Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:20:35 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: ./Fe3Se4.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized 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 42 32 9 1439 968 153 Max 43 33 10 1444 992 158 Sum 1527 1173 343 51879 35315 5579 bravais-lattice index = 14 lattice parameter (alat) = 12.4608 a.u. unit-cell volume = 836.3262 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.460814 celldm(2)= 1.000000 celldm(3)= 0.941465 celldm(4)= 0.443759 celldm(5)= 0.443759 celldm(6)= 0.855813 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.855813 0.517286 0.000000 ) a(3) = ( 0.417784 0.116452 0.835615 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.654430 -0.269408 ) b(2) = ( 0.000000 1.933168 -0.269408 ) b(3) = ( 0.000000 0.000000 1.196724 ) PseudoPot. # 1 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Fe 8.00 55.84500 Fe( 1.00) Se 6.00 78.96000 Se( 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= 367 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 2) = ( 0.0178571 0.0049775 -0.0096217), wk = 0.0027248 k( 3) = ( 0.0357143 0.0099549 -0.0192435), wk = 0.0027248 k( 4) = ( 0.0535714 0.0149324 -0.0288652), wk = 0.0027248 k( 5) = ( 0.0714286 0.0199099 -0.0384869), wk = 0.0027248 k( 6) = ( 0.0892857 0.0248873 -0.0481087), wk = 0.0027248 k( 7) = ( 0.1071429 0.0298648 -0.0577304), wk = 0.0027248 k( 8) = ( 0.1250000 0.0348423 -0.0673521), wk = 0.0027248 k( 9) = ( 0.1428571 0.0398197 -0.0769739), wk = 0.0027248 k( 10) = ( 0.1607143 0.0447972 -0.0865956), wk = 0.0027248 k( 11) = ( 0.1785714 0.0497747 -0.0962173), wk = 0.0027248 k( 12) = ( 0.1964286 0.0547521 -0.1058390), wk = 0.0027248 k( 13) = ( 0.2142857 0.0597296 -0.1154608), wk = 0.0027248 k( 14) = ( 0.2321429 0.0647070 -0.1250825), wk = 0.0027248 k( 15) = ( 0.2500000 0.0696845 -0.1347042), wk = 0.0027248 k( 16) = ( 0.2678571 0.0746620 -0.1443260), wk = 0.0027248 k( 17) = ( 0.2857143 0.0796394 -0.1539477), wk = 0.0027248 k( 18) = ( 0.3035714 0.0846169 -0.1635694), wk = 0.0027248 k( 19) = ( 0.3214286 0.0895944 -0.1731912), wk = 0.0027248 k( 20) = ( 0.3392857 0.0945718 -0.1828129), wk = 0.0027248 k( 21) = ( 0.3571429 0.0995493 -0.1924346), wk = 0.0027248 k( 22) = ( 0.3750000 0.1045268 -0.2020564), wk = 0.0027248 k( 23) = ( 0.3928571 0.1095042 -0.2116781), wk = 0.0027248 k( 24) = ( 0.4107143 0.1144817 -0.2212998), wk = 0.0027248 k( 25) = ( 0.4285714 0.1194592 -0.2309216), wk = 0.0027248 k( 26) = ( 0.4464286 0.1244366 -0.2405433), wk = 0.0027248 k( 27) = ( 0.4642857 0.1294141 -0.2501650), wk = 0.0027248 k( 28) = ( 0.4821429 0.1343916 -0.2597868), wk = 0.0027248 k( 29) = ( 0.5000000 0.1393690 -0.2694085), wk = 0.0027248 k( 30) = ( 0.5000000 0.1393690 -0.2694085), wk = 0.0027248 k( 31) = ( 0.5091371 0.1419159 -0.2511333), wk = 0.0027248 k( 32) = ( 0.5182742 0.1444627 -0.2328581), wk = 0.0027248 k( 33) = ( 0.5274112 0.1470096 -0.2145829), wk = 0.0027248 k( 34) = ( 0.5365483 0.1495564 -0.1963077), wk = 0.0027248 k( 35) = ( 0.5456854 0.1521033 -0.1780325), wk = 0.0027248 k( 36) = ( 0.5548225 0.1546501 -0.1597573), wk = 0.0027248 k( 37) = ( 0.5639596 0.1571970 -0.1414821), wk = 0.0027248 k( 38) = ( 0.5730966 0.1597438 -0.1232069), wk = 0.0027248 k( 39) = ( 0.5822337 0.1622907 -0.1049317), wk = 0.0027248 k( 40) = ( 0.5913708 0.1648375 -0.0866566), wk = 0.0027248 k( 41) = ( 0.6005079 0.1673844 -0.0683814), wk = 0.0027248 k( 42) = ( 0.6096449 0.1699312 -0.0501062), wk = 0.0027248 k( 43) = ( 0.6187820 0.1724781 -0.0318310), wk = 0.0027248 k( 44) = ( 0.6279191 0.1750249 -0.0135558), wk = 0.0027248 k( 45) = ( 0.6370562 0.1775718 0.0047194), wk = 0.0027248 k( 46) = ( 0.6461933 0.1801187 0.0229946), wk = 0.0027248 k( 47) = ( 0.6553303 0.1826655 0.0412698), wk = 0.0027248 k( 48) = ( 0.6644674 0.1852124 0.0595450), wk = 0.0027248 k( 49) = ( 0.6644674 0.1852124 0.0595450), wk = 0.0027248 k( 50) = ( 0.6541882 0.1823471 0.0763830), wk = 0.0027248 k( 51) = ( 0.6439090 0.1794819 0.0932211), wk = 0.0027248 k( 52) = ( 0.6336298 0.1766167 0.1100591), wk = 0.0027248 k( 53) = ( 0.6233506 0.1737515 0.1268971), wk = 0.0027248 k( 54) = ( 0.6130714 0.1708863 0.1437351), wk = 0.0027248 k( 55) = ( 0.6027921 0.1680211 0.1605732), wk = 0.0027248 k( 56) = ( 0.5925129 0.1651559 0.1774112), wk = 0.0027248 k( 57) = ( 0.5822337 0.1622907 0.1942492), wk = 0.0027248 k( 58) = ( 0.5719545 0.1594255 0.2110873), wk = 0.0027248 k( 59) = ( 0.5616753 0.1565603 0.2279253), wk = 0.0027248 k( 60) = ( 0.5513961 0.1536951 0.2447633), wk = 0.0027248 k( 61) = ( 0.5411169 0.1508299 0.2616013), wk = 0.0027248 k( 62) = ( 0.5308376 0.1479646 0.2784394), wk = 0.0027248 k( 63) = ( 0.5205584 0.1450994 0.2952774), wk = 0.0027248 k( 64) = ( 0.5102792 0.1422342 0.3121154), wk = 0.0027248 k( 65) = ( 0.5000000 0.1393690 0.3289535), wk = 0.0027248 k( 66) = ( 0.5000000 0.1393690 0.3289535), wk = 0.0027248 k( 67) = ( 0.5055242 0.1195506 0.3289535), wk = 0.0027248 k( 68) = ( 0.5110483 0.0997321 0.3289535), wk = 0.0027248 k( 69) = ( 0.5165725 0.0799136 0.3289535), wk = 0.0027248 k( 70) = ( 0.5220966 0.0600952 0.3289535), wk = 0.0027248 k( 71) = ( 0.5276208 0.0402767 0.3289535), wk = 0.0027248 k( 72) = ( 0.5331450 0.0204582 0.3289535), wk = 0.0027248 k( 73) = ( 0.5386691 0.0006398 0.3289535), wk = 0.0027248 k( 74) = ( 0.5441933 -0.0191787 0.3289535), wk = 0.0027248 k( 75) = ( 0.5497174 -0.0389971 0.3289535), wk = 0.0027248 k( 76) = ( 0.5552416 -0.0588156 0.3289535), wk = 0.0027248 k( 77) = ( 0.5607657 -0.0786340 0.3289535), wk = 0.0027248 k( 78) = ( 0.5662899 -0.0984525 0.3289535), wk = 0.0027248 k( 79) = ( 0.5718141 -0.1182710 0.3289535), wk = 0.0027248 k( 80) = ( 0.5773382 -0.1380894 0.3289535), wk = 0.0027248 k( 81) = ( 0.5828624 -0.1579079 0.3289535), wk = 0.0027248 k( 82) = ( 0.5883865 -0.1777264 0.3289535), wk = 0.0027248 k( 83) = ( 0.5939107 -0.1975448 0.3289535), wk = 0.0027248 k( 84) = ( 0.5994349 -0.2173633 0.3289535), wk = 0.0027248 k( 85) = ( 0.6049590 -0.2371818 0.3289535), wk = 0.0027248 k( 86) = ( 0.6104832 -0.2570002 0.3289535), wk = 0.0027248 k( 87) = ( 0.6160073 -0.2768187 0.3289535), wk = 0.0027248 k( 88) = ( 0.6215315 -0.2966371 0.3289535), wk = 0.0027248 k( 89) = ( 0.6270557 -0.3164556 0.3289535), wk = 0.0027248 k( 90) = ( 0.6325798 -0.3362741 0.3289535), wk = 0.0027248 k( 91) = ( 0.6381040 -0.3560925 0.3289535), wk = 0.0027248 k( 92) = ( 0.6436281 -0.3759110 0.3289535), wk = 0.0027248 k( 93) = ( 0.6491523 -0.3957295 0.3289535), wk = 0.0027248 k( 94) = ( 0.6546765 -0.4155479 0.3289535), wk = 0.0027248 k( 95) = ( 0.6602006 -0.4353664 0.3289535), wk = 0.0027248 k( 96) = ( 0.6657248 -0.4551848 0.3289535), wk = 0.0027248 k( 97) = ( 0.6712489 -0.4750033 0.3289535), wk = 0.0027248 k( 98) = ( 0.6767731 -0.4948217 0.3289535), wk = 0.0027248 k( 99) = ( 0.6822973 -0.5146402 0.3289535), wk = 0.0027248 k( 100) = ( 0.6878214 -0.5344587 0.3289535), wk = 0.0027248 k( 101) = ( 0.6933456 -0.5542771 0.3289535), wk = 0.0027248 k( 102) = ( 0.6988697 -0.5740956 0.3289535), wk = 0.0027248 k( 103) = ( 0.7043939 -0.5939141 0.3289535), wk = 0.0027248 k( 104) = ( 0.7099181 -0.6137325 0.3289535), wk = 0.0027248 k( 105) = ( 0.7154422 -0.6335510 0.3289535), wk = 0.0027248 k( 106) = ( 0.7209664 -0.6533695 0.3289535), wk = 0.0027248 k( 107) = ( 0.7264905 -0.6731879 0.3289535), wk = 0.0027248 k( 108) = ( 0.7320147 -0.6930064 0.3289535), wk = 0.0027248 k( 109) = ( 0.7375389 -0.7128249 0.3289535), wk = 0.0027248 k( 110) = ( 0.7430630 -0.7326433 0.3289535), wk = 0.0027248 k( 111) = ( 0.7485872 -0.7524618 0.3289535), wk = 0.0027248 k( 112) = ( 0.2514128 -0.9019681 0.5983620), wk = 0.0027248 k( 