2069-0.1835 ( 3474 PWs) bands (ev): -28.5456 -28.5456 -28.5406 -28.5406 -11.4516 -11.4516 -11.4356 -11.4356 -10.4321 -10.4321 -10.3591 -10.3591 -10.2620 -10.2620 -10.2220 -10.2220 -7.8449 -7.8449 -7.6098 -7.6098 1.4344 1.4344 1.9419 1.9419 2.1279 2.1279 2.7379 2.7379 2.9514 2.9514 3.0249 3.0249 3.8737 3.8737 4.1735 4.1735 7.2022 7.2022 10.0630 10.0630 10.2065 10.2065 10.6699 10.6699 k = 0.5769 0.1958-0.1835 ( 3474 PWs) bands (ev): -28.5456 -28.5456 -28.5406 -28.5406 -11.4509 -11.4509 -11.4355 -11.4355 -10.4302 -10.4302 -10.3585 -10.3585 -10.2647 -10.2647 -10.2238 -10.2238 -7.8392 -7.8392 -7.6142 -7.6142 1.4436 1.4436 1.9355 1.9355 2.1301 2.1301 2.7408 2.7408 2.9266 2.9266 3.0184 3.0184 3.8890 3.8890 4.1785 4.1785 7.2693 7.2693 10.0300 10.0300 10.2067 10.2067 10.6631 10.6631 k = 0.5839 0.1848-0.1835 ( 3470 PWs) bands (ev): -28.5456 -28.5456 -28.5407 -28.5407 -11.4502 -11.4502 -11.4355 -11.4355 -10.4282 -10.4282 -10.3580 -10.3580 -10.2673 -10.2673 -10.2259 -10.2259 -7.8332 -7.8332 -7.6188 -7.6188 1.4521 1.4521 1.9288 1.9288 2.1335 2.1335 2.7441 2.7441 2.9018 2.9018 3.0121 3.0121 3.9041 3.9041 4.1836 4.1836 7.3412 7.3412 9.9967 9.9967 10.2000 10.2000 10.6611 10.6611 k = 0.5909 0.1738-0.1835 ( 3474 PWs) bands (ev): -28.5457 -28.5457 -28.5407 -28.5407 -11.4494 -11.4494 -11.4354 -11.4354 -10.4261 -10.4261 -10.3576 -10.3576 -10.2698 -10.2698 -10.2280 -10.2280 -7.8269 -7.8269 -7.6238 -7.6238 1.4595 1.4595 1.9216 1.9216 2.1383 2.1383 2.7478 2.7478 2.8776 2.8776 3.0057 3.0057 3.9187 3.9187 4.1887 4.1887 7.4177 7.4177 9.9634 9.9634 10.1860 10.1860 10.6638 10.6638 k = 0.5979 0.1628-0.1835 ( 3466 PWs) bands (ev): -28.5458 -28.5458 -28.5408 -28.5408 -11.4487 -11.4487 -11.4353 -11.4353 -10.4238 -10.4238 -10.3571 -10.3571 -10.2722 -10.2722 -10.2302 -10.2302 -7.8205 -7.8205 -7.6289 -7.6289 1.4655 1.4655 1.9142 1.9142 2.1451 2.1451 2.7520 2.7520 2.8541 2.8541 2.9995 2.9995 3.9328 3.9328 4.1940 4.1940 7.4982 7.4982 9.9302 9.9302 10.1647 10.1647 10.6698 10.6698 k = 0.6048 0.1518-0.1835 ( 3472 PWs) bands (ev): -28.5458 -28.5458 -28.5409 -28.5409 -11.4480 -11.4480 -11.4351 -11.4351 -10.4214 -10.4214 -10.3568 -10.3568 -10.2745 -10.2745 -10.2325 -10.2325 -7.8139 -7.8139 -7.6342 -7.6342 1.4696 1.4696 1.9065 1.9065 2.1538 2.1538 2.7565 2.7565 2.8315 2.8315 2.9934 2.9934 3.9462 3.9462 4.1992 4.1992 7.5826 7.5826 9.8973 9.8973 10.1370 10.1370 10.6770 10.6770 k = 0.6118 0.1407-0.1835 ( 3476 PWs) bands (ev): -28.5459 -28.5459 -28.5409 -28.5409 -11.4473 -11.4473 -11.4348 -11.4348 -10.4189 -10.4189 -10.3565 -10.3565 -10.2766 -10.2766 -10.2348 -10.2348 -7.8073 -7.8073 -7.6397 -7.6397 1.4717 1.4717 1.8986 1.8986 2.1649 2.1649 2.7611 2.7611 2.8104 2.8104 2.9876 2.9876 3.9590 3.9590 4.2044 4.2044 7.6704 7.6704 9.8649 9.8649 10.1040 10.1040 10.6826 10.6826 k = 0.6188 0.1297-0.1835 ( 3478 PWs) bands (ev): -28.5460 -28.5460 -28.5410 -28.5410 -11.4466 -11.4466 -11.4345 -11.4345 -10.4163 -10.4163 -10.3562 -10.3562 -10.2785 -10.2785 -10.2371 -10.2371 -7.8006 -7.8006 -7.6452 -7.6452 1.4715 1.4715 1.8907 1.8907 2.1785 2.1785 2.7645 2.7645 2.7920 2.7920 2.9820 2.9820 3.9709 3.9709 4.2096 4.2096 7.7613 7.7613 9.8332 9.8332 10.0670 10.0670 10.6839 10.6839 k = 0.6258 0.1187-0.1835 ( 3474 PWs) bands (ev): -28.5461 -28.5461 -28.5411 -28.5411 -11.4460 -11.4460 -11.4341 -11.4341 -10.4136 -10.4136 -10.3560 -10.3560 -10.2802 -10.2802 -10.2393 -10.2393 -7.7940 -7.7940 -7.6507 -7.6507 1.4690 1.4690 1.8827 1.8827 2.1946 2.1946 2.7596 2.7596 2.7833 2.7833 2.9768 2.9768 3.9820 3.9820 4.2149 4.2149 7.8549 7.8549 9.8025 9.8025 10.0268 10.0268 10.6782 10.6782 k = 0.6328 0.1077-0.1835 ( 3476 PWs) bands (ev): -28.5463 -28.5463 -28.5412 -28.5412 -11.4454 -11.4454 -11.4335 -11.4335 -10.4109 -10.4109 -10.3558 -10.3558 -10.2817 -10.2817 -10.2414 -10.2414 -7.7876 -7.7876 -7.6562 -7.6562 1.4643 1.4643 1.8747 1.8747 2.2132 2.2132 2.7442 2.7442 2.7867 2.7867 2.9718 2.9718 3.9922 3.9922 4.2200 4.2200 7.9508 7.9508 9.7728 9.7728 9.9845 9.9845 10.6642 10.6642 k = 0.6398 0.0967-0.1835 ( 3474 PWs) bands (ev): -28.5464 -28.5464 -28.5413 -28.5413 -11.4449 -11.4449 -11.4329 -11.4329 -10.4082 -10.4082 -10.3556 -10.3556 -10.2831 -10.2831 -10.2433 -10.2433 -7.7813 -7.7813 -7.6617 -7.6617 1.4575 1.4575 1.8670 1.8670 2.2342 2.2342 2.7266 2.7266 2.7934 2.7934 2.9674 2.9674 4.0016 4.0016 4.2252 4.2252 8.0485 8.0485 9.7444 9.7444 9.9406 9.9406 10.6412 10.6412 k = 0.3602-0.5680-0.0000 ( 3474 PWs) bands (ev): -28.5464 -28.5464 -28.5413 -28.5413 -11.4449 -11.4449 -11.4329 -11.4329 -10.4082 -10.4082 -10.3556 -10.3556 -10.2831 -10.2831 -10.2433 -10.2433 -7.7813 -7.7813 -7.6617 -7.6617 1.4575 1.4575 1.8670 1.8670 2.2342 2.2342 2.7266 2.7266 2.7934 2.7934 2.9674 2.9674 4.0016 4.0016 4.2252 4.2252 8.0485 8.0485 9.7444 9.7444 9.9406 9.9406 10.6412 10.6412 k = 0.3531-0.5568-0.0000 ( 3472 PWs) bands (ev): -28.5466 -28.5466 -28.5414 -28.5414 -11.4444 -11.4444 -11.4321 -11.4321 -10.4056 -10.4056 -10.3552 -10.3552 -10.2844 -10.2844 -10.2450 -10.2450 -7.7752 -7.7752 -7.6671 -7.6671 1.4486 1.4486 1.8593 1.8593 2.2575 2.2575 2.7089 2.7089 2.8014 2.8014 2.9634 2.9634 4.0101 4.0101 4.2304 4.2304 8.1486 8.1486 9.7173 9.7173 9.8953 9.8953 10.6094 10.6094 k = 0.3461-0.5457-0.0000 ( 3476 PWs) bands (ev): -28.5467 -28.5467 -28.5415 -28.5415 -11.4440 -11.4440 -11.4312 -11.4312 -10.4030 -10.4030 -10.3547 -10.3547 -10.2856 -10.2856 -10.2464 -10.2464 -7.7695 -7.7695 -7.6724 -7.6724 1.4381 1.4381 1.8520 1.8520 2.2826 2.2826 2.6915 2.6915 2.8101 2.8101 2.9599 2.9599 4.0177 4.0177 4.2357 4.2357 8.2494 8.2494 9.6922 9.6922 9.8495 9.8495 10.5703 10.5703 k = 0.3390-0.5346-0.0000 ( 3474 PWs) bands (ev): -28.5469 -28.5469 -28.5416 -28.5416 -11.4436 -11.4436 -11.4301 -11.4301 -10.4006 -10.4006 -10.3540 -10.3540 -10.2868 -10.2868 -10.2474 -10.2474 -7.7641 -7.7641 -7.6775 -7.6775 1.4263 1.4263 1.8451 1.8451 2.3093 2.3093 2.6745 2.6745 2.8194 2.8194 2.9572 2.9572 4.0244 4.0244 4.2410 4.2410 8.3501 8.3501 9.6695 9.6695 9.8035 9.8035 10.5254 10.5254 k = 0.3320-0.5234-0.0000 ( 3472 PWs) bands (ev): -28.5471 -28.5471 -28.5417 -28.5417 -11.4432 -11.4432 -11.4290 -11.4290 -10.3984 -10.3984 -10.3530 -10.3530 -10.2880 -10.2880 -10.2480 -10.2480 -7.7591 -7.7591 -7.6824 -7.6824 1.4135 1.4135 1.8388 1.8388 2.3369 2.3369 2.6578 2.6578 2.8290 2.8290 2.9552 2.9552 4.0302 4.0302 4.2464 4.2464 8.4497 8.4497 9.6498 9.6498 9.7578 9.7578 10.4763 10.4763 k = 0.3249-0.5123-0.0000 ( 3466 PWs) bands (ev): -28.5474 -28.5474 -28.5418 -28.5418 -11.4429 -11.4429 -11.4277 -11.4277 -10.3965 -10.3965 -10.3517 -10.3517 -10.2891 -10.2891 -10.2481 -10.2481 -7.7546 -7.7546 -7.6869 -7.6869 1.3999 1.3999 1.8330 1.8330 2.3650 2.3650 2.6415 2.6415 2.8388 2.8388 2.9542 2.9542 4.0351 4.0351 4.2519 4.2519 8.5471 8.5471 9.6337 9.6337 9.7125 9.7125 10.4243 10.4243 k = 0.3178-0.5012-0.0000 ( 3466 PWs) bands (ev): -28.5476 -28.5476 -28.5420 -28.5420 -11.4426 -11.4426 -11.4263 -11.4263 -10.3948 -10.3948 -10.3500 -10.3500 -10.2903 -10.2903 -10.2478 -10.2478 -7.7507 -7.7507 -7.6912 -7.6912 1.3860 1.3860 1.8279 1.8279 2.3930 2.3930 2.6260 2.6260 2.8486 2.8486 2.9544 2.9544 4.0391 4.0391 4.2575 4.2575 8.6407 8.6407 9.6222 9.6222 9.6681 9.6681 10.3707 10.3707 k = 0.3108-0.4900-0.0000 ( 3464 PWs) bands (ev): -28.5479 -28.5479 -28.5421 -28.5421 -11.4423 -11.4423 -11.4249 -11.4249 -10.3934 -10.3934 -10.3480 -10.3480 -10.2914 -10.2914 -10.2471 -10.2471 -7.7474 -7.7474 -7.6950 -7.6950 1.3720 1.3720 1.8235 1.8235 2.4196 2.4196 2.6117 2.6117 2.8580 2.8580 2.9560 2.9560 4.0423 4.0423 4.2633 4.2633 8.7287 8.7287 9.6143 9.6143 9.6265 9.6265 10.3162 10.3162 k = 0.3037-0.4789-0.0000 ( 3458 PWs) bands (ev): -28.5482 -28.5482 -28.5423 -28.5423 -11.4420 -11.4420 -11.4233 -11.4233 -10.3922 -10.3922 -10.3458 -10.3458 -10.2923 -10.2923 -10.2460 -10.2460 -7.7447 -7.7447 -7.6985 -7.6985 1.3581 1.3581 1.8200 1.8200 2.4434 2.4434 2.6000 2.6000 2.8667 2.8667 2.9594 2.9594 4.0446 4.0446 4.2692 4.2692 8.8088 8.8088 9.5801 9.5801 9.6194 9.6194 10.2618 10.2618 k = 0.2966-0.4678-0.0000 ( 3463 PWs) bands (ev): -28.5485 -28.5485 -28.5424 -28.5424 -11.4417 -11.4417 -11.4216 -11.4216 -10.3913 -10.3913 -10.3434 -10.3434 -10.2930 -10.2930 -10.2445 -10.2445 -7.7428 -7.7428 -7.7015 -7.7015 1.3446 1.3446 1.8173 1.8173 2.4612 2.4612 2.5934 2.5934 2.8744 2.8744 2.9649 2.9649 4.0460 4.0460 4.2754 4.2754 8.8787 8.8787 9.5387 9.5387 9.6286 9.6286 10.2079 10.2079 k = 0.2896-0.4566-0.0000 ( 3461 PWs) bands (ev): -28.5488 -28.5488 -28.5426 -28.5426 -11.4414 -11.4414 -11.4197 -11.4197 -10.3906 -10.3906 -10.3408 -10.3408 -10.2932 -10.2932 -10.2428 -10.2428 -7.7414 -7.7414 -7.7042 -7.7042 1.3316 1.3316 1.8156 1.8156 2.4695 2.4695 2.5954 2.5954 2.8808 2.8808 2.9727 2.9727 4.0467 4.0467 4.2817 4.2817 8.9363 8.9363 9.4984 9.4984 9.6466 9.6466 10.1550 10.1550 k = 0.2825-0.4455-0.0000 ( 3459 PWs) bands (ev): -28.5492 -28.5492 -28.5428 -28.5428 -11.4411 -11.4411 -11.4178 -11.4178 -10.3901 -10.3901 -10.3383 -10.3383 -10.2930 -10.2930 -10.2408 -10.2408 -7.7407 -7.7407 -7.7064 -7.7064 1.3192 1.3192 1.8149 1.8149 2.4667 2.4667 2.6073 2.6073 2.8859 2.8859 2.9828 2.9828 4.0465 4.0465 4.2882 4.2882 8.9809 8.9809 9.4594 9.4594 9.6720 9.6720 10.1033 10.1033 k = 0.2754-0.4343-0.0000 ( 3459 PWs) bands (ev): -28.5495 -28.5495 -28.5430 -28.5430 -11.4408 -11.4408 -11.4157 -11.4157 -10.3897 -10.3897 -10.3359 -10.3359 -10.2921 -10.2921 -10.2386 -10.2386 -7.7407 -7.7407 -7.7083 -7.7083 1.3076 1.3076 1.8152 1.8152 2.4553 2.4553 2.6262 2.6262 2.8900 2.8900 2.9950 2.9950 4.0454 4.0454 4.2950 4.2950 9.0127 9.0127 9.4218 9.4218 9.7018 9.7018 10.0533 10.0533 k = 0.2684-0.4232-0.0000 ( 3459 PWs) bands (ev): -28.5499 -28.5499 -28.5432 -28.5432 -11.4405 -11.4405 -11.4135 -11.4135 -10.3896 -10.3896 -10.3336 -10.3336 -10.2905 -10.2905 -10.2362 -10.2362 -7.7413 -7.7413 -7.7098 -7.7098 1.2969 1.2969 1.8165 1.8165 2.4387 2.4387 2.6488 2.6488 2.8932 2.8932 3.0091 3.0091 4.0435 4.0435 4.3019 4.3019 9.0336 9.0336 9.3857 9.3857 9.7318 9.7318 10.0050 10.0050 k = 0.2613-0.4121-0.0000 ( 3453 PWs) bands (ev): -28.5503 -28.5503 -28.5434 -28.5434 -11.4402 -11.4402 -11.4111 -11.4111 -10.3896 -10.3896 -10.3314 -10.3314 -10.2883 -10.2883 -10.2336 -10.2336 -7.7425 -7.7425 -7.7110 -7.7110 1.2870 1.2870 1.8190 1.8190 2.4192 2.4192 2.6727 2.6727 2.8959 2.8959 3.0245 3.0245 4.0406 4.0406 4.3091 4.3091 9.0456 9.0456 9.3512 9.3512 9.7574 9.7574 9.9586 9.9586 k = 0.2543-0.4009-0.0000 ( 3453 PWs) bands (ev): -28.5507 -28.5507 -28.5437 -28.5437 -11.4400 -11.4400 -11.4086 -11.4086 -10.3898 -10.3898 -10.3293 -10.3293 -10.2853 -10.2853 -10.2310 -10.2310 -7.7442 -7.7442 -7.7118 -7.7118 1.2780 1.2780 1.8226 1.8226 2.3978 2.3978 2.6968 2.6968 2.8983 2.8983 3.0412 3.0412 4.0368 4.0368 4.3163 4.3163 9.0512 9.0512 9.3184 9.3184 9.7748 9.7748 9.9143 9.9143 k = 0.2472-0.3898-0.0000 ( 3455 PWs) bands (ev): -28.5512 -28.5512 -28.5439 -28.5439 -11.4397 -11.4397 -11.4060 -11.4060 -10.3903 -10.3903 -10.3272 -10.3272 -10.2817 -10.2817 -10.2282 -10.2282 -7.7467 -7.7467 -7.7123 -7.7123 1.2699 1.2699 1.8273 1.8273 2.3754 2.3754 2.7203 2.7203 2.9006 2.9006 3.0589 3.0589 4.0319 4.0319 4.3237 4.3237 9.0521 9.0521 9.2874 9.2874 9.7819 9.7819 9.8720 9.8720 k = 0.2401-0.3787-0.0000 ( 3453 PWs) bands (ev): -28.5516 -28.5516 -28.5442 -28.5442 -11.4395 -11.4395 -11.4032 -11.4032 -10.3910 -10.3910 -10.3249 -10.3249 -10.2775 -10.2775 -10.2254 -10.2254 -7.7498 -7.7498 -7.7123 -7.7123 1.2624 1.2624 1.8331 1.8331 2.3523 2.3523 2.7430 2.7430 2.9030 2.9030 3.0773 3.0773 4.0260 4.0260 4.3311 4.3311 9.0498 9.0498 9.2582 9.2582 9.7783 9.7783 9.8319 9.8319 k = 0.2331-0.3675-0.0000 ( 3455 PWs) bands (ev): -28.5521 -28.5521 -28.5444 -28.5444 -11.4393 -11.4393 -11.4003 -11.4003 -10.3919 -10.3919 -10.3223 -10.3223 -10.2729 -10.2729 -10.2225 -10.2225 -7.7537 -7.7537 -7.7119 -7.7119 1.2557 1.2557 1.8401 1.8401 2.3292 2.3292 2.7646 2.7646 2.9056 2.9056 3.0965 3.0965 4.0189 4.0189 4.3386 4.3386 9.0454 9.0454 9.2309 9.2309 9.7648 9.7648 9.7940 9.7940 k = 0.2260-0.3564-0.0000 ( 3455 PWs) bands (ev): -28.5525 -28.5525 -28.5447 -28.5447 -11.4391 -11.4391 -11.3973 -11.3973 -10.3931 -10.3931 -10.3194 -10.3194 -10.2680 -10.2680 -10.2195 -10.2195 -7.7584 -7.7584 -7.7109 -7.7109 1.2494 1.2494 1.8481 1.8481 2.3062 2.3062 2.7849 2.7849 2.9085 2.9085 3.1162 3.1162 4.0107 4.0107 4.3460 4.3460 9.0396 9.0396 9.2056 9.2056 9.7422 9.7422 9.7585 9.7585 k = 0.2189-0.3452-0.0000 ( 3455 PWs) bands (ev): -28.5530 -28.5530 -28.5449 -28.5449 -11.4390 -11.4390 -11.3941 -11.3941 -10.3945 -10.3945 -10.3161 -10.3161 -10.2628 -10.2628 -10.2166 -10.2166 -7.7639 -7.7639 -7.7094 -7.7094 1.2434 1.2434 1.8573 1.8573 2.2838 2.2838 2.8038 2.8038 2.9117 2.9117 3.1363 3.1363 4.0011 4.0011 4.3533 4.3533 9.0329 9.0329 9.1823 9.1823 9.7121 9.7121 9.7250 9.7250 k = 0.2119-0.3341-0.0000 ( 3449 PWs) bands (ev): -28.5535 -28.5535 -28.5452 -28.5452 -11.4389 -11.4389 -11.3909 -11.3909 -10.3961 -10.3961 -10.3123 -10.3123 -10.2574 -10.2574 -10.2136 -10.2136 -7.7701 -7.7701 -7.7074 -7.7074 1.2375 1.2375 1.8675 1.8675 2.2625 2.2625 2.8214 2.8214 2.9154 2.9154 3.1568 3.1568 3.9903 3.9903 4.3604 4.3604 9.0255 9.0255 9.1611 9.1611 9.6761 9.6761 9.6929 9.6929 k = 0.2048-0.3230-0.0000 ( 3443 PWs) bands (ev): -28.5540 -28.5540 -28.5455 -28.5455 -11.4388 -11.4388 -11.3875 -11.3875 -10.3979 -10.3979 -10.3082 -10.3082 -10.2519 -10.2519 -10.2106 -10.2106 -7.7771 -7.7771 -7.7049 -7.7049 1.2315 1.2315 1.8787 1.8787 2.2426 2.2426 2.8376 2.8376 2.9195 2.9195 3.1776 3.1776 3.9781 3.9781 4.3672 4.3672 9.0177 9.0177 9.1420 9.1420 9.6346 9.6346 9.6624 9.6624 k = 0.1978-0.3118-0.0000 ( 3453 PWs) bands (ev): -28.5545 -28.5545 -28.5458 -28.5458 -11.4388 -11.4388 -11.3840 -11.3840 -10.3998 -10.3998 -10.3036 -10.3036 -10.2462 -10.2462 -10.2076 -10.2076 -7.7848 -7.7848 -7.7019 -7.7019 1.2251 1.2251 1.8908 1.8908 2.2245 2.2245 2.8523 2.8523 2.9241 2.9241 3.1985 3.1985 3.9645 3.9645 4.3737 4.3737 9.0095 9.0095 9.1250 9.1250 9.5879 9.5879 9.6340 9.6340 k = 0.1907-0.3007-0.0000 ( 3451 PWs) bands (ev): -28.5550 -28.5550 -28.5461 -28.5461 -11.4389 -11.4389 -11.3804 -11.3804 -10.4017 -10.4017 -10.2987 -10.2987 -10.2405 -10.2405 -10.2046 -10.2046 -7.7932 -7.7932 -7.6985 -7.6985 1.2180 1.2180 1.9039 1.9039 2.2086 2.2086 2.8656 2.8656 2.9293 2.9293 3.2196 3.2196 3.9495 3.9495 4.3798 4.3798 9.0009 9.0009 9.1103 9.1103 9.5367 9.5367 9.6073 9.6073 k = 0.1836-0.2896-0.0000 ( 3451 PWs) bands (ev): -28.5555 -28.5555 -28.5464 -28.5464 -11.4389 -11.4389 -11.3767 -11.3767 -10.4037 -10.4037 -10.2934 -10.2934 -10.2347 -10.2347 -10.2016 -10.2016 -7.8022 -7.8022 -7.6947 -7.6947 1.2099 1.2099 1.9178 1.9178 2.1954 2.1954 2.8776 2.8776 2.9350 2.9350 3.2407 3.2407 3.9330 3.9330 4.3854 4.3854 8.9918 8.9918 9.0978 9.0978 9.4815 9.4815 9.5823 9.5823 k = 0.1766-0.2784-0.0000 ( 3455 PWs) bands (ev): -28.5561 -28.5561 -28.5467 -28.5467 -11.4390 -11.4390 -11.3730 -11.3730 -10.4058 -10.4058 -10.2878 -10.2878 -10.2289 -10.2289 -10.1986 -10.1986 -7.8117 -7.8117 -7.6905 -7.6905 1.2007 1.2007 1.9324 1.9324 2.1852 2.1852 2.8883 2.8883 2.9413 2.9413 3.2617 3.2617 3.9151 3.9151 4.3904 4.3904 8.9821 8.9821 9.0875 9.0875 9.4230 9.4230 9.5589 9.5589 k = 0.1695-0.2673-0.0000 ( 3455 PWs) bands (ev): -28.5566 -28.5566 -28.5470 -28.5470 -11.4392 -11.4392 -11.3693 -11.3693 -10.4078 -10.4078 -10.2819 -10.2819 -10.2230 -10.2230 -10.1957 -10.1957 -7.8218 -7.8218 -7.6860 -7.6860 1.1901 1.1901 1.9477 1.9477 2.1783 2.1783 2.8978 2.8978 2.9482 2.9482 3.2827 3.2827 3.8958 3.8958 4.3947 4.3947 8.9715 8.9715 9.0795 9.0795 9.3616 9.3616 9.5368 9.5368 k = 0.1624-0.2562-0.0000 ( 3457 PWs) bands (ev): -28.5571 -28.5571 -28.5473 -28.5473 -11.4394 -11.4394 -11.3655 -11.3655 -10.4099 -10.4099 -10.2757 -10.2757 -10.2172 -10.2172 -10.1927 -10.1927 -7.8323 -7.8323 -7.6813 -7.6813 1.1781 1.1781 1.9636 1.9636 2.1749 2.1749 2.9060 2.9060 2.9557 2.9557 3.3035 3.3035 3.8750 3.8750 4.3983 4.3983 8.9599 8.9599 9.0737 9.0737 9.2982 9.2982 9.5160 9.5160 k = 0.1554-0.2450-0.0000 ( 3457 PWs) bands (ev): -28.5576 -28.5576 -28.5476 -28.5476 -11.4397 -11.4397 -11.3617 -11.3617 -10.4119 -10.4119 -10.2694 -10.2694 -10.2115 -10.2115 -10.1898 -10.1898 -7.8431 -7.8431 -7.6763 -7.6763 1.1644 1.1644 1.9800 1.9800 2.1753 2.1753 2.9132 2.9132 2.9639 2.9639 3.3240 3.3240 3.8530 3.8530 4.4011 4.4011 8.9467 8.9467 9.0701 9.0701 9.2336 9.2336 9.4964 9.4964 k = 0.1483-0.2339-0.0000 ( 3455 PWs) bands (ev): -28.5581 -28.5581 -28.5480 -28.5480 -11.4400 -11.4400 -11.3579 -11.3579 -10.4138 -10.4138 -10.2630 -10.2630 -10.2058 -10.2058 -10.1868 -10.1868 -7.8543 -7.8543 -7.6710 -7.6710 1.1492 1.1492 1.9967 1.9967 2.1794 2.1794 2.9193 2.9193 2.9728 2.9728 3.3442 3.3442 3.8296 3.8296 4.4030 4.4030 8.9313 8.9313 9.0686 9.0686 9.1689 9.1689 9.4778 9.4778 k = 0.1413-0.2227-0.0000 ( 3453 PWs) bands (ev): -28.5586 -28.5586 -28.5483 -28.5483 -11.4403 -11.4403 -11.3542 -11.3542 -10.4157 -10.4157 -10.2565 -10.2565 -10.2001 -10.2001 -10.1839 -10.1839 -7.8657 -7.8657 -7.6657 -7.6657 1.1325 1.1325 2.0137 2.0137 2.1873 2.1873 2.9243 2.9243 2.9824 2.9824 3.3641 3.3641 3.8050 3.8050 4.4040 4.4040 8.9124 8.9124 9.0692 9.0692 9.1058 9.1058 9.4602 9.4602 k = 0.1342-0.2116-0.0000 ( 3449 PWs) bands (ev): -28.5591 -28.5591 -28.5486 -28.5486 -11.4407 -11.4407 -11.3505 -11.3505 -10.4175 -10.4175 -10.2500 -10.2500 -10.1946 -10.1946 -10.1809 -10.1809 -7.8773 -7.8773 -7.6602 -7.6602 1.1145 1.1145 2.0308 2.0308 2.1989 2.1989 2.9284 2.9284 2.9926 2.9926 3.3835 3.3835 3.7792 3.7792 4.4040 4.4040 8.8877 8.8877 9.0472 9.0472 9.0720 9.0720 9.4435 9.4435 k = 0.1271-0.2005-0.0000 ( 3451 PWs) bands (ev): -28.5595 -28.5595 -28.5489 -28.5489 -11.4411 -11.4411 -11.3468 -11.3468 -10.4192 -10.4192 -10.2435 -10.2435 -10.1891 -10.1891 -10.1779 -10.1779 -7.8890 -7.8890 -7.6547 -7.6547 1.0953 1.0953 2.0479 2.0479 2.2140 2.2140 2.9316 2.9316 3.0035 3.0035 3.4024 3.4024 3.7524 3.7524 4.4031 4.4031 8.8538 8.8538 8.9972 8.9972 9.0764 9.0764 9.4277 9.4277 k = 0.1201-0.1893-0.0000 ( 3453 PWs) bands (ev): -28.5600 -28.5600 -28.5491 -28.5491 -11.4416 -11.4416 -11.3433 -11.3433 -10.4208 -10.4208 -10.2373 -10.2373 -10.1837 -10.1837 -10.1749 -10.1749 -7.9006 -7.9006 -7.6492 -7.6492 1.0752 1.0752 2.0650 2.0650 2.2324 2.2324 2.9340 2.9340 3.0149 3.0149 3.4208 3.4208 3.7246 3.7246 4.4011 4.4011 8.8084 8.8084 8.9586 8.9586 9.0827 9.0827 9.4126 9.4126 k = 0.1130-0.1782-0.0000 ( 3449 PWs) bands (ev): -28.5604 -28.5604 -28.5494 -28.5494 -11.4421 -11.4421 -11.3398 -11.3398 -10.4223 -10.4223 -10.2312 -10.2312 -10.1785 -10.1785 -10.1718 -10.1718 -7.9122 -7.9122 -7.6437 -7.6437 1.0545 1.0545 2.0817 2.0817 2.2538 2.2538 2.9357 2.9357 3.0270 3.0270 3.4386 3.4386 3.6960 3.6960 4.3982 4.3982 8.7536 8.7536 8.9298 8.9298 9.0905 9.0905 9.3982 9.3982 k = 0.1059-0.1671-0.0000 ( 3447 PWs) bands (ev): -28.5609 -28.5609 -28.5497 -28.5497 -11.4425 -11.4425 -11.3365 -11.3365 -10.4237 -10.4237 -10.2254 -10.2254 -10.1733 -10.1733 -10.1687 -10.1687 -7.9237 -7.9237 -7.6383 -7.6383 1.0334 1.0334 2.0982 2.0982 2.2779 2.2779 2.9367 2.9367 3.0394 3.0394 3.4557 3.4557 3.6666 3.6666 4.3943 4.3943 8.6940 8.6940 8.9070 8.9070 9.0997 9.0997 9.3847 9.3847 k = 0.0989-0.1559-0.0000 ( 3435 PWs) bands (ev): -28.5613 -28.5613 -28.5499 -28.5499 -11.4430 -11.4430 -11.3333 -11.3333 -10.4250 -10.4250 -10.2200 -10.2200 -10.1684 -10.1684 -10.1655 -10.1655 -7.9349 -7.9349 -7.6330 -7.6330 1.0123 1.0123 2.1142 2.1142 2.3044 2.3044 2.9372 2.9372 3.0523 3.0523 3.4721 3.4721 3.6367 3.6367 4.3896 4.3896 8.6329 8.6329 8.8876 8.8876 9.1101 9.1101 9.3719 9.3719 k = 0.0918-0.1448-0.0000 ( 3433 PWs) bands (ev): -28.5617 -28.5617 -28.5502 -28.5502 -11.4436 -11.4436 -11.3302 -11.3302 -10.4263 -10.4263 -10.2150 -10.2150 -10.1637 -10.1637 -10.1620 -10.1620 -7.9459 -7.9459 -7.6279 -7.6279 0.9914 0.9914 2.1295 2.1295 2.3328 2.3328 2.9371 2.9371 3.0653 3.0653 3.4877 3.4877 3.6063 3.6063 4.3840 4.3840 8.5722 8.5722 8.8701 8.8701 9.1214 9.1214 9.3599 9.3599 k = 0.0848-0.1336-0.0000 ( 3431 PWs) bands (ev): -28.5620 -28.5620 -28.5504 -28.5504 -11.4441 -11.4441 -11.3273 -11.3273 -10.4274 -10.4274 -10.2104 -10.2104 -10.1598 -10.1598 -10.1579 -10.1579 -7.9564 -7.9564 -7.6229 -7.6229 0.9710 0.9710 2.1442 2.1442 2.3629 2.3629 2.9364 2.9364 3.0785 3.0785 3.5022 3.5022 3.5760 3.5760 4.3778 4.3778 8.5132 8.5132 8.8539 8.8539 9.1333 9.1333 9.3489 9.3489 k = 0.0777-0.1225-0.0000 ( 3433 PWs) bands (ev): -28.5624 -28.5624 -28.5506 -28.5506 -11.4446 -11.4446 -11.3246 -11.3246 -10.4284 -10.4284 -10.2063 -10.2063 -10.1565 -10.1565 -10.1534 -10.1534 -7.9664 -7.9664 -7.6182 -7.6182 0.9513 0.9513 2.1581 2.1581 2.3943 2.3943 2.9354 2.9354 3.0917 3.0917 3.5147 3.5147 3.5466 3.5466 4.3709 4.3709 8.4568 8.4568 8.8388 8.8388 9.1455 9.1455 9.3389 9.3389 k = 0.0706-0.1114-0.0000 ( 3427 PWs) bands (ev): -28.5627 -28.5627 -28.5509 -28.5509 -11.4451 -11.4451 -11.3221 -11.3221 -10.4293 -10.4293 -10.2027 -10.2027 -10.1535 -10.1535 -10.1490 -10.1490 -7.9759 -7.9759 -7.6138 -7.6138 0.9325 0.9325 2.1711 2.1711 2.4265 2.4265 2.9339 2.9339 3.1046 3.1046 3.5099 3.5099 3.5339 3.5339 4.3636 4.3636 8.4036 8.4036 8.8247 8.8247 9.1575 9.1575 9.3301 9.3301 k = 0.0636-0.1002-0.0000 ( 3425 PWs) bands (ev): -28.5630 -28.5630 -28.5510 -28.5510 -11.4455 -11.4455 -11.3198 -11.3198 -10.4301 -10.4301 -10.1996 -10.1996 -10.1506 -10.1506 -10.1447 -10.1447 -7.9847 -7.9847 -7.6097 -7.6097 0.9150 0.9150 2.1832 2.1832 2.4590 2.4590 2.9321 2.9321 3.1172 3.1172 3.4821 3.4821 3.5438 3.5438 4.3561 4.3561 8.3541 8.3541 8.8116 8.8116 9.1690 9.1690 9.3226 9.3226 k = 0.0565-0.0891-0.0000 ( 3425 PWs) bands (ev): -28.5632 -28.5632 -28.5512 -28.5512 -11.4460 -11.4460 -11.3177 -11.3177 -10.4308 -10.4308 -10.1968 -10.1968 -10.1479 -10.1479 -10.1406 -10.1406 -7.9929 -7.9929 -7.6059 -7.6059 0.8988 0.8988 2.1942 2.1942 2.4915 2.4915 2.9298 2.9298 3.1292 3.1292 3.4532 3.4532 3.5544 3.5544 4.3485 4.3485 8.3087 8.3087 8.7996 8.7996 9.1794 9.1794 9.3166 9.3166 k = 0.0494-0.0780-0.0000 ( 3431 PWs) bands (ev): -28.5635 -28.5635 -28.5514 -28.5514 -11.4464 -11.4464 -11.3158 -11.3158 -10.4314 -10.4314 -10.1945 -10.1945 -10.1455 -10.1455 -10.1368 -10.1368 -8.0002 -8.0002 -7.6026 -7.6026 0.8841 0.8841 2.2040 2.2040 2.5233 2.5233 2.9272 2.9272 3.1403 3.1403 3.4253 3.4253 3.5643 3.5643 4.3410 4.3410 8.2678 8.2678 8.7888 8.7888 9.1886 9.1886 9.3122 9.3122 k = 0.0424-0.0668-0.0000 ( 3429 PWs) bands (ev): -28.5637 -28.5637 -28.5515 -28.5515 -11.4467 -11.4467 -11.3141 -11.3141 -10.4319 -10.4319 -10.1926 -10.1926 -10.1433 -10.1433 -10.1334 -10.1334 -8.0067 -8.0067 -7.5996 -7.5996 0.8711 0.8711 2.2127 2.2127 2.5538 2.5538 2.9242 2.9242 3.1505 3.1505 3.3990 3.3990 3.5732 3.5732 4.3339 4.3339 8.2317 8.2317 8.7792 8.7792 9.1959 9.1959 9.3096 9.3096 k = 0.0353-0.0557-0.0000 ( 3431 PWs) bands (ev): -28.5639 -28.5639 -28.5516 -28.5516 -11.4470 -11.4470 -11.3127 -11.3127 -10.4324 -10.4324 -10.1910 -10.1910 -10.1415 -10.1415 -10.1304 -10.1304 -8.0124 -8.0124 -7.5970 -7.5970 0.8599 0.8599 2.2201 2.2201 2.5823 2.5823 2.9210 2.9210 3.1595 3.1595 3.3749 3.3749 3.5808 3.5808 4.3274 4.3274 8.2007 8.2007 8.7709 8.7709 9.2015 9.2015 9.3085 9.3085 k = 0.0283-0.0445-0.0000 ( 3433 PWs) bands (ev): -28.5640 -28.5640 -28.5517 -28.5517 -11.4473 -11.4473 -11.3116 -11.3116 -10.4328 -10.4328 -10.1898 -10.1898 -10.1399 -10.1399 -10.1279 -10.1279 -8.0170 -8.0170 -7.5948 -7.5948 0.8506 0.8506 2.2262 2.2262 2.6079 2.6079 2.9176 2.9176 3.1672 3.1672 3.3538 3.3538 3.5872 3.5872 4.3218 4.3218 8.1750 8.1750 8.7641 8.7641 9.2054 9.2054 9.3088 9.3088 k = 0.0212-0.0334-0.0000 ( 3431 PWs) bands (ev): -28.5641 -28.5641 -28.5518 -28.5518 -11.4475 -11.4475 -11.3107 -11.3107 -10.4330 -10.4330 -10.1888 -10.1888 -10.1387 -10.1387 -10.1258 -10.1258 -8.0207 -8.0207 -7.5932 -7.5932 0.8433 0.8433 2.2310 2.2310 2.6296 2.6296 2.9143 2.9143 3.1733 3.1733 3.3364 3.3364 3.5923 3.5923 4.3171 4.3171 8.1549 8.1549 8.7587 8.7587 9.2078 9.2078 9.3097 9.3097 k = 0.0141-0.0223-0.0000 ( 3431 PWs) bands (ev): -28.5642 -28.5642 -28.5518 -28.5518 -11.4477 -11.4477 -11.3100 -11.3100 -10.4332 -10.4332 -10.1881 -10.1881 -10.1378 -10.1378 -10.1244 -10.1244 -8.0233 -8.0233 -7.5920 -7.5920 0.8380 0.8380 2.2344 2.2344 2.6463 2.6463 2.9114 2.9114 3.1778 3.1778 3.3233 3.3233 3.5960 3.5960 4.3137 4.3137 8.1404 8.1404 8.7548 8.7548 9.2092 9.2092 9.3109 9.3109 k = 0.0071-0.0111-0.0000 ( 3433 PWs) bands (ev): -28.5642 -28.5642 -28.5519 -28.5519 -11.4478 -11.4478 -11.3096 -11.3096 -10.4333 -10.4333 -10.1877 -10.1877 -10.1373 -10.1373 -10.1235 -10.1235 -8.0249 -8.0249 -7.5912 -7.5912 0.8348 0.8348 2.2365 2.2365 2.6569 2.6569 2.9093 2.9093 3.1805 3.1805 3.3152 3.3152 3.5982 3.5982 4.3115 4.3115 8.1316 8.1316 8.7524 8.7524 9.2099 9.2099 9.3118 9.3118 k = 0.0000 0.0000 0.0000 ( 3433 PWs) bands (ev): -28.5643 -28.5643 -28.5519 -28.5519 -11.4478 -11.4478 -11.3095 -11.3095 -10.4334 -10.4334 -10.1876 -10.1876 -10.1371 -10.1371 -10.1232 -10.1232 -8.0254 -8.0254 -7.5910 -7.5910 0.8337 0.8337 2.2372 2.2372 2.6606 2.6606 2.9086 2.9086 3.1814 3.1814 3.3124 3.3124 3.5990 3.5990 4.3108 4.3108 8.1287 8.1287 8.7517 8.7517 9.2101 9.2101 9.3121 9.3121 k = 0.0000 0.0000 0.0000 ( 3433 PWs) bands (ev): -28.5643 -28.5643 -28.5519 -28.5519 -11.4478 -11.4478 -11.3095 -11.3095 -10.4334 -10.4334 -10.1876 -10.1876 -10.1371 -10.1371 -10.1232 -10.1232 -8.0254 -8.0254 -7.5910 -7.5910 0.8337 0.8337 2.2372 2.2372 2.6606 2.6606 2.9086 2.9086 3.1814 3.1814 3.3124 3.3124 3.5990 3.5990 4.3108 4.3108 8.1287 8.1287 8.7517 8.7517 9.2101 9.2101 9.3121 9.3121 k = 0.0116-0.0055-0.0021 ( 3434 PWs) bands (ev): -28.5642 -28.5642 -28.5519 -28.5519 -11.4478 -11.4478 -11.3096 -11.3096 -10.4333 -10.4333 -10.1877 -10.1877 -10.1373 -10.1373 -10.1235 -10.1235 -8.0249 -8.0249 -7.5913 -7.5913 0.8348 0.8348 2.2365 2.2365 2.6576 2.6576 2.9090 2.9090 3.1810 3.1810 3.3139 3.3139 3.5986 3.5986 4.3113 4.3113 8.1312 8.1312 8.7526 8.7526 9.2097 9.2097 9.3119 9.3119 k = 0.0233-0.0110-0.0043 ( 3436 PWs) bands (ev): -28.5642 -28.5642 -28.5518 -28.5518 -11.4477 -11.4477 -11.3100 -11.3100 -10.4332 -10.4332 -10.1881 -10.1881 -10.1378 -10.1378 -10.1244 -10.1244 -8.0233 -8.0233 -7.5920 -7.5920 0.8381 0.8381 2.2345 2.2345 2.6488 2.6488 2.9102 2.9102 3.1798 3.1798 3.3185 3.3185 3.5975 3.5975 4.3127 4.3127 8.1386 8.1386 8.7555 8.7555 9.2085 9.2085 9.3114 9.3114 k = 0.0349-0.0164-0.0064 ( 3435 PWs) bands (ev): -28.5641 -28.5641 -28.5518 -28.5518 -11.4475 -11.4475 -11.3107 -11.3107 -10.4330 -10.4330 -10.1888 -10.1888 -10.1387 -10.1387 -10.1258 -10.1258 -8.0207 -8.0207 -7.5932 -7.5932 0.8436 0.8436 2.2311 2.2311 2.6349 2.6349 2.9118 2.9118 3.1777 3.1777 3.3260 3.3260 3.5958 3.5958 4.3150 4.3150 8.1509 8.1509 8.7602 8.7602 9.2067 9.2067 9.3104 9.3104 k = 0.0465-0.0219-0.0085 ( 3435 PWs) bands (ev): -28.5640 -28.5640 -28.5517 -28.5517 -11.4472 -11.4472 -11.3116 -11.3116 -10.4327 -10.4327 -10.1898 -10.1898 -10.1400 -10.1400 -10.1278 -10.1278 -8.0170 -8.0170 -7.5950 -7.5950 0.8511 0.8511 2.2262 2.2262 2.6166 2.6166 2.9137 2.9137 3.1745 3.1745 3.3360 3.3360 3.5935 3.5935 4.3180 4.3180 8.1680 8.1680 8.7663 8.7663 9.2045 9.2045 9.3092 9.3092 k = 0.0581-0.0274-0.0107 ( 3433 PWs) bands (ev): -28.5638 -28.5638 -28.5516 -28.5516 -11.4470 -11.4470 -11.3128 -11.3128 -10.4323 -10.4323 -10.1910 -10.1910 -10.1416 -10.1416 -10.1302 -10.1302 -8.0123 -8.0123 -7.5972 -7.5972 0.8607 0.8607 2.2199 2.2199 2.5950 2.5950 2.9155 2.9155 3.1702 3.1702 3.3480 3.3480 3.5910 3.5910 4.3217 4.3217 8.1898 8.1898 8.7734 8.7734 9.2023 9.2023 9.3078 9.3078 k = 0.0698-0.0329-0.0128 ( 3437 PWs) bands (ev): -28.5636 -28.5636 -28.5515 -28.5515 -11.4466 -11.4466 -11.3142 -11.3142 -10.4318 -10.4318 -10.1927 -10.1927 -10.1435 -10.1435 -10.1331 -10.1331 -8.0067 -8.0067 -7.5998 -7.5998 0.8723 0.8723 2.2118 2.2118 2.5710 2.5710 2.9171 2.9171 3.1648 3.1648 3.3614 3.3614 3.5884 3.5884 4.3259 4.3259 8.2161 8.2161 8.7810 8.7810 9.2003 9.2003 9.3063 9.3063 k = 0.0814-0.0384-0.0149 ( 3436 PWs) bands (ev): -28.5634 -28.5634 -28.5514 -28.5514 -11.4462 -11.4462 -11.3159 -11.3159 -10.4312 -10.4312 -10.1947 -10.1947 -10.1457 -10.1457 -10.1363 -10.1363 -8.0003 -8.0003 -7.6029 -7.6029 0.8857 0.8857 2.2021 2.2021 2.5455 2.5455 2.9185 2.9185 3.1584 3.1584 3.3755 3.3755 3.5862 3.5862 4.3303 4.3303 8.2467 8.2467 8.7883 8.7883 9.1992 9.1992 9.3051 9.3051 k = 0.0930-0.0438-0.0171 ( 3435 PWs) bands (ev): -28.5632 -28.5632 -28.5512 -28.5512 -11.4458 -11.4458 -11.3178 -11.3178 -10.4305 -10.4305 -10.1973 -10.1973 -10.1482 -10.1482 -10.1396 -10.1396 -7.9930 -7.9930 -7.6064 -7.6064 0.9008 0.9008 2.1904 2.1904 2.5194 2.5194 2.9195 2.9195 3.1509 3.1509 3.3893 3.3893 3.5849 3.5849 4.3348 4.3348 8.2813 8.2813 8.7948 8.7948 9.1993 9.1993 9.3044 9.3044 k = 0.1047-0.0493-0.0192 ( 3434 PWs) bands (ev): -28.5629 -28.5629 -28.5510 -28.5510 -11.4453 -11.4453 -11.3199 -11.3199 -10.4298 -10.4298 -10.2003 -10.2003 -10.1510 -10.1510 -10.1431 -10.1431 -7.9849 -7.9849 -7.6102 -7.6102 0.9176 0.9176 2.1767 2.1767 2.4932 2.4932 2.9203 2.9203 3.1425 3.1425 3.4020 3.4020 3.5852 3.5852 4.3392 4.3392 8.3196 8.3196 8.7995 8.7995 9.2010 9.2010 9.3047 9.3047 k = 0.1163-0.0548-0.0213 ( 3439 PWs) bands (ev): -28.5626 -28.5626 -28.5508 -28.5508 -11.4448 -11.4448 -11.3223 -11.3223 -10.4290 -10.4290 -10.2040 -10.2040 -10.1539 -10.1539 -10.1467 -10.1467 -7.9762 -7.9762 -7.6144 -7.6144 0.9358 0.9358 2.1610 2.1610 2.4677 2.4677 2.9207 2.9207 3.1334 3.1334 3.4123 3.4123 3.5880 3.5880 4.3434 4.3434 8.3613 8.3613 8.8019 8.8019 9.2044 9.2044 9.3067 9.3067 k = 0.1279-0.0603-0.0235 ( 3445 PWs) bands (ev): -28.5623 -28.5623 -28.5506 -28.5506 -11.4443 -11.4443 -11.3249 -11.3249 -10.4281 -10.4281 -10.2082 -10.2082 -10.1569 -10.1569 -10.1503 -10.1503 -7.9669 -7.9669 -7.6188 -7.6188 0.9553 0.9553 2.1431 2.1431 2.4435 2.4435 2.9207 2.9207 3.1236 3.1236 3.4195 3.4195 3.5940 3.5940 4.3471 4.3471 8.4059 8.4059 8.8014 8.8014 9.2094 9.2094 9.3113 9.3113 k = 0.1395-0.0658-0.0256 ( 3443 PWs) bands (ev): -28.5619 -28.5619 -28.5504 -28.5504 -11.4438 -11.4438 -11.3276 -11.3276 -10.4272 -10.4272 -10.2131 -10.2131 -10.1601 -10.1601 -10.1537 -10.1537 -7.9571 -7.9571 -7.6235 -7.6235 0.9758 0.9758 2.1231 2.1231 2.4208 2.4208 2.9205 2.9205 3.1133 3.1133 3.4229 3.4229 3.6036 3.6036 4.3502 4.3502 8.4530 8.4530 8.7980 8.7980 9.2155 9.2155 9.3193 9.3193 k = 0.1512-0.0712-0.0277 ( 3447 PWs) bands (ev): -28.5615 -28.5615 -28.5502 -28.5502 -11.4432 -11.4432 -11.3306 -11.3306 -10.4262 -10.4262 -10.2186 -10.2186 -10.1633 -10.1633 -10.1570 -10.1570 -7.9469 -7.9469 -7.6284 -7.6284 0.9972 0.9972 2.1013 2.1013 2.4000 2.4000 2.9199 2.9199 3.1025 3.1025 3.4226 3.4226 3.6168 3.6168 4.3527 4.3527 8.5016 8.5016 8.7917 8.7917 9.2224 9.2224 9.3316 9.3316 k = 0.1628-0.0767-0.0299 ( 3449 PWs) bands (ev): -28.5611 -28.5611 -28.5499 -28.5499 -11.4427 -11.4427 -11.3337 -11.3337 -10.4251 -10.4251 -10.2246 -10.2246 -10.1667 -10.1667 -10.1600 -10.1600 -7.9363 -7.9363 -7.6336 -7.6336 1.0194 1.0194 2.0778 2.0778 2.3811 2.3811 2.9189 2.9189 3.0916 3.0916 3.4191 3.4191 3.6330 3.6330 4.3543 4.3543 8.5506 8.5506 8.7834 8.7834 9.2299 9.2299 9.3485 9.3485 k = 0.1744-0.0822-0.0320 ( 3447 PWs) bands (ev): -28.5607 -28.5607 -28.5497 -28.5497 -11.4422 -11.4422 -11.3370 -11.3370 -10.4240 -10.4240 -10.2312 -10.2312 -10.1703 -10.1703 -10.1627 -10.1627 -7.9255 -7.9255 -7.6388 -7.6388 1.0419 1.0419 2.0532 2.0532 2.3642 2.3642 2.9174 2.9174 3.0806 3.0806 3.4130 3.4130 3.6516 3.6516 4.3552 4.3552 8.5979 8.5979 8.7747 8.7747 9.2383 9.2383 9.3699 9.3699 k = 0.1860-0.0877-0.0341 ( 3448 PWs) bands (ev): -28.5603 -28.5603 -28.5494 -28.5494 -11.4418 -11.4418 -11.3404 -11.3404 -10.4229 -10.4229 -10.2381 -10.2381 -10.1740 -10.1740 -10.1651 -10.1651 -7.9145 -7.9145 -7.6441 -7.6441 1.0647 1.0647 2.0278 2.0278 2.3491 2.3491 2.9154 2.9154 3.0696 3.0696 3.4049 3.4049 3.6719 3.6719 4.3551 4.3551 8.6389 8.6389 8.7696 8.7696 9.2485 9.2485 9.3953 9.3953 k = 0.1977-0.0932-0.0363 ( 3444 PWs) bands (ev): -28.5598 -28.5598 -28.5491 -28.5491 -11.4413 -11.4413 -11.3440 -11.3440 -10.4217 -10.4217 -10.2454 -10.2454 -10.1778 -10.1778 -10.1673 -10.1673 -7.9034 -7.9034 -7.6495 -7.6495 1.0876 1.0876 2.0020 2.0020 2.3358 2.3358 2.9126 2.9126 3.0590 3.0590 3.3953 3.3953 3.6935 3.6935 4.3542 4.3542 8.6644 8.6644 8.7767 8.7767 9.2617 9.2617 9.4240 9.4240 k = 0.2093-0.0987-0.0384 ( 3443 PWs) bands (ev): -28.5593 -28.5593 -28.5488 -28.5488 -11.4409 -11.4409 -11.3477 -11.3477 -10.4205 -10.4205 -10.2529 -10.2529 -10.1816 -10.1816 -10.1694 -10.1694 -7.8923 -7.8923 -7.6549 -7.6549 1.1102 1.1102 1.9762 1.9762 2.3241 2.3241 2.9089 2.9089 3.0488 3.0488 3.3846 3.3846 3.7159 3.7159 4.3524 4.3524 8.6678 8.6678 8.8015 8.8015 9.2793 9.2793 9.4553 9.4553 k = 0.2209-0.1041-0.0405 ( 3443 PWs) bands (ev): -28.5589 -28.5589 -28.5486 -28.5486 -11.4406 -11.4406 -11.3514 -11.3514 -10.4194 -10.4194 -10.2606 -10.2606 -10.1854 -10.1854 -10.1712 -10.1712 -7.8814 -7.8814 -7.6603 -7.6603 1.1324 1.1324 1.9507 1.9507 2.3140 2.3140 2.9040 2.9040 3.0394 3.0394 3.3731 3.3731 3.7389 3.7389 4.3499 4.3499 8.6569 8.6569 8.8350 8.8350 9.3028 9.3028 9.4887 9.4887 k = 0.2326-0.1096-0.0427 ( 3445 PWs) bands (ev): -28.5584 -28.5584 -28.5483 -28.5483 -11.4403 -11.4403 -11.3552 -11.3552 -10.4182 -10.4182 -10.2684 -10.2684 -10.1891 -10.1891 -10.1729 -10.1729 -7.8705 -7.8705 -7.6656 -7.6656 1.1540 1.1540 1.9259 1.9259 2.3053 2.3053 2.8979 2.8979 3.0309 3.0309 3.3610 3.3610 3.7621 3.7621 4.3466 4.3466 8.6397 8.6397 8.8680 8.8680 9.3336 9.3336 9.5238 9.5238 k = 0.2442-0.1151-0.0448 ( 3445 PWs) bands (ev): -28.5579 -28.5579 -28.5480 -28.5480 -11.4400 -11.4400 -11.3591 -11.3591 -10.4171 -10.4171 -10.2762 -10.2762 -10.1928 -10.1928 -10.1746 -10.1746 -7.8599 -7.8599 -7.6708 -7.6708 1.1748 1.1748 1.9018 1.9018 2.2981 2.2981 2.8902 2.8902 3.0236 3.0236 3.3486 3.3486 3.7856 3.7856 4.3427 4.3427 8.6198 8.6198 8.8962 8.8962 9.3724 9.3724 9.5604 9.5604 k = 0.2558-0.1206-0.0469 ( 3442 PWs) bands (ev): -28.5574 -28.5574 -28.5477 -28.5477 -11.4398 -11.4398 -11.3630 -11.3630 -10.4160 -10.4160 -10.2839 -10.2839 -10.1963 -10.1963 -10.1762 -10.1762 -7.8495 -7.8495 -7.6759 -7.6759 1.1948 1.1948 1.8787 1.8787 2.2924 2.2924 2.8810 2.8810 3.0175 3.0175 3.3360 3.3360 3.8091 3.8091 4.3383 4.3383 8.5986 8.5986 8.9181 8.9181 9.4192 9.4192 9.5980 9.5980 k = 0.2674-0.1261-0.0491 ( 3442 PWs) bands (ev): -28.5569 -28.5569 -28.5474 -28.5474 -11.4396 -11.4396 -11.3669 -11.3669 -10.4149 -10.4149 -10.2915 -10.2915 -10.1997 -10.1997 -10.1777 -10.1777 -7.8395 -7.8395 -7.6808 -7.6808 1.2137 1.2137 1.8567 1.8567 2.2881 2.2881 2.8702 2.8702 3.0126 3.0126 3.3233 3.3233 3.8325 3.8325 4.3335 4.3335 8.5769 8.5769 8.9335 8.9335 9.4732 9.4732 9.6366 9.6366 k = 0.2791-0.1315-0.0512 ( 3438 PWs) bands (ev): -28.5564 -28.5564 -28.5471 -28.5471 -11.4395 -11.4395 -11.3709 -11.3709 -10.4139 -10.4139 -10.2990 -10.2990 -10.2029 -10.2029 -10.1791 -10.1791 -7.8298 -7.8298 -7.6856 -7.6856 1.2317 1.2317 1.8356 1.8356 2.2853 2.2853 2.8579 2.8579 3.0089 3.0089 3.3106 3.3106 3.8557 3.8557 4.3284 4.3284 8.5552 8.5552 8.9431 8.9431 9.5331 9.5331 9.6759 9.6759 k = 0.2907-0.1370-0.0533 ( 3439 PWs) bands (ev): -28.5559 -28.5559 -28.5469 -28.5469 -11.4395 -11.4395 -11.3747 -11.3747 -10.4129 -10.4129 -10.3064 -10.3064 -10.2058 -10.2058 -10.1805 -10.1805 -7.8206 -7.8206 -7.6901 -7.6901 1.2485 1.2485 1.8155 1.8155 2.2839 2.2839 2.8441 2.8441 3.0063 3.0063 3.2980 3.2980 3.8787 3.8787 4.3231 4.3231 8.5339 8.5339 8.9479 8.9479 9.5973 9.5973 9.7159 9.7159 k = 0.3023-0.1425-0.0555 ( 3441 PWs) bands (ev): -28.5554 -28.5554 -28.5466 -28.5466 -11.4395 -11.4395 -11.3786 -11.3786 -10.4121 -10.4121 -10.3134 -10.3134 -10.2086 -10.2086 -10.1819 -10.1819 -7.8119 -7.8119 -7.6944 -7.6944 1.2644 1.2644 1.7963 1.7963 2.2839 2.2839 2.8291 2.8291 3.0045 3.0045 3.2856 3.2856 3.9014 3.9014 4.3177 4.3177 8.5131 8.5131 8.9487 8.9487 9.6644 9.6644 9.7564 9.7564 k = 0.3140-0.1480-0.0576 ( 3437 PWs) bands (ev): -28.5549 -28.5549 -28.5464 -28.5464 -11.4395 -11.4395 -11.3823 -11.3823 -10.4113 -10.4113 -10.3203 -10.3203 -10.2111 -10.2111 -10.1833 -10.1833 -7.8036 -7.8036 -7.6985 -7.6985 1.2794 1.2794 1.7779 1.7779 2.2855 2.2855 2.8131 2.8131 3.0036 3.0036 3.2734 3.2734 3.9238 3.9238 4.3123 4.3123 8.4931 8.4931 8.9464 8.9464 9.7331 9.7331 9.7975 9.7975 k = 0.3256-0.1535-0.0597 ( 3442 PWs) bands (ev): -28.5545 -28.5545 -28.5461 -28.5461 -11.4396 -11.4396 -11.3860 -11.3860 -10.4106 -10.4106 -10.3268 -10.3268 -10.2134 -10.2134 -10.1846 -10.1846 -7.7958 -7.7958 -7.7023 -7.7023 1.2937 1.2937 1.7601 1.7601 2.2884 2.2884 2.7961 2.7961 3.0032 3.0032 3.2616 3.2616 3.9457 3.9457 4.3069 4.3069 8.4740 8.4740 8.9416 8.9416 9.8015 9.8015 9.8397 9.8397 k = 0.3372-0.1589-0.0619 ( 3447 PWs) bands (ev): -28.5540 -28.5540 -28.5459 -28.5459 -11.4397 -11.4397 -11.3896 -11.3896 -10.4099 -10.4099 -10.3331 -10.3331 -10.2154 -10.2154 -10.1859 -10.1859 -7.7886 -7.7886 -7.7058 -7.7058 1.3073 1.3073 1.7427 1.7427 2.2926 2.2926 2.7783 2.7783 3.0033 3.0033 3.2501 3.2501 3.9673 3.9673 4.3015 4.3015 8.4559 8.4559 8.9348 8.9348 9.8649 9.8649 9.8865 9.8865 k = 0.3488-0.1644-0.0640 ( 3445 PWs) bands (ev): -28.5536 -28.5536 -28.5457 -28.5457 -11.4399 -11.4399 -11.3930 -11.3930 -10.4094 -10.4094 -10.3390 -10.3390 -10.2171 -10.2171 -10.1871 -10.1871 -7.7819 -7.7819 -7.7091 -7.7091 1.3204 1.3204 1.7258 1.7258 2.2982 2.2982 2.7599 2.7599 3.0039 3.0039 3.2391 3.2391 3.9883 3.9883 4.2962 4.2962 8.4389 8.4389 8.9266 8.9266 9.9136 9.9136 9.9469 9.9469 k = 0.3605-0.1699-0.0661 ( 3445 PWs) bands (ev): -28.5532 -28.5532 -28.5455 -28.5455 -11.4400 -11.4400 -11.3962 -11.3962 -10.4089 -10.4089 -10.3445 -10.3445 -10.2186 -10.2186 -10.1884 -10.1884 -7.7757 -7.7757 -7.7121 -7.7121 1.3333 1.3333 1.7090 1.7090 2.3049 2.3049 2.7411 2.7411 3.0047 3.0047 3.2285 3.2285 4.0089 4.0089 4.2910 4.2910 8.4231 8.4231 8.9174 8.9174 9.9553 9.9553 10.0123 10.0123 k = 0.3721-0.1754-0.0683 ( 3443 PWs) bands (ev): -28.5528 -28.5528 -28.5453 -28.5453 -11.4402 -11.4402 -11.3994 -11.3994 -10.4085 -10.4085 -10.3497 -10.3497 -10.2198 -10.2198 -10.1896 -10.1896 -7.7701 -7.7701 -7.7148 -7.7148 1.3460 1.3460 1.6923 1.6923 2.3127 2.3127 2.7218 2.7218 3.0059 3.0059 3.2185 3.2185 4.0289 4.0289 4.2857 4.2857 8.4085 8.4085 8.9075 8.9075 9.9952 9.9952 10.0768 10.0768 k = 0.3837-0.1809-0.0704 ( 3443 PWs) bands (ev): -28.5524 -28.5524 -28.5451 -28.5451 -11.4404 -11.4404 -11.4023 -11.4023 -10.4082 -10.4082 -10.3546 -10.3546 -10.2208 -10.2208 -10.1907 -10.1907 -7.7649 -7.7649 -7.7173 -7.7173 1.3588 1.3588 1.6757 1.6757 2.3215 2.3215 2.7024 2.7024 3.0072 3.0072 3.2091 3.2091 4.0483 4.0483 4.2805 4.2805 8.3952 8.3952 8.8973 8.8973 10.0338 10.0338 10.1393 10.1393 k = 0.3953-0.1863-0.0725 ( 3443 PWs) bands (ev): -28.5521 -28.5521 -28.5449 -28.5449 -11.4405 -11.4405 -11.4050 -11.4050 -10.4079 -10.4079 -10.3590 -10.3590 -10.2216 -10.2216 -10.1918 -10.1918 -7.7603 -7.7603 -7.7196 -7.7196 1.3718 1.3718 1.6590 1.6590 2.3312 2.3312 2.6829 2.6829 3.0086 3.0086 3.2002 3.2002 4.0671 4.0671 4.2751 4.2751 8.3831 8.3831 8.8871 8.8871 10.0709 10.0709 10.1992 10.1992 k = 0.4070-0.1918-0.0747 ( 3445 PWs) bands (ev): -28.5518 -28.5518 -28.5448 -28.5448 -11.4407 -11.4407 -11.4075 -11.4075 -10.4076 -10.4076 -10.3630 -10.3630 -10.2222 -10.2222 -10.1928 -10.1928 -7.7561 -7.7561 -7.7217 -7.7217 1.3850 1.3850 1.6422 1.6422 2.3415 2.3415 2.6636 2.6636 3.0102 3.0102 3.1921 3.1921 4.0852 4.0852 4.2694 4.2694 8.3724 8.3724 8.8772 8.8772 10.1061 10.1061 10.2563 10.2563 k = 0.4186-0.1973-0.0768 ( 3441 PWs) bands (ev): -28.5515 -28.5515 -28.5447 -28.5447 -11.4408 -11.4408 -11.4097 -11.4097 -10.4074 -10.4074 -10.3666 -10.3666 -10.2226 -10.2226 -10.1938 -10.1938 -7.7524 -7.7524 -7.7235 -7.7235 1.3987 1.3987 1.6253 1.6253 2.3524 2.3524 2.6447 2.6447 3.0118 3.0118 3.1847 3.1847 4.1025 4.1025 4.2635 4.2635 8.3629 8.3629 8.8678 8.8678 10.1391 10.1391 10.3102 10.3102 k = 0.4302-0.2028-0.0789 ( 3443 PWs) bands (ev): -28.5513 -28.5513 -28.5446 -28.5446 -11.4409 -11.4409 -11.4117 -11.4117 -10.4072 -10.4072 -10.3698 -10.3698 -10.2229 -10.2229 -10.1947 -10.1947 -7.7492 -7.7492 -7.7252 -7.7252 1.4127 1.4127 1.6083 1.6083 2.3635 2.3635 2.6264 2.6264 3.0133 3.0133 3.1781 3.1781 4.1191 4.1191 4.2573 4.2573 8.3548 8.3548 8.8593 8.8593 10.1693 10.1693 10.3601 10.3601 k = 0.4419-0.2083-0.0811 ( 3443 PWs) bands (ev): -28.5510 -28.5510 -28.5445 -28.5445 -11.4410 -11.4410 -11.4135 -11.4135 -10.4070 -10.4070 -10.3725 -10.3725 -10.2230 -10.2230 -10.1955 -10.1955 -7.7463 -7.7463 -7.7267 -7.7267 1.4272 1.4272 1.5912 1.5912 2.3747 2.3747 2.6090 2.6090 3.0148 3.0148 3.1724 3.1724 4.1349 4.1349 4.2505 4.2505 8.3479 8.3479 8.8517 8.8517 10.1963 10.1963 10.4056 10.4056 k = 0.4535-0.2137-0.0832 ( 3442 PWs) bands (ev): -28.5509 -28.5509 -28.5444 -28.5444 -11.4411 -11.4411 -11.4149 -11.4149 -10.4068 -10.4068 -10.3748 -10.3748 -10.2231 -10.2231 -10.1962 -10.1962 -7.7438 -7.7438 -7.7281 -7.7281 1.4421 1.4421 1.5741 1.5741 2.3856 2.3856 2.5930 2.5930 3.0161 3.0161 3.1676 3.1676 4.1497 4.1497 4.2433 4.2433 8.3423 8.3423 8.8452 8.8452 10.2193 10.2193 10.4455 10.4455 k = 0.4651-0.2192-0.0853 ( 3447 PWs) bands (ev): -28.5507 -28.5507 -28.5443 -28.5443 -11.4411 -11.4411 -11.4160 -11.4160 -10.4067 -10.4067 -10.3766 -10.3766 -10.2232 -10.2232 -10.1967 -10.1967 -7.7417 -7.7417 -7.7294 -7.7294 1.4574 1.4574 1.5570 1.5570 2.3955 2.3955 2.5790 2.5790 3.0172 3.0172 3.1637 3.1637 4.1634 4.1634 4.2356 4.2356 8.3380 8.3380 8.8400 8.8400 10.2380 10.2380 10.4786 10.4786 k = 0.4767-0.2247-0.0875 ( 3448 PWs) bands (ev): -28.5506 -28.5506 -28.5443 -28.5443 -11.4412 -11.4412 -11.4169 -11.4169 -10.4066 -10.4066 -10.3779 -10.3779 -10.2232 -10.2232 -10.1971 -10.1971 -7.7400 -7.7400 -7.7306 -7.7306 1.4732 1.4732 1.5400 1.5400 2.4038 2.4038 2.5678 2.5678 3.0180 3.0180 3.1609 3.1609 4.1757 4.1757 4.2276 4.2276 8.3349 8.3349 8.8362 8.8362 10.2517 10.2517 10.5038 10.5038 k = 0.4884-0.2302-0.0896 ( 3449 PWs) bands (ev): -28.5506 -28.5506 -28.5443 -28.5443 -11.4412 -11.4412 -11.4174 -11.4174 -10.4065 -10.4065 -10.3787 -10.3787 -10.2232 -10.2232 -10.1974 -10.1974 -7.7387 -7.7387 -7.7315 -7.7315 1.4892 1.4892 1.5232 1.5232 2.4094 2.4094 2.5604 2.5604 3.0186 3.0186 3.1592 3.1592 4.1857 4.1857 4.2202 4.2202 8.3330 8.3330 8.8339 8.8339 10.2601 10.2601 10.5195 10.5195 k = 0.5000-0.2357-0.0918 ( 3448 PWs) bands (ev): -28.5505 -28.5505 -28.5442 -28.5442 -11.4412 -11.4412 -11.4175 -11.4175 -10.4065 -10.4065 -10.3790 -10.3790 -10.2232 -10.2232 -10.1974 -10.1974 -7.7382 -7.7382 -7.7318 -7.7318 1.5026 1.5026 1.5096 1.5096 2.4114 2.4114 2.5578 2.5578 3.0188 3.0188 3.1587 3.1587 4.1903 4.1903 4.2165 4.2165 8.3324 8.3324 8.8332 8.8332 10.2630 10.2630 10.5248 10.5248 k = 0.5000-0.2357 0.1924 ( 3444 PWs) bands (ev): -28.5490 -28.5490 -28.5458 -28.5458 -11.4457 -11.4457 -11.4171 -11.4171 -10.4366 -10.4366 -10.3423 -10.3423 -10.2276 -10.2276 -10.1883 -10.1883 -7.8739 -7.8739 -7.6000 -7.6000 1.2427 1.2427 1.5584 1.5584 2.5252 2.5252 2.8204 2.8204 3.0016 3.0016 3.3018 3.3018 3.9823 3.9823 4.1388 4.1388 7.5538 7.5538 9.8843 9.8843 10.2091 10.2091 10.7425 10.7425 k = 0.4889-0.2304 0.1882 ( 3438 PWs) bands (ev): -28.5491 -28.5491 -28.5458 -28.5458 -11.4455 -11.4455 -11.4170 -11.4170 -10.4364 -10.4364 -10.3423 -10.3423 -10.2276 -10.2276 -10.1882 -10.1882 -7.8736 -7.8736 -7.6004 -7.6004 1.2434 1.2434 1.5588 1.5588 2.5244 2.5244 2.8206 2.8206 3.0008 3.0008 3.3012 3.3012 3.9840 3.9840 4.1384 4.1384 7.5555 7.5555 9.8839 9.8839 10.2033 10.2033 10.7440 10.7440 k = 0.4778-0.2252 0.1839 ( 3444 PWs) bands (ev): -28.5491 -28.5491 -28.5458 -28.5458 -11.4451 -11.4451 -11.4169 -11.4169 -10.4357 -10.4357 -10.3424 -10.3424 -10.2277 -10.2277 -10.1879 -10.1879 -7.8725 -7.8725 -7.6018 -7.6018 1.2453 1.2453 1.5598 1.5598 2.5219 2.5219 2.8212 2.8212 2.9987 2.9987 3.2995 3.2995 3.9890 3.9890 4.1372 4.1372 7.5605 7.5605 9.8826 9.8826 10.1868 10.1868 10.7474 10.7474 k = 0.4667-0.2200 0.1796 ( 3438 PWs) bands (ev): -28.5492 -28.5492 -28.5458 -28.5458 -11.4444 -11.4444 -11.4168 -11.4168 -10.4347 -10.4347 -10.3425 -10.3425 -10.2278 -10.2278 -10.1875 -10.1875 -7.8706 -7.8706 -7.6041 -7.6041 1.2486 1.2486 1.5615 1.5615 2.5176 2.5176 2.8221 2.8221 2.9955 2.9955 3.2968 3.2968 3.9972 3.9972 4.1353 4.1353 7.5688 7.5688 9.8803 9.8803 10.1610 10.1610 10.7507 10.7507 k = 0.4556-0.2147 0.1753 ( 3439 PWs) bands (ev): -28.5494 -28.5494 -28.5458 -28.5458 -11.4435 -11.4435 -11.4165 -11.4165 -10.4332 -10.4332 -10.3428 -10.3428 -10.2280 -10.2280 -10.1870 -10.1870 -7.8681 -7.8681 -7.6072 -7.6072 1.2531 1.2531 1.5638 1.5638 2.5116 2.5116 2.8232 2.8232 2.9916 2.9916 3.2930 3.2930 4.0079 4.0079 4.1327 4.1327 7.5804 7.5804 9.8766 9.8766 10.1279 10.1279 10.7510 10.7510 k = 0.4444-0.2095 0.1711 ( 3443 PWs) bands (ev): -28.5496 -28.5496 -28.5459 -28.5459 -11.4423 -11.4423 -11.4162 -11.4162 -10.4313 -10.4313 -10.3430 -10.3430 -10.2280 -10.2280 -10.1863 -10.1863 -7.8648 -7.8648 -7.6113 -7.6113 1.2587 1.2587 1.5669 1.5669 2.5038 2.5038 2.8245 2.8245 2.9876 2.9876 3.2883 3.2883 4.0207 4.0207 4.1297 4.1297 7.5952 7.5952 9.8709 9.8709 10.0896 10.0896 10.7453 10.7453 k = 0.4333-0.2042 0.1668 ( 3441 PWs) bands (ev): -28.5498 -28.5498 -28.5459 -28.5459 -11.4410 -11.4410 -11.4157 -11.4157 -10.4291 -10.4291 -10.3434 -10.3434 -10.2281 -10.2281 -10.1855 -10.1855 -7.8609 -7.8609 -7.6162 -7.6162 1.2653 1.2653 1.5705 1.5705 2.4941 2.4941 2.8257 2.8257 2.9843 2.9843 3.2827 3.2827 4.0346 4.0346 4.1267 4.1267 7.6132 7.6132 9.8625 9.8625 10.0482 10.0482 10.7318 10.7318 k = 0.4222-0.1990 0.1625 ( 3440 PWs) bands (ev): -28.5501 -28.5501 -28.5460 -28.5460 -11.4395 -11.4395 -11.4151 -11.4151 -10.4265 -10.4265 -10.3438 -10.3438 -10.2280 -10.2280 -10.1846 -10.1846 -7.8563 -7.8563 -7.6220 -7.6220 1.2727 1.2727 1.5748 1.5748 2.4826 2.4826 2.8269 2.8269 2.9822 2.9822 3.2764 3.2764 4.0483 4.0483 4.1246 4.1246 7.6344 7.6344 9.8500 9.8500 10.0057 10.0057 10.7093 10.7093 k = 0.4111-0.1938 0.1582 ( 3440 PWs) bands (ev): -28.5504 -28.5504 -28.5460 -28.5460 -11.4379 -11.4379 -11.4143 -11.4143 -10.4236 -10.4236 -10.3443 -10.3443 -10.2277 -10.2277 -10.1836 -10.1836 -7.8511 -7.8511 -7.6286 -7.6286 1.2808 1.2808 1.5798 1.5798 2.4695 2.4695 2.8280 2.8280 2.9818 2.9818 3.2694 3.2694 4.0594 4.0594 4.1253 4.1253 7.6587 7.6587 9.8317 9.8317 9.9646 9.9646 10.6781 10.6781 k = 0.4000-0.1885 0.1539 ( 3442 PWs) bands (ev): -28.5507 -28.5507 -28.5461 -28.5461 -11.4363 -11.4363 -11.4133 -11.4133 -10.4204 -10.4204 -10.3447 -10.3447 -10.2273 -10.2273 -10.1826 -10.1826 -7.8453 -7.8453 -7.6361 -7.6361 1.2892 1.2892 1.5854 1.5854 2.4548 2.4548 2.8291 2.8291 2.9833 2.9833 3.2618 3.2618 4.0648 4.0648 4.1314 4.1314 7.6860 7.6860 9.8052 9.8052 9.9274 9.9274 10.6391 10.6391 k = 0.3889-0.1833 0.1497 ( 3443 PWs) bands (ev): -28.5511 -28.5511 -28.5462 -28.5462 -11.4347 -11.4347 -11.4120 -11.4120 -10.4169 -10.4169 -10.3452 -10.3452 -10.2266 -10.2266 -10.1815 -10.1815 -7.8390 -7.8390 -7.6443 -7.6443 1.2977 1.2977 1.5919 1.5919 2.4390 2.4390 