113) = ( 0.2458259 -0.8819243 0.5983620), wk = 0.0027248 k( 114) = ( 0.2402389 -0.8618806 0.5983620), wk = 0.0027248 k( 115) = ( 0.2346520 -0.8418369 0.5983620), wk = 0.0027248 k( 116) = ( 0.2290650 -0.8217931 0.5983620), wk = 0.0027248 k( 117) = ( 0.2234781 -0.8017494 0.5983620), wk = 0.0027248 k( 118) = ( 0.2178911 -0.7817057 0.5983620), wk = 0.0027248 k( 119) = ( 0.2123042 -0.7616619 0.5983620), wk = 0.0027248 k( 120) = ( 0.2067172 -0.7416182 0.5983620), wk = 0.0027248 k( 121) = ( 0.2011303 -0.7215745 0.5983620), wk = 0.0027248 k( 122) = ( 0.1955433 -0.7015307 0.5983620), wk = 0.0027248 k( 123) = ( 0.1899564 -0.6814870 0.5983620), wk = 0.0027248 k( 124) = ( 0.1843694 -0.6614432 0.5983620), wk = 0.0027248 k( 125) = ( 0.1787825 -0.6413995 0.5983620), wk = 0.0027248 k( 126) = ( 0.1731955 -0.6213558 0.5983620), wk = 0.0027248 k( 127) = ( 0.1676085 -0.6013121 0.5983620), wk = 0.0027248 k( 128) = ( 0.1620216 -0.5812683 0.5983620), wk = 0.0027248 k( 129) = ( 0.1564347 -0.5612246 0.5983620), wk = 0.0027248 k( 130) = ( 0.1508477 -0.5411808 0.5983620), wk = 0.0027248 k( 131) = ( 0.1452607 -0.5211371 0.5983620), wk = 0.0027248 k( 132) = ( 0.1396738 -0.5010934 0.5983620), wk = 0.0027248 k( 133) = ( 0.1340868 -0.4810496 0.5983620), wk = 0.0027248 k( 134) = ( 0.1284999 -0.4610059 0.5983620), wk = 0.0027248 k( 135) = ( 0.1229129 -0.4409622 0.5983620), wk = 0.0027248 k( 136) = ( 0.1173260 -0.4209184 0.5983620), wk = 0.0027248 k( 137) = ( 0.1117390 -0.4008747 0.5983620), wk = 0.0027248 k( 138) = ( 0.1061521 -0.3808310 0.5983620), wk = 0.0027248 k( 139) = ( 0.1005651 -0.3607872 0.5983620), wk = 0.0027248 k( 140) = ( 0.0949782 -0.3407435 0.5983620), wk = 0.0027248 k( 141) = ( 0.0893912 -0.3206998 0.5983620), wk = 0.0027248 k( 142) = ( 0.0838043 -0.3006560 0.5983620), wk = 0.0027248 k( 143) = ( 0.0782173 -0.2806123 0.5983620), wk = 0.0027248 k( 144) = ( 0.0726304 -0.2605686 0.5983620), wk = 0.0027248 k( 145) = ( 0.0670434 -0.2405248 0.5983620), wk = 0.0027248 k( 146) = ( 0.0614565 -0.2204811 0.5983620), wk = 0.0027248 k( 147) = ( 0.0558695 -0.2004374 0.5983620), wk = 0.0027248 k( 148) = ( 0.0502826 -0.1803936 0.5983620), wk = 0.0027248 k( 149) = ( 0.0446956 -0.1603499 0.5983620), wk = 0.0027248 k( 150) = ( 0.0391087 -0.1403061 0.5983620), wk = 0.0027248 k( 151) = ( 0.0335217 -0.1202624 0.5983620), wk = 0.0027248 k( 152) = ( 0.0279348 -0.1002187 0.5983620), wk = 0.0027248 k( 153) = ( 0.0223478 -0.0801750 0.5983620), wk = 0.0027248 k( 154) = ( 0.0167609 -0.0601312 0.5983620), wk = 0.0027248 k( 155) = ( 0.0111739 -0.0400875 0.5983620), wk = 0.0027248 k( 156) = ( 0.0055870 -0.0200437 0.5983620), wk = 0.0027248 k( 157) = ( 0.0000000 0.0000000 0.5983620), wk = 0.0027248 k( 158) = ( 0.0000000 0.0000000 0.5983620), wk = 0.0027248 k( 159) = ( 0.0197372 0.0055015 0.5983620), wk = 0.0027248 k( 160) = ( 0.0394744 0.0110030 0.5983620), wk = 0.0027248 k( 161) = ( 0.0592116 0.0165045 0.5983620), wk = 0.0027248 k( 162) = ( 0.0789488 0.0220060 0.5983620), wk = 0.0027248 k( 163) = ( 0.0986860 0.0275076 0.5983620), wk = 0.0027248 k( 164) = ( 0.1184233 0.0330091 0.5983620), wk = 0.0027248 k( 165) = ( 0.1381605 0.0385106 0.5983620), wk = 0.0027248 k( 166) = ( 0.1578977 0.0440121 0.5983620), wk = 0.0027248 k( 167) = ( 0.1776349 0.0495136 0.5983619), wk = 0.0027248 k( 168) = ( 0.1973721 0.0550151 0.5983620), wk = 0.0027248 k( 169) = ( 0.2171093 0.0605166 0.5983620), wk = 0.0027248 k( 170) = ( 0.2368465 0.0660181 0.5983620), wk = 0.0027248 k( 171) = ( 0.2565837 0.0715196 0.5983620), wk = 0.0027248 k( 172) = ( 0.2763209 0.0770212 0.5983620), wk = 0.0027248 k( 173) = ( 0.2960582 0.0825227 0.5983620), wk = 0.0027248 k( 174) = ( 0.3157954 0.0880242 0.5983620), wk = 0.0027248 k( 175) = ( 0.3355326 0.0935257 0.5983620), wk = 0.0027248 k( 176) = ( 0.5000000 0.1393690 -0.2694085), wk = 0.0027248 k( 177) = ( 0.5056336 0.1191580 -0.2694085), wk = 0.0027248 k( 178) = ( 0.5112672 0.0989469 -0.2694085), wk = 0.0027248 k( 179) = ( 0.5169008 0.0787359 -0.2694085), wk = 0.0027248 k( 180) = ( 0.5225344 0.0585248 -0.2694085), wk = 0.0027248 k( 181) = ( 0.5281680 0.0383137 -0.2694085), wk = 0.0027248 k( 182) = ( 0.5338015 0.0181027 -0.2694085), wk = 0.0027248 k( 183) = ( 0.5394351 -0.0021084 -0.2694085), wk = 0.0027248 k( 184) = ( 0.5450687 -0.0223194 -0.2694085), wk = 0.0027248 k( 185) = ( 0.5507023 -0.0425305 -0.2694085), wk = 0.0027248 k( 186) = ( 0.5563359 -0.0627416 -0.2694085), wk = 0.0027248 k( 187) = ( 0.5619695 -0.0829526 -0.2694085), wk = 0.0027248 k( 188) = ( 0.5676031 -0.1031637 -0.2694085), wk = 0.0027248 k( 189) = ( 0.5732367 -0.1233748 -0.2694085), wk = 0.0027248 k( 190) = ( 0.5788703 -0.1435858 -0.2694085), wk = 0.0027248 k( 191) = ( 0.5845039 -0.1637969 -0.2694085), wk = 0.0027248 k( 192) = ( 0.5901375 -0.1840079 -0.2694085), wk = 0.0027248 k( 193) = ( 0.5957710 -0.2042190 -0.2694085), wk = 0.0027248 k( 194) = ( 0.6014046 -0.2244300 -0.2694085), wk = 0.0027248 k( 195) = ( 0.6070382 -0.2446411 -0.2694085), wk = 0.0027248 k( 196) = ( 0.6126718 -0.2648522 -0.2694085), wk = 0.0027248 k( 197) = ( 0.6183054 -0.2850632 -0.2694085), wk = 0.0027248 k( 198) = ( 0.6239390 -0.3052743 -0.2694085), wk = 0.0027248 k( 199) = ( 0.6295726 -0.3254853 -0.2694085), wk = 0.0027248 k( 200) = ( 0.6352062 -0.3456964 -0.2694085), wk = 0.0027248 k( 201) = ( 0.6408398 -0.3659075 -0.2694085), wk = 0.0027248 k( 202) = ( 0.6464734 -0.3861185 -0.2694085), wk = 0.0027248 k( 203) = ( 0.6521070 -0.4063296 -0.2694085), wk = 0.0027248 k( 204) = ( 0.6577406 -0.4265407 -0.2694085), wk = 0.0027248 k( 205) = ( 0.6633741 -0.4467517 -0.2694085), wk = 0.0027248 k( 206) = ( 0.6690077 -0.4669628 -0.2694085), wk = 0.0027248 k( 207) = ( 0.6746413 -0.4871738 -0.2694085), wk = 0.0027248 k( 208) = ( 0.6802749 -0.5073849 -0.2694085), wk = 0.0027248 k( 209) = ( 0.6859085 -0.5275959 -0.2694085), wk = 0.0027248 k( 210) = ( 0.6915421 -0.5478070 -0.2694085), wk = 0.0027248 k( 211) = ( 0.6971757 -0.5680181 -0.2694085), wk = 0.0027248 k( 212) = ( 0.7028093 -0.5882291 -0.2694085), wk = 0.0027248 k( 213) = ( 0.7084429 -0.6084402 -0.2694085), wk = 0.0027248 k( 214) = ( 0.7140765 -0.6286512 -0.2694085), wk = 0.0027248 k( 215) = ( 0.7197101 -0.6488623 -0.2694085), wk = 0.0027248 k( 216) = ( 0.7253437 -0.6690733 -0.2694085), wk = 0.0027248 k( 217) = ( 0.2746563 -0.9853565 0.0000000), wk = 0.0027248 k( 218) = ( 0.2690511 -0.9652472 0.0000000), wk = 0.0027248 k( 219) = ( 0.2634459 -0.9451378 0.0000000), wk = 0.0027248 k( 220) = ( 0.2578407 -0.9250285 0.0000000), wk = 0.0027248 k( 221) = ( 0.2522354 -0.9049192 0.0000000), wk = 0.0027248 k( 222) = ( 0.2466302 -0.8848099 0.0000000), wk = 0.0027248 k( 223) = ( 0.2410250 -0.8647006 0.0000000), wk = 0.0027248 k( 224) = ( 0.2354197 -0.8445913 0.0000000), wk = 0.0027248 k( 225) = ( 0.2298145 -0.8244819 0.0000000), wk = 0.0027248 k( 226) = ( 0.2242093 -0.8043726 0.0000000), wk = 0.0027248 k( 227) = ( 0.2186040 -0.7842633 0.0000000), wk = 0.0027248 k( 228) = ( 0.2129988 -0.7641540 0.0000000), wk = 0.0027248 k( 229) = ( 0.2073936 -0.7440447 0.0000000), wk = 0.0027248 k( 230) = ( 0.2017883 -0.7239354 0.0000000), wk = 0.0027248 k( 231) = ( 0.1961831 -0.7038260 0.0000000), wk = 0.0027248 k( 232) = ( 0.1905779 -0.6837167 0.0000000), wk = 0.0027248 k( 233) = ( 0.1849726 -0.6636074 0.0000000), wk = 0.0027248 k( 234) = ( 0.1793674 -0.6434981 0.0000000), wk = 0.0027248 k( 235) = ( 0.1737622 -0.6233888 0.0000000), wk = 0.0027248 k( 236) = ( 0.1681569 -0.6032795 0.0000000), wk = 0.0027248 k( 237) = ( 0.1625517 -0.5831701 0.0000000), wk = 0.0027248 k( 238) = ( 0.1569465 -0.5630608 0.0000000), wk = 0.0027248 k( 239) = ( 0.1513413 -0.5429515 