2.8302 2.8302 2.9870 2.9870 3.2537 3.2537 4.0637 4.0637 4.1435 4.1435 7.7161 7.7161 9.7696 9.7696 9.8955 9.8955 10.5934 10.5934 k = 0.3778-0.1781 0.1454 ( 3445 PWs) bands (ev): -28.5514 -28.5514 -28.5464 -28.5464 -11.4332 -11.4332 -11.4104 -11.4104 -10.4134 -10.4134 -10.3455 -10.3455 -10.2257 -10.2257 -10.1804 -10.1804 -7.8321 -7.8321 -7.6532 -7.6532 1.3059 1.3059 1.5991 1.5991 2.4223 2.4223 2.8316 2.8316 2.9928 2.9928 3.2452 3.2452 4.0576 4.0576 4.1596 4.1596 7.7491 7.7491 9.7259 9.7259 9.8678 9.8678 10.5421 10.5421 k = 0.3667-0.1728 0.1411 ( 3444 PWs) bands (ev): -28.5518 -28.5518 -28.5465 -28.5465 -11.4320 -11.4320 -11.4084 -11.4084 -10.4098 -10.4098 -10.3456 -10.3456 -10.2246 -10.2246 -10.1792 -10.1792 -7.8247 -7.8247 -7.6629 -7.6629 1.3133 1.3133 1.6075 1.6075 2.4053 2.4053 2.8334 2.8334 3.0005 3.0005 3.2365 3.2365 4.0484 4.0484 4.1776 4.1776 7.7847 7.7847 9.6769 9.6769 9.8420 9.8420 10.4862 10.4862 k = 0.3556-0.1676 0.1368 ( 3444 PWs) bands (ev): -28.5523 -28.5523 -28.5466 -28.5466 -11.4309 -11.4309 -11.4060 -11.4060 -10.4063 -10.4063 -10.3455 -10.3455 -10.2231 -10.2231 -10.1780 -10.1780 -7.8169 -7.8169 -7.6732 -7.6732 1.3195 1.3195 1.6170 1.6170 2.3885 2.3885 2.8358 2.8358 3.0099 3.0099 3.2276 3.2276 4.0370 4.0370 4.1962 4.1962 7.8228 7.8228 9.6245 9.6245 9.8164 9.8164 10.4265 10.4265 k = 0.3444-0.1623 0.1326 ( 3444 PWs) bands (ev): -28.5527 -28.5527 -28.5468 -28.5468 -11.4301 -11.4301 -11.4032 -11.4032 -10.4031 -10.4031 -10.3448 -10.3448 -10.2214 -10.2214 -10.1768 -10.1768 -7.8088 -7.8088 -7.6842 -7.6842 1.3238 1.3238 1.6280 1.6280 2.3723 2.3723 2.8388 2.8388 3.0208 3.0208 3.2187 3.2187 4.0239 4.0239 4.2146 4.2146 7.8631 7.8631 9.5700 9.5700 9.7903 9.7903 10.3635 10.3635 k = 0.3333-0.1571 0.1283 ( 3441 PWs) bands (ev): -28.5532 -28.5532 -28.5470 -28.5470 -11.4296 -11.4296 -11.4001 -11.4001 -10.4004 -10.4004 -10.3434 -10.3434 -10.2193 -10.2193 -10.1756 -10.1756 -7.8003 -7.8003 -7.6956 -7.6956 1.3258 1.3258 1.6407 1.6407 2.3573 2.3573 2.8426 2.8426 3.0328 3.0328 3.2102 3.2102 4.0095 4.0095 4.2326 4.2326 7.9055 7.9055 9.5141 9.5141 9.7633 9.7633 10.2980 10.2980 k = 0.3222-0.1519 0.1240 ( 3444 PWs) bands (ev): -28.5537 -28.5537 -28.5471 -28.5471 -11.4293 -11.4293 -11.3966 -11.3966 -10.3984 -10.3984 -10.3411 -10.3411 -10.2170 -10.2170 -10.1743 -10.1743 -7.7917 -7.7917 -7.7076 -7.7076 1.3251 1.3251 1.6553 1.6553 2.3440 2.3440 2.8471 2.8471 3.0455 3.0455 3.2022 3.2022 3.9937 3.9937 4.2498 4.2498 7.9496 7.9496 9.4574 9.4574 9.7355 9.7355 10.2303 10.2303 k = 0.3111-0.1466 0.1197 ( 3442 PWs) bands (ev): -28.5542 -28.5542 -28.5473 -28.5473 -11.4292 -11.4292 -11.3929 -11.3929 -10.3970 -10.3970 -10.3379 -10.3379 -10.2144 -10.2144 -10.1731 -10.1731 -7.7830 -7.7830 -7.7198 -7.7198 1.3213 1.3213 1.6720 1.6720 2.3326 2.3326 2.8524 2.8524 3.0584 3.0584 3.1952 3.1952 3.9767 3.9767 4.2659 4.2659 7.9951 7.9951 9.4003 9.4003 9.7074 9.7074 10.1611 10.1611 k = 0.3000-0.1414 0.1155 ( 3440 PWs) bands (ev): -28.5547 -28.5547 -28.5475 -28.5475 -11.4292 -11.4292 -11.3890 -11.3890 -10.3965 -10.3965 -10.3337 -10.3337 -10.2116 -10.2116 -10.1718 -10.1718 -7.7747 -7.7747 -7.7319 -7.7319 1.3142 1.3142 1.6907 1.6907 2.3236 2.3236 2.8584 2.8584 3.0708 3.0708 3.1900 3.1900 3.9586 3.9586 4.2809 4.2809 8.0417 8.0417 9.3431 9.3431 9.6792 9.6792 10.0908 10.0908 k = 0.2889-0.1362 0.1112 ( 3436 PWs) bands (ev): -28.5552 -28.5552 -28.5477 -28.5477 -11.4294 -11.4294 -11.3849 -11.3849 -10.3967 -10.3967 -10.3285 -10.3285 -10.2085 -10.2085 -10.1705 -10.1705 -7.7684 -7.7684 -7.7422 -7.7422 1.3038 1.3038 1.7114 1.7114 2.3171 2.3171 2.8651 2.8651 3.0816 3.0816 3.1875 3.1875 3.9394 3.9394 4.2946 4.2946 8.0890 8.0890 9.2863 9.2863 9.6513 9.6513 10.0200 10.0200 k = 0.2778-0.1309 0.1069 ( 3439 PWs) bands (ev): -28.5557 -28.5557 -28.5479 -28.5479 -11.4298 -11.4298 -11.3807 -11.3807 -10.3975 -10.3975 -10.3225 -10.3225 -10.2052 -10.2052 -10.1692 -10.1692 -7.7700 -7.7700 -7.7448 -7.7448 1.2903 1.2903 1.7340 1.7340 2.3132 2.3132 2.8723 2.8723 3.0896 3.0896 3.1888 3.1888 3.9192 3.9192 4.3070 4.3070 8.1363 8.1363 9.2301 9.2301 9.6240 9.6240 9.9491 9.9491 k = 0.2667-0.1257 0.1026 ( 3444 PWs) bands (ev): -28.5562 -28.5562 -28.5482 -28.5482 -11.4302 -11.4302 -11.3765 -11.3765 -10.3988 -10.3988 -10.3159 -10.3159 -10.2018 -10.2018 -10.1679 -10.1679 -7.7804 -7.7804 -7.7389 -7.7389 1.2738 1.2738 1.7584 1.7584 2.3119 2.3119 2.8799 2.8799 3.0941 3.0941 3.1949 3.1949 3.8981 3.8981 4.3179 4.3179 8.1831 8.1831 9.1753 9.1753 9.5976 9.5976 9.8786 9.8786 k = 0.2556-0.1205 0.0984 ( 3445 PWs) bands (ev): -28.5567 -28.5567 -28.5484 -28.5484 -11.4308 -11.4308 -11.3721 -11.3721 -10.4005 -10.4005 -10.3087 -10.3087 -10.1982 -10.1982 -10.1666 -10.1666 -7.7936 -7.7936 -7.7303 -7.7303 1.2548 1.2548 1.7842 1.7842 2.3132 2.3132 2.8878 2.8878 3.0952 3.0952 3.2055 3.2055 3.8761 3.8761 4.3275 4.3275 8.2286 8.2286 9.1222 9.1222 9.5723 9.5723 9.8089 9.8089 k = 0.2444-0.1152 0.0941 ( 3445 PWs) bands (ev): -28.5572 -28.5572 -28.5486 -28.5486 -11.4315 -11.4315 -11.3678 -11.3678 -10.4024 -10.4024 -10.3010 -10.3010 -10.1944 -10.1944 -10.1652 -10.1652 -7.8077 -7.8077 -7.7211 -7.7211 1.2335 1.2335 1.8114 1.8114 2.3170 2.3170 2.8958 2.8958 3.0939 3.0939 3.2196 3.2196 3.8533 3.8533 4.3356 4.3356 8.2719 8.2719 9.0718 9.0718 9.5482 9.5482 9.7405 9.7405 k = 0.2333-0.1100 0.0898 ( 3441 PWs) bands (ev): -28.5578 -28.5578 -28.5488 -28.5488 -11.4322 -11.4322 -11.3635 -11.3635 -10.4045 -10.4045 -10.2931 -10.2931 -10.1906 -10.1906 -10.1639 -10.1639 -7.8222 -7.8222 -7.7117 -7.7117 1.2105 1.2105 1.8395 1.8395 2.3229 2.3229 2.9038 2.9038 3.0916 3.0916 3.2361 3.2361 3.8297 3.8297 4.3424 4.3424 8.3118 8.3118 9.0249 9.0249 9.5254 9.5254 9.6738 9.6738 k = 0.2222-0.1047 0.0855 ( 3439 PWs) bands (ev): -28.5583 -28.5583 -28.5491 -28.5491 -11.4330 -11.4330 -11.3592 -11.3592 -10.4066 -10.4066 -10.2850 -10.2850 -10.1866 -10.1866 -10.1624 -10.1624 -7.8367 -7.8367 -7.7023 -7.7023 1.1860 1.1860 1.8683 1.8683 2.3311 2.3311 2.9114 2.9114 3.0891 3.0891 3.2540 3.2540 3.8056 3.8056 4.3477 4.3477 8.3470 8.3470 8.9826 8.9826 9.5036 9.5036 9.6095 9.6095 k = 0.2111-0.0995 0.0813 ( 3444 PWs) bands (ev): -28.5588 -28.5588 -28.5493 -28.5493 -11.4339 -11.4339 -11.3550 -11.3550 -10.4089 -10.4089 -10.2767 -10.2767 -10.1826 -10.1826 -10.1610 -10.1610 -7.8514 -7.8514 -7.6929 -7.6929 1.1606 1.1606 1.8976 1.8976 2.3411 2.3411 2.9185 2.9185 3.0872 3.0872 3.2727 3.2727 3.7810 3.7810 4.3517 4.3517 8.3757 8.3757 8.9464 8.9464 9.4823 9.4823 9.5485 9.5485 k = 0.2000-0.0943 0.0770 ( 3444 PWs) bands (ev): -28.5593 -28.5593 -28.5495 -28.5495 -11.4348 -11.4348 -11.3508 -11.3508 -10.4111 -10.4111 -10.2684 -10.2684 -10.1786 -10.1786 -10.1595 -10.1595 -7.8659 -7.8659 -7.6838 -7.6838 1.1345 1.1345 1.9271 1.9271 2.3529 2.3529 2.9247 2.9247 3.0864 3.0864 3.2917 3.2917 3.7560 3.7560 4.3544 4.3544 8.3962 8.3962 8.9175 8.9175 9.4584 9.4584 9.4944 9.4944 k = 0.1889-0.0890 0.0727 ( 3439 PWs) bands (ev): -28.5597 -28.5597 -28.5497 -28.5497 -11.4358 -11.4358 -11.3468 -11.3468 -10.4133 -10.4133 -10.2602 -10.2602 -10.1747 -10.1747 -10.1579 -10.1579 -7.8803 -7.8803 -7.6749 -7.6749 1.1081 1.1081 1.9566 1.9566 2.3664 2.3664 2.9298 2.9298 3.0871 3.0871 3.3105 3.3105 3.7310 3.7310 4.3559 4.3559 8.4071 8.4071 8.8971 8.8971 9.4200 9.4200 9.4594 9.4594 k = 0.1778-0.0838 0.0684 ( 3438 PWs) bands (ev): -28.5602 -28.5602 -28.5499 -28.5499 -11.4368 -11.4368 -11.3429 -11.3429 -10.4154 -10.4154 -10.2521 -10.2521 -10.1707 -10.1707 -10.1563 -10.1563 -7.8944 -7.8944 -7.6662 -7.6662 1.0818 1.0818 1.9856 1.9856 2.3814 2.3814 2.9336 2.9336 3.0895 3.0895 3.3287 3.3287 3.7060 3.7060 4.3563 4.3563 8.4078 8.4078 8.8850 8.8850 9.3718 9.3718 9.4395 9.4395 k = 0.1667-0.0786 0.0641 ( 3436 PWs) bands (ev): -28.5607 -28.5607 -28.5502 -28.5502 -11.4378 -11.4378 -11.3392 -11.3392 -10.4175 -10.4175 -10.2443 -10.2443 -10.1669 -10.1669 -10.1545 -10.1545 -7.9082 -7.9082 -7.6578 -7.6578 1.0558 1.0558 2.0141 2.0141 2.3977 2.3977 2.9361 2.9361 3.0936 3.0936 3.3460 3.3460 3.6815 3.6815 4.3557 4.3557 8.3990 8.3990 8.8799 8.8799 9.3255 9.3255 9.4236 9.4236 k = 0.1556-0.0733 0.0599 ( 3437 PWs) bands (ev): -28.5611 -28.5611 -28.5504 -28.5504 -11.4388 -11.4388 -11.3356 -11.3356 -10.4195 -10.4195 -10.2368 -10.2368 -10.1632 -10.1632 -10.1526 -10.1526 -7.9215 -7.9215 -7.6498 -7.6498 1.0304 1.0304 2.0416 2.0416 2.4153 2.4153 2.9374 2.9374 3.0993 3.0993 3.3617 3.3617 3.6579 3.6579 4.3541 4.3541 8.3826 8.3826 8.8793 8.8793 9.2841 9.2841 9.4094 9.4094 k = 0.1444-0.0681 0.0556 ( 3444 PWs) bands (ev): -28.5615 -28.5615 -28.5506 -28.5506 -11.4399 -11.4399 -11.3322 -11.3322 -10.4214 -10.4214 -10.2297 -10.2297 -10.1596 -10.1596 -10.1505 -10.1505 -7.9344 -7.9344 -7.6422 -7.6422 1.0059 1.0059 2.0680 2.0680 2.4341 2.4341 2.9376 2.9376 3.1063 3.1063 3.3753 3.3753 3.6358 3.6358 4.3517 4.3517 8.3608 8.3608 8.8800 8.8800 9.2490 9.2490 9.3964 9.3964 k = 0.1333-0.0628 0.0513 ( 3439 PWs) bands (ev): -28.5619 -28.5619 -28.5507 -28.5507 -11.4409 -11.4409 -11.3290 -11.3290 -10.4231 -10.4231 -10.2230 -10.2230 -10.1563 -10.1563 -10.1482 -10.1482 -7.9467 -7.9467 -7.6350 -7.6350 0.9824 0.9824 2.0929 2.0929 2.4540 2.4540 2.9368 2.9368 3.1144 3.1144 3.3860 3.3860 3.6161 3.6161 4.3486 4.3486 8.3357 8.3357 8.8791 8.8791 9.2214 9.2214 9.3845 9.3845 k = 0.1222-0.0576 0.0470 ( 3439 PWs) bands (ev): -28.5622 -28.5622 -28.5509 -28.5509 -11.4418 -11.4418 -11.3260 -11.3260 -10.4247 -10.4247 -10.2169 -10.2169 -10.1533 -10.1533 -10.1457 -10.1457 -7.9584 -7.9584 -7.6283 -7.6283 0.9602 0.9602 2.1161 2.1161 2.4748 2.4748 2.9354 2.9354 3.1231 3.1231 3.3928 3.3928 3.5998 3.5998 4.3450 4.3450 8.3090 8.3090 8.8747 8.8747 9.2017 9.2017 9.3735 9.3735 k = 0.1111-0.0524 0.0428 ( 3439 PWs) bands (ev): -28.5626 -28.5626 -28.5511 -28.5511 -11.4428 -11.4428 -11.3232 -11.3232 -10.4262 -10.4262 -10.2114 -10.2114 -10.1506 -10.1506 -10.1429 -10.1429 -7.9693 -7.9693 -7.6221 -7.6221 0.9394 0.9394 2.1375 2.1375 2.4965 2.4965 2.9335 2.9335 3.1320 3.1320 3.3948 3.3948 3.5877 3.5877 4.3410 4.3410 8.2821 8.2821 8.8659 8.8659 9.1898 9.1898 9.3633 9.3633 k = 0.1000-0.0471 0.0385 ( 3436 PWs) bands (ev): -28.5629 -28.5629 -28.5512 -28.5512 -11.4436 -11.4436 -11.3207 -11.3207 -10.4276 -10.4276 -10.2065 -10.2065 -10.1482 -10.1482 -10.1401 -10.1401 -7.9794 -7.9794 -7.6163 -7.6163 0.9201 0.9201 2.1568 2.1568 2.5186 2.5186 2.9311 2.9311 3.1409 3.1409 3.3917 3.3917 3.5805 3.5805 4.3368 4.3368 8.2559 8.2559 8.8531 8.8531 9.1845 9.1845 9.3540 9.3540 k = 0.0889-0.0419 0.0342 ( 3430 PWs) bands (ev): -28.5632 -28.5632 -28.5514 -28.5514 -11.4444 -11.4444 -11.3184 -11.3184 -10.4288 -10.4288 -10.2022 -10.2022 -10.1460 -10.1460 -10.1371 -10.1371 -7.9887 -7.9887 -7.6111 -7.6111 0.9026 0.9026 2.1741 2.1741 2.5410 2.5410 2.9284 2.9284 3.1495 3.1495 3.3840 3.3840 3.5778 3.5778 4.3325 4.3325 8.2312 8.2312 8.8377 8.8377 9.1841 9.1841 9.3455 9.3455 k = 0.0778-0.0367 0.0299 ( 3428 PWs) bands (ev): -28.5634 -28.5634 -28.5515 -28.5515 -11.4452 -11.4452 -11.3163 -11.3163 -10.4299 -10.4299 -10.1985 -10.1985 -10.1440 -10.1440 -10.1343 -10.1343 -7.9971 -7.9971 -7.6065 -7.6065 0.8868 0.8868 2.1892 2.1892 2.5632 2.5632 2.9255 2.9255 3.1573 3.1573 3.3730 3.3730 3.5786 3.5786 4.3282 4.3282 8.2084 8.2084 8.8212 8.8212 9.1867 9.1867 9.3379 9.3379 k = 0.0667-0.0314 0.0257 ( 3431 PWs) bands (ev): -28.5636 -28.5636 -28.5516 -28.5516 -11.4459 -11.4459 -11.3145 -11.3145 -10.4308 -10.4308 -10.1955 -10.1955 -10.1423 -10.1423 -10.1316 -10.1316 -8.0044 -8.0044 -7.6024 -7.6024 0.8730 0.8730 2.2022 2.2022 2.5847 2.5847 2.9225 2.9225 3.1642 3.1642 3.3603 3.3603 3.5816 3.5816 4.3241 4.3241 8.1880 8.1880 8.8049 8.8049 9.1910 9.1910 9.3312 9.3312 k = 0.0556-0.0262 0.0214 ( 3432 PWs) bands (ev): -28.5638 -28.5638 -28.5517 -28.5517 -11.4464 -11.4464 -11.3130 -11.3130 -10.4316 -10.4316 -10.1929 -10.1929 -10.1407 -10.1407 -10.1292 -10.1292 -8.0107 -8.0107 -7.5990 -7.5990 0.8611 0.8611 2.2130 2.2130 2.6050 2.6050 2.9193 2.9193 3.1700 3.1700 3.3475 3.3475 3.5856 3.5856 4.3203 4.3203 8.1703 8.1703 8.7898 8.7898 9.1958 9.1958 9.3254 9.3254 k = 0.0444-0.0209 0.0171 ( 3435 PWs) bands (ev): -28.5640 -28.5640 -28.5517 -28.5517 -11.4469 -11.4469 -11.3117 -11.3117 -10.4322 -10.4322 -10.1910 -10.1910 -10.1394 -10.1394 -10.1271 -10.1271 -8.0160 -8.0160 -7.5961 -7.5961 0.8513 0.8513 2.2218 2.2218 2.6232 2.6232 2.9161 2.9161 3.1746 3.1746 3.3356 3.3356 3.5898 3.5898 4.3171 4.3171 8.1555 8.1555 8.7766 8.7766 9.2005 9.2005 9.3207 9.3207 k = 0.0333-0.0157 0.0128 ( 3438 PWs) bands (ev): -28.5641 -28.5641 -28.5518 -28.5518 -11.4473 -11.4473 -11.3108 -11.3108 -10.4327 -10.4327 -10.1895 -10.1895 -10.1384 -10.1384 -10.1254 -10.1254 -8.0201 -8.0201 -7.5939 -7.5939 0.8437 0.8437 2.2286 2.2286 2.6387 2.6387 2.9132 2.9132 3.1778 3.1778 3.3257 3.3257 3.5935 3.5935 4.3144 4.3144 8.1439 8.1439 8.7659 8.7659 9.2045 9.2045 9.3169 9.3169 k = 0.0222-0.0105 0.0086 ( 3434 PWs) bands (ev): -28.5642 -28.5642 -28.5518 -28.5518 -11.4476 -11.4476 -11.3101 -11.3101 -10.4331 -10.4331 -10.1884 -10.1884 -10.1377 -10.1377 -10.1242 -10.1242 -8.0231 -8.0231 -7.5923 -7.5923 0.8381 0.8381 2.2334 2.2334 2.6505 2.6505 2.9108 2.9108 3.1799 3.1799 3.3184 3.3184 3.5965 3.5965 4.3124 4.3124 8.1355 8.1355 8.7581 8.7581 9.2076 9.2076 9.3143 9.3143 k = 0.0111-0.0052 0.0043 ( 3435 PWs) bands (ev): -28.5642 -28.5642 -28.5519 -28.5519 -11.4477 -11.4477 -11.3096 -11.3096 -10.4333 -10.4333 -10.1878 -10.1878 -10.1372 -10.1372 -10.1234 -10.1234 -8.0249 -8.0249 -7.5913 -7.5913 0.8348 0.8348 2.2362 2.2362 2.6580 2.6580 2.9092 2.9092 3.1810 3.1810 3.3139 3.3139 3.5983 3.5983 4.3112 4.3112 8.1304 8.1304 8.7533 8.7533 9.2094 9.2094 9.3127 9.3127 k = 0.0000 0.0000 0.0000 ( 3433 PWs) bands (ev): -28.5643 -28.5643 -28.5519 -28.5519 -11.4478 -11.4478 -11.3095 -11.3095 -10.4334 -10.4334 -10.1876 -10.1876 -10.1371 -10.1371 -10.1232 -10.1232 -8.0254 -8.0254 -7.5910 -7.5910 0.8337 0.8337 2.2372 2.2372 2.6606 2.6606 2.9086 2.9086 3.1814 3.1814 3.3124 3.3124 3.5990 3.5990 4.3108 4.3108 8.1287 8.1287 8.7517 8.7517 9.2101 9.2101 9.3121 9.3121 Writing output data file SrC2.save init_run : 0.25s CPU 0.79s WALL ( 1 calls) electrons : 110.36s CPU 113.79s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.10s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 110.35s CPU 113.77s 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 : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.06s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 353 calls) cegterg : 98.52s CPU 99.99s WALL ( 388 calls) Called by sum_band: Called by *egterg: h_psi : 52.87s CPU 54.02s WALL ( 7186 calls) s_psi : 2.69s CPU 2.91s WALL ( 7186 calls) g_psi : 0.16s CPU 0.15s WALL ( 6445 calls) cdiaghg : 40.30s CPU 41.05s WALL ( 6798 calls) cegterg:over : 4.01s CPU 3.85s WALL ( 6445 calls) cegterg:upda : 3.22s CPU 3.07s WALL ( 6445 calls) cegterg:last : 1.67s CPU 1.71s WALL ( 1094 calls) cdiaghg:chol : 2.25s CPU 2.24s WALL ( 6798 calls) cdiaghg:inve : 1.24s CPU 1.36s WALL ( 6798 calls) cdiaghg:para : 2.15s CPU 2.30s WALL ( 13596 calls) Called by h_psi: h_psi:vloc : 45.38s CPU 46.51s WALL ( 7186 calls) h_psi:vnl : 7.33s CPU 7.37s WALL ( 7186 calls) add_vuspsi : 3.54s CPU 3.58s WALL ( 7186 calls) General routines calbec : 3.76s CPU 3.77s WALL ( 7186 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 42.00s CPU 43.04s WALL ( 663616 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.16s CPU 0.18s WALL ( 706 calls) Parallel routines fft_scatter : 16.48s CPU 16.92s WALL ( 663639 calls) PWSCF : 2m 3.29s CPU 2m40.61s WALL This run was terminated on: 16:27:25 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=