0.0000000), wk = 0.0027248 k( 240) = ( 0.1457360 -0.5228422 0.0000000), wk = 0.0027248 k( 241) = ( 0.1401308 -0.5027329 0.0000000), wk = 0.0027248 k( 242) = ( 0.1345256 -0.4826236 0.0000000), wk = 0.0027248 k( 243) = ( 0.1289203 -0.4625143 0.0000000), wk = 0.0027248 k( 244) = ( 0.1233151 -0.4424049 0.0000000), wk = 0.0027248 k( 245) = ( 0.1177099 -0.4222956 0.0000000), wk = 0.0027248 k( 246) = ( 0.1121046 -0.4021863 0.0000000), wk = 0.0027248 k( 247) = ( 0.1064994 -0.3820770 0.0000000), wk = 0.0027248 k( 248) = ( 0.1008942 -0.3619677 0.0000000), wk = 0.0027248 k( 249) = ( 0.0952889 -0.3418584 0.0000000), wk = 0.0027248 k( 250) = ( 0.0896837 -0.3217490 0.0000000), wk = 0.0027248 k( 251) = ( 0.0840785 -0.3016397 0.0000000), wk = 0.0027248 k( 252) = ( 0.0784732 -0.2815304 0.0000000), wk = 0.0027248 k( 253) = ( 0.0728680 -0.2614211 0.0000000), wk = 0.0027248 k( 254) = ( 0.0672628 -0.2413118 0.0000000), wk = 0.0027248 k( 255) = ( 0.0616575 -0.2212025 0.0000000), wk = 0.0027248 k( 256) = ( 0.0560523 -0.2010932 0.0000000), wk = 0.0027248 k( 257) = ( 0.0504471 -0.1809838 0.0000000), wk = 0.0027248 k( 258) = ( 0.0448419 -0.1608745 0.0000000), wk = 0.0027248 k( 259) = ( 0.0392366 -0.1407652 0.0000000), wk = 0.0027248 k( 260) = ( 0.0336314 -0.1206559 0.0000000), wk = 0.0027248 k( 261) = ( 0.0280262 -0.1005466 0.0000000), wk = 0.0027248 k( 262) = ( 0.0224209 -0.0804373 0.0000000), wk = 0.0027248 k( 263) = ( 0.0168157 -0.0603279 0.0000000), wk = 0.0027248 k( 264) = ( 0.0112105 -0.0402186 0.0000000), wk = 0.0027248 k( 265) = ( 0.0056052 -0.0201093 0.0000000), wk = 0.0027248 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 267) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 268) = ( 0.0106383 -0.0176003 -0.0028660), wk = 0.0027248 k( 269) = ( 0.0212766 -0.0352006 -0.0057321), wk = 0.0027248 k( 270) = ( 0.0319149 -0.0528009 -0.0085981), wk = 0.0027248 k( 271) = ( 0.0425532 -0.0704013 -0.0114642), wk = 0.0027248 k( 272) = ( 0.0531915 -0.0880016 -0.0143302), wk = 0.0027248 k( 273) = ( 0.0638298 -0.1056019 -0.0171963), wk = 0.0027248 k( 274) = ( 0.0744681 -0.1232022 -0.0200623), wk = 0.0027248 k( 275) = ( 0.0851064 -0.1408025 -0.0229284), wk = 0.0027248 k( 276) = ( 0.0957447 -0.1584029 -0.0257944), wk = 0.0027248 k( 277) = ( 0.1063830 -0.1760032 -0.0286605), wk = 0.0027248 k( 278) = ( 0.1170213 -0.1936035 -0.0315265), wk = 0.0027248 k( 279) = ( 0.1276596 -0.2112038 -0.0343926), wk = 0.0027248 k( 280) = ( 0.1382979 -0.2288041 -0.0372586), wk = 0.0027248 k( 281) = ( 0.1489362 -0.2464044 -0.0401247), wk = 0.0027248 k( 282) = ( 0.1595745 -0.2640048 -0.0429907), wk = 0.0027248 k( 283) = ( 0.1702128 -0.2816051 -0.0458568), wk = 0.0027248 k( 284) = ( 0.1808511 -0.2992054 -0.0487228), wk = 0.0027248 k( 285) = ( 0.1914894 -0.3168057 -0.0515889), wk = 0.0027248 k( 286) = ( 0.2021277 -0.3344060 -0.0544549), wk = 0.0027248 k( 287) = ( 0.2127660 -0.3520064 -0.0573210), wk = 0.0027248 k( 288) = ( 0.2234043 -0.3696067 -0.0601870), wk = 0.0027248 k( 289) = ( 0.2340425 -0.3872070 -0.0630530), wk = 0.0027248 k( 290) = ( 0.2446809 -0.4048073 -0.0659191), wk = 0.0027248 k( 291) = ( 0.2553191 -0.4224076 -0.0687851), wk = 0.0027248 k( 292) = ( 0.2659574 -0.4400079 -0.0716512), wk = 0.0027248 k( 293) = ( 0.2765957 -0.4576082 -0.0745172), wk = 0.0027248 k( 294) = ( 0.2872340 -0.4752086 -0.0773833), wk = 0.0027248 k( 295) = ( 0.2978723 -0.4928089 -0.0802493), wk = 0.0027248 k( 296) = ( 0.3085106 -0.5104092 -0.0831154), wk = 0.0027248 k( 297) = ( 0.3191489 -0.5280095 -0.0859814), wk = 0.0027248 k( 298) = ( 0.3297872 -0.5456098 -0.0888475), wk = 0.0027248 k( 299) = ( 0.3404255 -0.5632102 -0.0917135), wk = 0.0027248 k( 300) = ( 0.3510638 -0.5808105 -0.0945796), wk = 0.0027248 k( 301) = ( 0.3617021 -0.5984108 -0.0974456), wk = 0.0027248 k( 302) = ( 0.3723404 -0.6160111 -0.1003117), wk = 0.0027248 k( 303) = ( 0.3829787 -0.6336114 -0.1031777), wk = 0.0027248 k( 304) = ( 0.3936170 -0.6512117 -0.1060438), wk = 0.0027248 k( 305) = ( 0.4042553 -0.6688121 -0.1089098), wk = 0.0027248 k( 306) = ( 0.4148936 -0.6864124 -0.1117759), wk = 0.0027248 k( 307) = ( 0.4255319 -0.7040127 -0.1146419), wk = 0.0027248 k( 308) = ( 0.4361702 -0.7216130 -0.1175080), wk = 0.0027248 k( 309) = ( 0.4468085 -0.7392133 -0.1203740), wk = 0.0027248 k( 310) = ( 0.4574468 -0.7568137 -0.1232401), wk = 0.0027248 k( 311) = ( 0.4680851 -0.7744140 -0.1261061), wk = 0.0027248 k( 312) = ( 0.4787234 -0.7920143 -0.1289721), wk = 0.0027248 k( 313) = ( 0.4893617 -0.8096146 -0.1318382), wk = 0.0027248 k( 314) = ( 0.5000000 -0.8272149 -0.1347042), wk = 0.0027248 k( 315) = ( 0.5000000 -0.8272149 0.4636577), wk = 0.0027248 k( 316) = ( 0.4903846 -0.8113069 0.4547412), wk = 0.0027248 k( 317) = ( 0.4807692 -0.7953990 0.4458247), wk = 0.0027248 k( 318) = ( 0.4711538 -0.7794910 0.4369082), wk = 0.0027248 k( 319) = ( 0.4615385 -0.7635830 0.4279917), wk = 0.0027248 k( 320) = ( 0.4519231 -0.7476750 0.4190752), wk = 0.0027248 k( 321) = ( 0.4423077 -0.7317670 0.4101587), wk = 0.0027248 k( 322) = ( 0.4326923 -0.7158591 0.4012423), wk = 0.0027248 k( 323) = ( 0.4230769 -0.6999511 0.3923258), wk = 0.0027248 k( 324) = ( 0.4134615 -0.6840431 0.3834093), wk = 0.0027248 k( 325) = ( 0.4038462 -0.6681351 0.3744928), wk = 0.0027248 k( 326) = ( 0.3942308 -0.6522272 0.3655763), wk = 0.0027248 k( 327) = ( 0.3846154 -0.6363192 0.3566598), wk = 0.0027248 k( 328) = ( 0.3750000 -0.6204112 0.3477433), wk = 0.0027248 k( 329) = ( 0.3653846 -0.6045032 0.3388268), wk = 0.0027248 k( 330) = ( 0.3557692 -0.5885952 0.3299103), wk = 0.0027248 k( 331) = ( 0.3461538 -0.5726873 0.3209938), wk = 0.0027248 k( 332) = ( 0.3365385 -0.5567793 0.3120773), wk = 0.0027248 k( 333) = ( 0.3269231 -0.5408713 0.3031608), wk = 0.0027248 k( 334) = ( 0.3173077 -0.5249633 0.2942443), wk = 0.0027248 k( 335) = ( 0.3076923 -0.5090553 0.2853278), wk = 0.0027248 k( 336) = ( 0.2980769 -0.4931474 0.2764113), wk = 0.0027248 k( 337) = ( 0.2884615 -0.4772394 0.2674948), wk = 0.0027248 k( 338) = ( 0.2788462 -0.4613314 0.2585783), wk = 0.0027248 k( 339) = ( 0.2692308 -0.4454234 0.2496618), wk = 0.0027248 k( 340) = ( 0.2596154 -0.4295154 0.2407453), wk = 0.0027248 k( 341) = ( 0.2500000 -0.4136075 0.2318289), wk = 0.0027248 k( 342) = ( 0.2403846 -0.3976995 0.2229124), wk = 0.0027248 k( 343) = ( 0.2307692 -0.3817915 0.2139959), wk = 0.0027248 k( 344) = ( 0.2211539 -0.3658835 0.2050794), wk = 0.0027248 k( 345) = ( 0.2115385 -0.3499755 0.1961629), wk = 0.0027248 k( 346) = ( 0.2019231 -0.3340676 0.1872464), wk = 0.0027248 k( 347) = ( 0.1923077 -0.3181596 0.1783299), wk = 0.0027248 k( 348) = ( 0.1826923 -0.3022516 0.1694134), wk = 0.0027248 k( 349) = ( 0.1730769 -0.2863436 0.1604969), wk = 0.0027248 k( 350) = ( 0.1634615 -0.2704356 0.1515804), wk = 0.0027248 k( 351) = ( 0.1538461 -0.2545277 0.1426639), wk = 0.0027248 k( 352) = ( 0.1442308 -0.2386197 0.1337474), wk = 0.0027248 k( 353) = ( 0.1346154 -0.2227117 0.1248309), wk = 0.0027248 k( 354) = ( 0.1250000 -0.2068037 0.1159144), wk = 0.0027248 k( 355) = ( 0.1153846 -0.1908958 0.1069979), wk = 0.0027248 k( 356) = ( 0.1057692 -0.1749878 0.0980814), wk = 0.0027248 k( 357) = ( 0.0961538 -0.1590798 0.0891649), wk = 0.0027248 k( 358) = ( 0.0865385 -0.1431718 0.0802484), wk = 0.0027248 k( 359) = ( 0.0769231 -0.1272638 0.0713320), wk = 0.0027248 k( 360) = ( 0.0673077 -0.1113559 0.0624155), wk = 0.0027248 k( 361) = ( 0.0576923 -0.0954479 0.0534990), wk = 0.0027248 k( 362) = ( 0.0480769 -0.0795399 0.0445825), wk = 0.0027248 k( 363) = ( 0.0384615 -0.0636319 0.0356660), wk = 0.0027248 k( 364) = ( 0.0288462 -0.0477239 0.0267495), wk = 0.0027248 k( 365) = ( 0.0192308 -0.0318160 0.0178330), wk = 0.0027248 k( 366) = ( 0.0096154 -0.0159080 0.0089165), wk = 0.0027248 k( 367) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 2) = ( 0.0178571 0.0178571 0.0000000), wk = 0.0027248 k( 3) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0027248 k( 4) = ( 0.0535714 0.0535714 0.0000000), wk = 0.0027248 k( 5) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0027248 k( 6) = ( 0.0892857 0.0892857 0.0000000), wk = 0.0027248 k( 7) = ( 0.1071429 0.1071429 0.0000000), wk = 0.0027248 k( 8) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0027248 k( 9) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0027248 k( 10) = ( 0.1607143 0.1607143 0.0000000), wk = 0.0027248 k( 11) = ( 0.1785714 0.1785714 0.0000000), wk = 0.0027248 k( 12) = ( 0.1964286 0.1964286 0.0000000), wk = 0.0027248 k( 13) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0027248 k( 14) = ( 0.2321429 0.2321429 0.0000000), wk = 0.0027248 k( 15) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0027248 k( 16) = ( 0.2678571 0.2678571 0.0000000), wk = 0.0027248 k( 17) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0027248 k( 18) = ( 0.3035714 0.3035714 0.0000000), wk = 0.0027248 k( 19) = ( 0.3214286 0.3214286 0.0000000), wk = 0.0027248 k( 20) = ( 0.3392857 0.3392857 0.0000000), wk = 0.0027248 k( 21) = ( 0.3571429 0.3571429 0.0000000), wk = 0.0027248 k( 22) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0027248 k( 23) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0027248 k( 24) = ( 0.4107143 0.4107143 0.0000000), wk = 0.0027248 k( 25) = ( 0.4285714 0.4285714 0.0000000), wk = 0.0027248 k( 26) = ( 0.4464286 0.4464286 0.0000000), wk = 0.0027248 k( 27) = ( 0.4642857 0.4642857 0.0000000), wk = 0.0027248 k( 28) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0027248 k( 29) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027248 k( 30) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027248 k( 31) = ( 0.5091371 0.5091371 0.0193849), wk = 0.0027248 k( 32) = ( 0.5182742 0.5182742 0.0387699), wk = 0.0027248 k( 33) = ( 0.5274112 0.5274112 0.0581548), wk = 0.0027248 k( 34) = ( 0.5365483 0.5365483 0.0775397), wk = 0.0027248 k( 35) = ( 0.5456854 0.5456854 0.0969246), wk = 0.0027248 k( 36) = ( 0.5548225 0.5548225 0.1163096), wk = 0.0027248 k( 37) = ( 0.5639596 0.5639596 0.1356945), wk = 0.0027248 k( 38) = ( 0.5730966 0.5730966 0.1550794), wk = 0.0027248 k( 39) = ( 0.5822337 0.5822337 0.1744643), wk = 0.0027248 k( 40) = ( 0.5913708 0.5913708 0.1938493), wk = 0.0027248 k( 41) = ( 0.6005079 0.6005079 0.2132342), wk = 0.0027248 k( 42) = ( 0.6096449 0.6096449 0.2326191), wk = 0.0027248 k( 43) = ( 0.6187820 0.6187820 0.2520041), wk = 0.0027248 k( 44) = ( 0.6279191 0.6279191 0.2713890), wk = 0.0027248 k( 45) = ( 0.6370562 0.6370562 0.2907739), wk = 0.0027248 k( 46) = ( 0.6461933 0.6461933 0.3101588), wk = 0.0027248 k( 47) = ( 0.6553303 0.6553304 0.3295438), wk = 0.0027248 k( 48) = ( 0.6644674 0.6644674 0.3489287), wk = 0.0027248 k( 49) = ( 0.6644674 0.6644674 0.3489287), wk = 0.0027248 k( 50) = ( 0.6541882 0.6541882 0.3583707), wk = 0.0027248 k( 51) = ( 0.6439090 0.6439090 0.3678126), wk = 0.0027248 k( 52) = ( 0.6336298 0.6336298 0.3772546), wk = 0.0027248 k( 53) = ( 0.6233506 0.6233506 0.3866965), wk = 0.0027248 k( 54) = ( 0.6130714 0.6130714 0.3961385), wk = 0.0027248 k( 55) = ( 0.6027921 0.6027921 0.4055804), wk = 0.0027248 k( 56) = ( 0.5925129 0.5925129 0.4150224), wk = 0.0027248 k( 57) = ( 0.5822337 0.5822337 0.4244643), wk = 0.0027248 k( 58) = ( 0.5719545 0.5719545 0.4339063), wk = 0.0027248 k( 59) = ( 0.5616753 0.5616753 0.4433483), wk = 0.0027248 k( 60) = ( 0.5513961 0.5513961 0.4527902), wk = 0.0027248 k( 61) = ( 0.5411169 0.5411169 0.4622322), wk = 0.0027248 k( 62) = ( 0.5308376 0.5308376 0.4716741), wk = 0.0027248 k( 63) = ( 0.5205584 0.5205584 0.4811161), wk = 0.0027248 k( 64) = ( 0.5102792 0.5102792 0.4905580), wk = 0.0027248 k( 65) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027248 k( 66) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027248 k( 67) = ( 0.5055242 0.4944758 0.5000000), wk = 0.0027248 k( 68) = ( 0.5110483 0.4889517 0.5000000), wk = 0.0027248 k( 69) = ( 0.5165725 0.4834275 0.5000000), wk = 0.0027248 k( 70) = ( 0.5220966 0.4779034 0.5000000), wk = 0.0027248 k( 71) = ( 0.5276208 0.4723792 0.5000000), wk = 0.0027248 k( 72) = ( 0.5331450 0.4668550 0.5000000), wk = 0.0027248 k( 73) = ( 0.5386691 0.4613309 0.5000000), wk = 0.0027248 k( 74) = ( 0.5441933 0.4558067 0.5000000), wk = 0.0027248 k( 75) = ( 0.5497174 0.4502826 0.5000000), wk = 0.0027248 k( 76) = ( 0.5552416 0.4447584 0.5000000), wk = 0.0027248 k( 77) = ( 0.5607657 0.4392343 0.5000000), wk = 0.0027248 k( 78) = ( 0.5662899 0.4337101 0.5000000), wk = 0.0027248 k( 79) = ( 0.5718141 0.4281859 0.5000000), wk = 0.0027248 k( 80) = ( 0.5773382 0.4226618 0.5000000), wk = 0.0027248 k( 81) = ( 0.5828624 0.4171376 0.5000000), wk = 0.0027248 k( 82) = ( 0.5883865 0.4116134 0.5000000), wk = 0.0027248 k( 83) = ( 0.5939107 0.4060893 0.5000000), wk = 0.0027248 k( 84) = ( 0.5994349 0.4005651 0.5000000), wk = 0.0027248 k( 85) = ( 0.6049590 0.3950410 0.5000000), wk = 0.0027248 k( 86) = ( 0.6104832 0.3895168 0.5000000), wk = 0.0027248 k( 87) = ( 0.6160073 0.3839927 0.5000000), wk = 0.0027248 k( 88) = ( 0.6215315 0.3784685 0.5000000), wk = 0.0027248 k( 89) = ( 0.6270557 0.3729443 0.5000000), wk = 0.0027248 k( 90) = ( 0.6325798 0.3674202 0.5000000), wk = 0.0027248 k( 91) = ( 0.6381040 0.3618960 0.5000000), wk = 0.0027248 k( 92) = ( 0.6436281 0.3563719 0.5000000), wk = 0.0027248 k( 93) = ( 0.6491523 0.3508477 0.5000000), wk = 0.0027248 k( 94) = ( 0.6546765 0.3453235 0.5000000), wk = 0.0027248 k( 95) = ( 0.6602006 0.3397994 0.5000000), wk = 0.0027248 k( 96) = ( 0.6657248 0.3342752 0.5000000), wk = 0.0027248 k( 97) = ( 0.6712489 0.3287511 0.5000000), wk = 0.0027248 k( 98) = ( 0.6767731 0.3232269 0.5000000), wk = 0.0027248 k( 99) = ( 0.6822973 0.3177027 0.5000000), wk = 0.0027248 k( 100) = ( 0.6878214 0.3121786 0.5000000), wk = 0.0027248 k( 101) = ( 0.6933456 0.3066544 0.5000000), wk = 0.0027248 k( 102) = ( 0.6988697 0.3011303 0.5000000), wk = 0.0027248 k( 103) = ( 0.7043939 0.2956061 0.5000000), wk = 0.0027248 k( 104) = ( 0.7099181 0.2900819 0.5000000), wk = 0.0027248 k( 105) = ( 0.7154422 0.2845578 0.5000000), wk = 0.0027248 k( 106) = ( 0.7209664 0.2790336 0.5000000), wk = 0.0027248 k( 107) = ( 0.7264905 0.2735095 0.5000000), wk = 0.0027248 k( 108) = ( 0.7320147 0.2679853 0.5000000), wk = 0.0027248 k( 109) = ( 0.7375389 0.2624611 0.5000000), wk = 0.0027248 k( 110) = ( 0.7430630 0.2569370 0.5000000), wk = 0.0027248 k( 111) = ( 0.7485872 0.2514128 0.5000000), wk = 0.0027248 k( 112) = ( 0.2514128 -0.2514128 0.5000000), wk = 0.0027248 k( 113) = ( 0.2458259 -0.2458259 0.5000000), wk = 0.0027248 k( 114) = ( 0.2402389 -0.2402389 0.5000000), wk = 0.0027248 k( 115) = ( 0.2346520 -0.2346520 0.5000000), wk = 0.0027248 k( 116) = ( 0.2290650 -0.2290650 0.5000000), wk = 0.0027248 k( 117) = ( 0.2234781 -0.2234781 0.5000000), wk = 0.0027248 k( 118) = ( 0.2178911 -0.2178911 0.5000000), wk = 0.0027248 k( 119) = ( 0.2123042 -0.2123042 0.5000000), wk = 0.0027248 k( 120) = ( 0.2067172 -0.2067172 0.5000000), wk = 0.0027248 k( 121) = ( 0.2011303 -0.2011303 0.5000000), wk = 0.0027248 k( 122) = ( 0.1955433 -0.1955433 0.5000000), wk = 0.0027248 k( 123) = ( 0.1899564 -0.1899564 0.5000000), wk = 0.0027248 k( 124) = ( 0.1843694 -0.1843694 0.5000000), wk = 0.0027248 k( 125) = ( 0.1787825 -0.1787824 0.5000000), wk = 0.0027248 k( 126) = ( 0.1731955 -0.1731955 0.5000000), wk = 0.0027248 k( 127) = ( 0.1676085 -0.1676085 0.5000000), wk = 0.0027248 k( 128) = ( 0.1620216 -0.1620216 0.5000000), wk = 0.0027248 k( 129) = ( 0.1564347 -0.1564346 0.5000000), wk = 0.0027248 k( 130) = ( 0.1508477 -0.1508477 0.5000000), wk = 0.0027248 k( 131) = ( 0.1452607 -0.1452607 0.5000000), wk = 0.0027248 k( 132) = ( 0.1396738 -0.1396738 0.5000000), wk = 0.0027248 k( 133) = ( 0.1340868 -0.1340868 0.5000000), wk = 0.0027248 k( 134) = ( 0.1284999 -0.1284999 0.5000000), wk = 0.0027248 k( 135) = ( 0.1229129 -0.1229129 0.5000000), wk = 0.0027248 k( 136) = ( 0.1173260 -0.1173260 0.5000000), wk = 0.0027248 k( 137) = ( 0.1117390 -0.1117390 0.5000000), wk = 0.0027248 k( 138) = ( 0.1061521 -0.1061521 0.5000000), wk = 0.0027248 k( 139) = ( 0.1005651 -0.1005651 0.5000000), wk = 0.0027248 k( 140) = ( 0.0949782 -0.0949782 0.5000000), wk = 0.0027248 k( 141) = ( 0.0893912 -0.0893912 0.5000000), wk = 0.0027248 k( 142) = ( 0.0838043 -0.0838043 0.5000000), wk = 0.0027248 k( 143) = ( 0.0782173 -0.0782173 0.5000000), wk = 0.0027248 k( 144) = ( 0.0726304 -0.0726304 0.5000000), wk = 0.0027248 k( 145) = ( 0.0670434 -0.0670434 0.5000000), wk = 0.0027248 k( 146) = ( 0.0614565 -0.0614565 0.5000000), wk = 0.0027248 k( 147) = ( 0.0558695 -0.0558695 0.5000000), wk = 0.0027248 k( 148) = ( 0.0502826 -0.0502826 0.5000000), wk = 0.0027248 k( 149) = ( 0.0446956 -0.0446956 0.5000000), wk = 0.0027248 k( 150) = ( 0.0391087 -0.0391087 0.5000000), wk = 0.0027248 k( 151) = ( 0.0335217 -0.0335217 0.5000000), wk = 0.0027248 k( 152) = ( 0.0279348 -0.0279348 0.5000000), wk = 0.0027248 k( 153) = ( 0.0223478 -0.0223478 0.5000000), wk = 0.0027248 k( 154) = ( 0.0167609 -0.0167609 0.5000000), wk = 0.0027248 k( 155) = ( 0.0111739 -0.0111739 0.5000000), wk = 0.0027248 k( 156) = ( 0.0055870 -0.0055869 0.5000000), wk = 0.0027248 k( 157) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027248 k( 158) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027248 k( 159) = ( 0.0197372 0.0197372 0.5088866), wk = 0.0027248 k( 160) = ( 0.0394744 0.0394744 0.5177731), wk = 0.0027248 k( 161) = ( 0.0592116 0.0592116 0.5266596), wk = 0.0027248 k( 162) = ( 0.0789488 0.0789488 0.5355462), wk = 0.0027248 k( 163) = ( 0.0986860 0.0986860 0.5444327), wk = 0.0027248 k( 164) = ( 0.1184233 0.1184233 0.5533193), wk = 0.0027248 k( 165) = ( 0.1381605 0.1381605 0.5622058), wk = 0.0027248 k( 166) = ( 0.1578977 0.1578977 0.5710924), wk = 0.0027248 k( 167) = ( 0.1776349 0.1776349 0.5799789), wk = 0.0027248 k( 168) = ( 0.1973721 0.1973721 0.5888655), wk = 0.0027248 k( 169) = ( 0.2171093 0.2171093 0.5977520), wk = 0.0027248 k( 170) = ( 0.2368465 0.2368465 0.6066386), wk = 0.0027248 k( 171) = ( 0.2565837 0.2565837 0.6155251), wk = 0.0027248 k( 172) = ( 0.2763209 0.2763209 0.6244117), wk = 0.0027248 k( 173) = ( 0.2960582 0.2960582 0.6332982), wk = 0.0027248 k( 174) = ( 0.3157954 0.3157954 0.6421848), wk = 0.0027248 k( 175) = ( 0.3355326 0.3355326 0.6510713), wk = 0.0027248 k( 176) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0027248 k( 177) = ( 0.5056336 0.4943664 0.0000000), wk = 0.0027248 k( 178) = ( 0.5112672 0.4887328 -0.0000000), wk = 0.0027248 k( 179) = ( 0.5169008 0.4830992 -0.0000000), wk = 0.0027248 k( 180) = ( 0.5225344 0.4774656 -0.0000000), wk = 0.0027248 k( 181) = ( 0.5281680 0.4718320 -0.0000000), wk = 0.0027248 k( 182) = ( 0.5338015 0.4661984 0.0000000), wk = 0.0027248 k( 183) = ( 0.5394351 0.4605649 -0.0000000), wk = 0.0027248 k( 184) = ( 0.5450687 0.4549313 -0.0000000), wk = 0.0027248 k( 185) = ( 0.5507023 0.4492977 0.0000000), wk = 0.0027248 k( 186) = ( 0.5563359 0.4436641 -0.0000000), wk = 0.0027248 k( 187) = ( 0.5619695 0.4380305 -0.0000000), wk = 0.0027248 k( 188) = ( 0.5676031 0.4323969 0.0000000), wk = 0.0027248 k( 189) = ( 0.5732367 0.4267633 0.0000000), wk = 0.0027248 k( 190) = ( 0.5788703 0.4211297 0.0000000), wk = 0.0027248 k( 191) = ( 0.5845039 0.4154961 -0.0000000), wk = 0.0027248 k( 192) = ( 0.5901375 0.4098625 0.0000000), wk = 0.0027248 k( 193) = ( 0.5957710 0.4042290 0.0000000), wk = 0.0027248 k( 194) = ( 0.6014046 0.3985954 -0.0000000), wk = 0.0027248 k( 195) = ( 0.6070382 0.3929618 0.0000000), wk = 0.0027248 k( 196) = ( 0.6126718 0.3873282 -0.0000000), wk = 0.0027248 k( 197) = ( 0.6183054 0.3816946 0.0000000), wk = 0.0027248 k( 198) = ( 0.6239390 0.3760610 0.0000000), wk = 0.0027248 k( 199) = ( 0.6295726 0.3704274 -0.0000000), wk = 0.0027248 k( 200) = ( 0.6352062 0.3647938 0.0000000), wk = 0.0027248 k( 201) = ( 0.6408398 0.3591602 0.0000000), wk = 0.0027248 k( 202) = ( 0.6464734 0.3535266 0.0000000), wk = 0.0027248 k( 203) = ( 0.6521070 0.3478930 0.0000000), wk = 0.0027248 k( 204) = ( 0.6577406 0.3422594 -0.0000000), wk = 0.0027248 k( 205) = ( 0.6633741 0.3366259 0.0000000), wk = 0.0027248 k( 206) = ( 0.6690077 0.3309923 0.0000000), wk = 0.0027248 k( 207) = ( 0.6746413 0.3253587 0.0000000), wk = 0.0027248 k( 208) = ( 0.6802749 0.3197251 0.0000000), wk = 0.0027248 k( 209) = ( 0.6859085 0.3140915 0.0000000), wk = 0.0027248 k( 210) = ( 0.6915421 0.3084579 0.0000000), wk = 0.0027248 k( 211) = ( 0.6971757 0.3028243 0.0000000), wk = 0.0027248 k( 212) = ( 0.7028093 0.2971907 -0.0000000), wk = 0.0027248 k( 213) = ( 0.7084429 0.2915571 0.0000000), wk = 0.0027248 k( 214) = ( 0.7140765 0.2859235 0.0000000), wk = 0.0027248 k( 215) = ( 0.7197101 0.2802899 -0.0000000), wk = 0.0027248 k( 216) = ( 0.7253437 0.2746564 0.0000000), wk = 0.0027248 k( 217) = ( 0.2746563 -0.2746563 0.0000000), wk = 0.0027248 k( 218) = ( 0.2690511 -0.2690511 0.0000000), wk = 0.0027248 k( 219) = ( 0.2634459 -0.2634459 0.0000000), wk = 0.0027248 k( 220) = ( 0.2578407 -0.2578406 0.0000000), wk = 0.0027248 k( 221) = ( 0.2522354 -0.2522354 0.0000000), wk = 0.0027248 k( 222) = ( 0.2466302 -0.2466302 0.0000000), wk = 0.0027248 k( 223) = ( 0.2410250 -0.2410250 0.0000000), wk = 0.0027248 k( 224) = ( 0.2354197 -0.2354197 0.0000000), wk = 0.0027248 k( 225) = ( 0.2298145 -0.2298145 0.0000000), wk = 0.0027248 k( 226) = ( 0.2242093 -0.2242093 0.0000000), wk = 0.0027248 k( 227) = ( 0.2186040 -0.2186040 0.0000000), wk = 0.0027248 k( 228) = ( 0.2129988 -0.2129988 0.0000000), wk = 0.0027248 k( 229) = ( 0.2073936 -0.2073936 0.0000000), wk = 0.0027248 k( 230) = ( 0.2017883 -0.2017883 -0.0000000), wk = 0.0027248 k( 231) = ( 0.1961831 -0.1961831 0.0000000), wk = 0.0027248 k( 232) = ( 0.1905779 -0.1905779 0.0000000), wk = 0.0027248 k( 233) = ( 0.1849726 -0.1849726 0.0000000), wk = 0.0027248 k( 234) = ( 0.1793674 -0.1793674 0.0000000), wk = 0.0027248 k( 235) = ( 0.1737622 -0.1737622 0.0000000), wk = 0.0027248 k( 236) = ( 0.1681569 -0.1681569 0.0000000), wk = 0.0027248 k( 237) = ( 0.1625517 -0.1625517 0.0000000), wk = 0.0027248 k( 238) = ( 0.1569465 -0.1569465 0.0000000), wk = 0.0027248 k( 239) = ( 0.1513413 -0.1513413 -0.0000000), wk = 0.0027248 k( 240) = ( 0.1457360 -0.1457360 0.0000000), wk = 0.0027248 k( 241) = ( 0.1401308 -0.1401308 0.0000000), wk = 0.0027248 k( 242) = ( 0.1345256 -0.1345256 0.0000000), wk = 0.0027248 k( 243) = ( 0.1289203 -0.1289203 0.0000000), wk = 0.0027248 k( 244) = ( 0.1233151 -0.1233151 0.0000000), wk = 0.0027248 k( 245) = ( 0.1177099 -0.1177099 0.0000000), wk = 0.0027248 k( 246) = ( 0.1121046 -0.1121046 0.0000000), wk = 0.0027248 k( 247) = ( 0.1064994 -0.1064994 0.0000000), wk = 0.0027248 k( 248) = ( 0.1008942 -0.1008942 -0.0000000), wk = 0.0027248 k( 249) = ( 0.0952889 -0.0952889 0.0000000), wk = 0.0027248 k( 250) = ( 0.0896837 -0.0896837 0.0000000), wk = 0.0027248 k( 251) = ( 0.0840785 -0.0840785 0.0000000), wk = 0.0027248 k( 252) = ( 0.0784732 -0.0784732 0.0000000), wk = 0.0027248 k( 253) = ( 0.0728680 -0.0728680 0.0000000), wk = 0.0027248 k( 254) = ( 0.0672628 -0.0672628 0.0000000), wk = 0.0027248 k( 255) = ( 0.0616575 -0.0616575 0.0000000), wk = 0.0027248 k( 256) = ( 0.0560523 -0.0560523 0.0000000), wk = 0.0027248 k( 257) = ( 0.0504471 -0.0504471 -0.0000000), wk = 0.0027248 k( 258) = ( 0.0448419 -0.0448419 0.0000000), wk = 0.0027248 k( 259) = ( 0.0392366 -0.0392366 0.0000000), wk = 0.0027248 k( 260) = ( 0.0336314 -0.0336314 0.0000000), wk = 0.0027248 k( 261) = ( 0.0280262 -0.0280262 0.0000000), wk = 0.0027248 k( 262) = ( 0.0224209 -0.0224209 0.0000000), wk = 0.0027248 k( 263) = ( 0.0168157 -0.0168157 0.0000000), wk = 0.0027248 k( 264) = ( 0.0112105 -0.0112105 0.0000000), wk = 0.0027248 k( 265) = ( 0.0056052 -0.0056052 0.0000000), wk = 0.0027248 k( 266) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 267) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 k( 268) = ( 0.0106383 0.0000000 0.0000000), wk = 0.0027248 k( 269) = ( 0.0212766 0.0000000 0.0000000), wk = 0.0027248 k( 270) = ( 0.0319149 0.0000000 0.0000000), wk = 0.0027248 k( 271) = ( 0.0425532 0.0000000 0.0000000), wk = 0.0027248 k( 272) = ( 0.0531915 0.0000000 0.0000000), wk = 0.0027248 k( 273) = ( 0.0638298 0.0000000 0.0000000), wk = 0.0027248 k( 274) = ( 0.0744681 0.0000000 0.0000000), wk = 0.0027248 k( 275) = ( 0.0851064 0.0000000 0.0000000), wk = 0.0027248 k( 276) = ( 0.0957447 0.0000000 0.0000000), wk = 0.0027248 k( 277) = ( 0.1063830 0.0000000 0.0000000), wk = 0.0027248 k( 278) = ( 0.1170213 0.0000000 0.0000000), wk = 0.0027248 k( 279) = ( 0.1276596 -0.0000000 -0.0000000), wk = 0.0027248 k( 280) = ( 0.1382979 0.0000000 0.0000000), wk = 0.0027248 k( 281) = ( 0.1489362 0.0000000 0.0000000), wk = 0.0027248 k( 282) = ( 0.1595745 -0.0000000 0.0000000), wk = 0.0027248 k( 283) = ( 0.1702128 0.0000000 -0.0000000), wk = 0.0027248 k( 284) = ( 0.1808511 0.0000000 0.0000000), wk = 0.0027248 k( 285) = ( 0.1914894 0.0000000 0.0000000), wk = 0.0027248 k( 286) = ( 0.2021277 0.0000000 0.0000000), wk = 0.0027248 k( 287) = ( 0.2127660 0.0000000 0.0000000), wk = 0.0027248 k( 288) = ( 0.2234043 0.0000000 0.0000000), wk = 0.0027248 k( 289) = ( 0.2340425 0.0000000 0.0000000), wk = 0.0027248 k( 290) = ( 0.2446809 0.0000000 0.0000000), wk = 0.0027248 k( 291) = ( 0.2553191 0.0000000 0.0000000), wk = 0.0027248 k( 292) = ( 0.2659574 0.0000000 0.0000000), wk = 0.0027248 k( 293) = ( 0.2765957 0.0000000 0.0000000), wk = 0.0027248 k( 294) = ( 0.2872340 0.0000000 0.0000000), wk = 0.0027248 k( 295) = ( 0.2978723 0.0000000 0.0000000), wk = 0.0027248 k( 296) = ( 0.3085106 0.0000000 0.0000000), wk = 0.0027248 k( 297) = ( 0.3191489 -0.0000000 0.0000000), wk = 0.0027248 k( 298) = ( 0.3297872 0.0000000 0.0000000), wk = 0.0027248 k( 299) = ( 0.3404255 0.0000000 0.0000000), wk = 0.0027248 k( 300) = ( 0.3510638 -0.0000000 0.0000000), wk = 0.0027248 k( 301) = ( 0.3617021 0.0000000 0.0000000), wk = 0.0027248 k( 302) = ( 0.3723404 0.0000000 0.0000000), wk = 0.0027248 k( 303) = ( 0.3829787 0.0000000 0.0000000), wk = 0.0027248 k( 304) = ( 0.3936170 -0.0000000 0.0000000), wk = 0.0027248 k( 305) = ( 0.4042553 0.0000000 0.0000000), wk = 0.0027248 k( 306) = ( 0.4148936 0.0000000 0.0000000), wk = 0.0027248 k( 307) = ( 0.4255319 0.0000000 0.0000000), wk = 0.0027248 k( 308) = ( 0.4361702 0.0000000 0.0000000), wk = 0.0027248 k( 309) = ( 0.4468085 -0.0000000 0.0000000), wk = 0.0027248 k( 310) = ( 0.4574468 0.0000000 0.0000000), wk = 0.0027248 k( 311) = ( 0.4680851 0.0000000 0.0000000), wk = 0.0027248 k( 312) = ( 0.4787234 0.0000000 0.0000000), wk = 0.0027248 k( 313) = ( 0.4893617 0.0000000 0.0000000), wk = 0.0027248 k( 314) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027248 k( 315) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027248 k( 316) = ( 0.4903846 0.0000000 0.4903846), wk = 0.0027248 k( 317) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0027248 k( 318) = ( 0.4711538 0.0000000 0.4711538), wk = 0.0027248 k( 319) = ( 0.4615385 0.0000000 0.4615385), wk = 0.0027248 k( 320) = ( 0.4519231 0.0000000 0.4519231), wk = 0.0027248 k( 321) = ( 0.4423077 0.0000000 0.4423077), wk = 0.0027248 k( 322) = ( 0.4326923 0.0000000 0.4326923), wk = 0.0027248 k( 323) = ( 0.4230769 0.0000000 0.4230769), wk = 0.0027248 k( 324) = ( 0.4134615 0.0000000 0.4134615), wk = 0.0027248 k( 325) = ( 0.4038462 -0.0000000 0.4038461), wk = 0.0027248 k( 326) = ( 0.3942308 0.0000000 0.3942308), wk = 0.0027248 k( 327) = ( 0.3846154 0.0000000 0.3846154), wk = 0.0027248 k( 328) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0027248 k( 329) = ( 0.3653846 0.0000000 0.3653846), wk = 0.0027248 k( 330) = ( 0.3557692 0.0000000 0.3557692), wk = 0.0027248 k( 331) = ( 0.3461538 0.0000000 0.3461538), wk = 0.0027248 k( 332) = ( 0.3365385 -0.0000000 0.3365385), wk = 0.0027248 k( 333) = ( 0.3269231 -0.0000000 0.3269231), wk = 0.0027248 k( 334) = ( 0.3173077 0.0000000 0.3173077), wk = 0.0027248 k( 335) = ( 0.3076923 0.0000000 0.3076923), wk = 0.0027248 k( 336) = ( 0.2980769 0.0000000 0.2980769), wk = 0.0027248 k( 337) = ( 0.2884615 0.0000000 0.2884615), wk = 0.0027248 k( 338) = ( 0.2788462 0.0000000 0.2788462), wk = 0.0027248 k( 339) = ( 0.2692308 0.0000000 0.2692308), wk = 0.0027248 k( 340) = ( 0.2596154 0.0000000 0.2596154), wk = 0.0027248 k( 341) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0027248 k( 342) = ( 0.2403846 0.0000000 0.2403846), wk = 0.0027248 k( 343) = ( 0.2307692 0.0000000 0.2307692), wk = 0.0027248 k( 344) = ( 0.2211539 0.0000000 0.2211539), wk = 0.0027248 k( 345) = ( 0.2115385 0.0000000 0.2115385), wk = 0.0027248 k( 346) = ( 0.2019231 0.0000000 0.2019231), wk = 0.0027248 k( 347) = ( 0.1923077 0.0000000 0.1923077), wk = 0.0027248 k( 348) = ( 0.1826923 0.0000000 0.1826923), wk = 0.0027248 k( 349) = ( 0.1730769 0.0000000 0.1730769), wk = 0.0027248 k( 350) = ( 0.1634615 -0.0000000 0.1634615), wk = 0.0027248 k( 351) = ( 0.1538461 0.0000000 0.1538461), wk = 0.0027248 k( 352) = ( 0.1442308 0.0000000 0.1442308), wk = 0.0027248 k( 353) = ( 0.1346154 0.0000000 0.1346154), wk = 0.0027248 k( 354) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0027248 k( 355) = ( 0.1153846 0.0000000 0.1153846), wk = 0.0027248 k( 356) = ( 0.1057692 0.0000000 0.1057692), wk = 0.0027248 k( 357) = ( 0.0961538 0.0000000 0.0961538), wk = 0.0027248 k( 358) = ( 0.0865385 0.0000000 0.0865385), wk = 0.0027248 k( 359) = ( 0.0769231 0.0000000 0.0769231), wk = 0.0027248 k( 360) = ( 0.0673077 0.0000000 0.0673077), wk = 0.0027248 k( 361) = ( 0.0576923 0.0000000 0.0576923), wk = 0.0027248 k( 362) = ( 0.0480769 0.0000000 0.0480769), wk = 0.0027248 k( 363) = ( 0.0384615 0.0000000 0.0384615), wk = 0.0027248 k( 364) = ( 0.0288462 0.0000000 0.0288462), wk = 0.0027248 k( 365) = ( 0.0192308 0.0000000 0.0192308), wk = 0.0027248 k( 366) = ( 0.0096154 -0.0000000 0.0096154), wk = 0.0027248 k( 367) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027248 Dense grid: 51879 G-vectors FFT dimensions: ( 64, 64, 60) Smooth grid: 35315 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.23 Mb ( 256, 58) NL pseudopotentials 0.31 Mb ( 128, 158) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1444) G-vector shells 0.01 Mb ( 1394) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.91 Mb ( 256, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.28 Mb ( 158, 2, 58) The potential is recalculated from file : ./Fe3Se4.save/charge-density.dat Starting wfc are 86 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.5 secs Computing kpt #: 2 total cpu time spent up to now is 3.2 secs Computing kpt #: 3 total cpu time spent up to now is 3.8 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 5.0 secs Computing kpt #: 6 total cpu time spent up to now is 5.6 secs Computing kpt #: 7 total cpu time spent up to now is 6.2 secs Computing kpt #: 8 total cpu time spent up to now is 6.9 secs Computing kpt #: 9 total cpu time spent up to now is 7.5 secs Computing kpt #: 10 total cpu time spent up to now is 8.1 secs Computing kpt #: 11 total cpu time spent up to now is 8.8 secs Computing kpt #: 12 total cpu time spent up to now is 9.4 secs Computing kpt #: 13 total cpu time spent up to now is 10.1 secs Computing kpt #: 14 total cpu time spent up to now is 10.7 secs Computing kpt #: 15 total cpu time spent up to now is 11.4 secs Computing kpt #: 16 total cpu time spent up to now is 12.1 secs Computing kpt #: 17 total cpu time spent up to now is 12.7 secs Computing kpt #: 18 total cpu time spent up to now is 13.4 secs Computing kpt #: 19 total cpu time spent up to now is 14.1 secs Computing kpt #: 20 total cpu time spent up to now is 14.7 secs Computing kpt #: 21 total cpu time spent up to now is 15.4 secs Computing kpt #: 22 total cpu time spent up to now is 16.1 secs Computing kpt #: 23 total cpu time spent up to now is 16.7 secs Computing kpt #: 24 total cpu time spent up to now is 17.4 secs Computing kpt #: 25 total cpu time spent up to now is 18.1 secs Computing kpt #: 26 total cpu time spent up to now is 18.8 secs Computing kpt #: 27 total cpu time spent up to now is 19.5 secs Computing kpt #: 28 total cpu time spent up to now is 20.2 secs Computing kpt #: 29 total cpu time spent up to now is 20.8 secs Computing kpt #: 30 total cpu time spent up to now is 21.5 secs Computing kpt #: 31 total cpu time spent up to now is 22.1 secs Computing kpt #: 32 total cpu time spent up to now is 22.8 secs Computing kpt #: 33 total cpu time spent up to now is 23.5 secs Computing kpt #: 34 total cpu time spent up to now is 24.1 secs Computing kpt #: 35 total cpu time spent up to now is 24.8 secs Computing kpt #: 36 total cpu time spent up to now is 25.5 secs Computing kpt #: 37 total cpu time spent up to now is 26.2 secs Computing kpt #: 38 total cpu time spent up to now is 26.9 secs Computing kpt #: 39 total cpu time spent up to now is 27.6 secs Computing kpt #: 40 total cpu time spent up to now is 28.3 secs Computing kpt #: 41 total cpu time spent up to now is 29.0 secs Computing kpt #: 42 total cpu time spent up to now is 29.7 secs Computing kpt #: 43 total cpu time spent up to now is 30.3 secs Computing kpt #: 44 total cpu time spent up to now is 31.0 secs Computing kpt #: 45 total cpu time spent up to now is 31.7 secs Computing kpt #: 46 total cpu time spent up to now is 32.4 secs Computing kpt #: 47 total cpu time spent up to now is 33.1 secs Computing kpt #: 48 total cpu time spent up to now is 33.7 secs Computing kpt #: 49 total cpu time spent up to now is 34.4 secs Computing kpt #: 50 total cpu time spent up to now is 35.0 secs Computing kpt #: 51 total cpu time spent up to now is 35.7 secs Computing kpt #: 52 total cpu time spent up to now is 36.3 secs Computing kpt #: 53 total cpu time spent up to now is 37.0 secs Computing kpt #: 54 total cpu time spent up to now is 37.6 secs Computing kpt #: 55 total cpu time spent up to now is 38.2 secs Computing kpt #: 56 total cpu time spent up to now is 38.9 secs Computing kpt #: 57 total cpu time spent up to now is 39.5 secs Computing kpt #: 58 total cpu time spent up to now is 40.1 secs Computing kpt #: 59 total cpu time spent up to now is 40.8 secs Computing kpt #: 60 total cpu time spent up to now is 41.4 secs Computing kpt #: 61 total cpu time spent up to now is 42.0 secs Computing kpt #: 62 total cpu time spent up to now is 42.7 secs Computing kpt #: 63 total cpu time spent up to now is 43.3 secs Computing kpt #: 64 total cpu time spent up to now is 43.9 secs Computing kpt #: 65 total cpu time spent up to now is 44.6 secs Computing kpt #: 66 total cpu time spent up to now is 45.2 secs Computing kpt #: 67 total cpu time spent up to now is 45.8 secs Computing kpt #: 68 total cpu time spent up to now is 46.4 secs Computing kpt #: 69 total cpu time spent up to now is 47.0 secs Computing kpt #: 70 total cpu time spent up to now is 47.7 secs Computing kpt #: 71 total cpu time spent up to now is 48.3 secs Computing kpt #: 72 total cpu time spent up to now is 48.9 secs Computing kpt #: 73 total cpu time spent up to now is 49.5 secs Computing kpt #: 74 total cpu time spent up to now is 50.1 secs Computing kpt #: 75 total cpu time spent up to now is 50.7 secs Computing kpt #: 76 total cpu time spent up to now is 51.4 secs Computing kpt #: 77 total cpu time spent up to now is 52.0 secs Computing kpt #: 78 total cpu time spent up to now is 52.6 secs Computing kpt #: 79 total cpu time spent up to now is 53.3 secs Computing kpt #: 80 total cpu time spent up to now is 54.0 secs Computing kpt #: 81 total cpu time spent up to now is 54.6 secs Computing kpt #: 82 total cpu time spent up to now is 55.3 secs Computing kpt #: 83 total cpu time spent up to now is 55.9 secs Computing kpt #: 84 total cpu time spent up to now is 56.6 secs Computing kpt #: 85 total cpu time spent up to now is 57.2 secs Computing kpt #: 86 total cpu time spent up to now is 57.9 secs Computing kpt #: 87 total cpu time spent up to now is 58.6 secs Computing kpt #: 88 total cpu time spent up to now is 59.2 secs Computing kpt #: 89 total cpu time spent up to now is 59.9 secs Computing kpt #: 90 total cpu time spent up to now is 60.6 secs Computing kpt #: 91 total cpu time spent up to now is 61.3 secs Computing kpt #: 92 total cpu time spent up to now is 62.0 secs Computing kpt #: 93 total cpu time spent up to now is 62.6 secs Computing kpt #: 94 total cpu time spent up to now is 63.3 secs Computing kpt #: 95 total cpu time spent up to now is 64.0 secs Computing kpt #: 96 total cpu time spent up to now is 64.6 secs Computing kpt #: 97 total cpu time spent up to now is 65.3 secs Computing kpt #: 98 total cpu time spent up to now is 66.0 secs Computing kpt #: 99 total cpu time spent up to now is 66.7 secs Computing kpt #: 100 total cpu time spent up to now is 67.4 secs Computing kpt #: 101 total cpu time spent up to now is 68.1 secs Computing kpt #: 102 total cpu time spent up to now is 68.8 secs Computing kpt #: 103 total cpu time spent up to now is 69.4 secs Computing kpt #: 104 total cpu time spent up to now is 70.1 secs Computing kpt #: 105 total cpu time spent up to now is 70.8 secs Computing kpt #: 106 total cpu time spent up to now is 71.5 secs Computing kpt #: 107 total cpu time spent up to now is 72.2 secs Computing kpt #: 108 total cpu time spent up to now is 72.9 secs Computing kpt #: 109 total cpu time spent up to now is 73.6 secs Computing kpt #: 110 total cpu time spent up to now is 74.3 secs Computing kpt #: 111 total cpu time spent up to now is 74.9 secs Computing kpt #: 112 total cpu time spent up to now is 75.6 secs Computing kpt #: 113 total cpu time spent up to now is 76.3 secs Computing kpt #: 114 total cpu time spent up to now is 76.9 secs Computing kpt #: 115 total cpu time spent up to now is 77.6 secs Computing kpt #: 116 total cpu time spent up to now is 78.3 secs Computing kpt #: 117 total cpu time spent up to now is 78.9 secs Computing kpt #: 118 total cpu time spent up to now is 79.5 secs Computing kpt #: 119 total cpu time spent up to now is 80.2 secs Computing kpt #: 120 total cpu time spent up to now is 80.8 secs Computing kpt #: 121 total cpu time spent up to now is 81.4 secs Computing kpt #: 122 total cpu time spent up to now is 82.1 secs Computing kpt #: 123 total cpu time spent up to now is 82.7 secs Computing kpt #: 124 total cpu time spent up to now is 83.3 secs Computing kpt #: 125 total cpu time spent up to now is 84.0 secs Computing kpt #: 126 total cpu time spent up to now is 84.6 secs Computing kpt #: 127 total cpu time spent up to now is 85.2 secs Computing kpt #: 128 total cpu time spent up to now is 85.8 secs Computing kpt #: 129 total cpu time spent up to now is 86.5 secs Computing kpt #: 130 total cpu time spent up to now is 87.1 secs Computing kpt #: 131 total cpu time spent up to now is 87.7 secs Computing kpt #: 132 total cpu time spent up to now is 88.3 secs Computing kpt #: 133 total cpu time spent up to now is 88.9 secs Computing kpt #: 134 total cpu time spent up to now is 89.5 secs Computing kpt #: 135 total cpu time spent up to now is 90.1 secs Computing kpt #: 136 total cpu time spent up to now is 90.7 secs Computing kpt #: 137 total cpu time spent up to now is 91.3 secs Computing kpt #: 138 total cpu time spent up to now is 92.0 secs Computing kpt #: 139 total cpu time spent up to now is 92.6 secs Computing kpt #: 140 total cpu time spent up to now is 93.2 secs Computing kpt #: 141 total cpu time spent up to now is 93.9 secs Computing kpt #: 142 total cpu time spent up to now is 94.5 secs Computing kpt #: 143 total cpu time spent up to now is 95.1 secs Computing kpt #: 144 total cpu time spent up to now is 95.7 secs Computing kpt #: 145 total cpu time spent up to now is 96.3 secs Computing kpt #: 146 total cpu time spent up to now is 97.0 secs Computing kpt #: 147 total cpu time spent up to now is 97.5 secs Computing kpt #: 148 total cpu time spent up to now is 98.2 secs Computing kpt #: 149 total cpu time spent up to now is 98.8 secs Computing kpt #: 150 total cpu time spent up to now is 99.4 secs Computing kpt #: 151 total cpu time spent up to now is 99.9 secs Computing kpt #: 152 total cpu time spent up to now is 100.5 secs Computing kpt #: 153 total cpu time spent up to now is 101.1 secs Computing kpt #: 154 total cpu time spent up to now is 101.7 secs Computing kpt #: 155 total cpu time spent up to now is 102.3 secs Computing kpt #: 156 total cpu time spent up to now is 102.9 secs Computing kpt #: 157 total cpu time spent up to now is 103.4 secs Computing kpt #: 158 total cpu time spent up to now is 104.0 secs Computing kpt #: 159 total cpu time spent up to now is 104.5 secs Computing kpt #: 160 total cpu time spent up to now is 105.1 secs Computing kpt #: 161 total cpu time spent up to now is 105.7 secs Computing kpt #: 162 total cpu time spent up to now is 106.3 secs Computing kpt #: 163 total cpu time spent up to now is 106.9 secs Computing kpt #: 164 total cpu time spent up to now is 107.5 secs Computing kpt #: 165 total cpu time spent up to now is 108.1 secs Computing kpt #: 166 total cpu time spent up to now is 108.7 secs Computing kpt #: 167 total cpu time spent up to now is 109.3 secs Computing kpt #: 168 total cpu time spent up to now is 109.9 secs Computing kpt #: 169 total cpu time spent up to now is 110.6 secs Computing kpt #: 170 total cpu time spent up to now is 111.2 secs Computing kpt #: 171 total cpu time spent up to now is 111.8 secs Computing kpt #: 172 total cpu time spent up to now is 112.5 secs Computing kpt #: 173 total cpu time spent up to now is 113.1 secs Computing kpt #: 174 total cpu time spent up to now is 113.8 secs Computing kpt #: 175 total cpu time spent up to now is 114.4 secs Computing kpt #: 176 total cpu time spent up to now is 115.1 secs Computing kpt #: 177 total cpu time spent up to now is 115.8 secs Computing kpt #: 178 total cpu time spent up to now is 116.4 secs Computing kpt #: 179 total cpu time spent up to now is 117.1 secs Computing kpt #: 180 total cpu time spent up to now is 117.8 secs Computing kpt #: 181 total cpu time spent up to now is 118.5 secs Computing kpt #: 182 total cpu time spent up to now is 119.2 secs Computing kpt #: 183 total cpu time spent up to now is 119.8 secs Computing kpt #: 184 total cpu time spent up to now is 120.5 secs Computing kpt #: 185 total cpu time spent up to now is 121.1 secs Computing kpt #: 186 total cpu time spent up to now is 121.8 secs Computing kpt #: 187 total cpu time spent up to now is 122.5 secs Computing kpt #: 188 total cpu time spent up to now is 123.2 secs Computing kpt #: 189 total cpu time spent up to now is 123.9 secs Computing kpt #: 190 total cpu time spent up to now is 124.5 secs Computing kpt #: 191 total cpu time spent up to now is 125.2 secs Computing kpt #: 192 total cpu time spent up to now is 125.8 secs Computing kpt #: 193 total cpu time spent up to now is 126.5 secs Computing kpt #: 194 total cpu time spent up to now is 127.1 secs Computing kpt #: 195 total cpu time spent up to now is 127.8 secs Computing kpt #: 196 total cpu time spent up to now is 128.4 secs Computing kpt #: 197 total cpu time spent up to now is 129.1 secs Computing kpt #: 198 total cpu time spent up to now is 129.8 secs Computing kpt #: 199 total cpu time spent up to now is 130.4 secs Computing kpt #: 200 total cpu time spent up to now is 131.1 secs Computing kpt #: 201 total cpu time spent up to now is 131.8 secs Computing kpt #: 202 total cpu time spent up to now is 132.4 secs Computing kpt #: 203 total cpu time spent up to now is 133.1 secs Computing kpt #: 204 total cpu time spent up to now is 133.7 secs Computing kpt #: 205 total cpu time spent up to now is 134.4 secs Computing kpt #: 206 total cpu time spent up to now is 135.1 secs Computing kpt #: 207 total cpu time spent up to now is 135.7 secs Computing kpt #: 208 total cpu time spent up to now is 136.4 secs Computing kpt #: 209 total cpu time spent up to now is 137.0 secs Computing kpt #: 210 total cpu time spent up to now is 137.7 secs Computing kpt #: 211 total cpu time spent up to now is 138.3 secs Computing kpt #: 212 total cpu time spent up to now is 139.0 secs Computing kpt #: 213 total cpu time spent up to now is 139.7 secs Computing kpt #: 214 total cpu time spent up to now is 140.4 secs Computing kpt #: 215 total cpu time spent up to now is 141.0 secs Computing kpt #: 216 total cpu time spent up to now is 141.7 secs Computing kpt #: 217 total cpu time spent up to now is 142.4 secs Computing kpt #: 218 total cpu time spent up to now is 143.0 secs Computing kpt #: 219 total cpu time spent up to now is 143.7 secs Computing kpt #: 220 total cpu time spent up to now is 144.4 secs Computing kpt #: 221 total cpu time spent up to now is 145.0 secs Computing kpt #: 222 total cpu time spent up to now is 145.7 secs Computing kpt #: 223 total cpu time spent up to now is 146.3 secs Computing kpt #: 224 total cpu time spent up to now is 147.0 secs Computing kpt #: 225 total cpu time spent up to now is 147.6 secs Computing kpt #: 226 total cpu time spent up to now is 148.3 secs Computing kpt #: 227 total cpu time spent up to now is 148.9 secs Computing kpt #: 228 total cpu time spent up to now is 149.5 secs Computing kpt #: 229 total cpu time spent up to now is 150.2 secs Computing kpt #: 230 total cpu time spent up to now is 150.8 secs Computing kpt #: 231 total cpu time spent up to now is 151.4 secs Computing kpt #: 232 total cpu time spent up to now is 152.1 secs Computing kpt #: 233 total cpu time spent up to now is 152.7 secs Computing kpt #: 234 total cpu time spent up to now is 153.3 secs Computing kpt #: 235 total cpu time spent up to now is 153.9 secs Computing kpt #: 236 total cpu time spent up to now is 154.6 secs Computing kpt #: 237 total cpu time spent up to now is 155.2 secs Computing kpt #: 238 total cpu time spent up to now is 155.9 secs Computing kpt #: 239 total cpu time spent up to now is 156.5 secs Computing kpt #: 240 total cpu time spent up to now is 157.1 secs Computing kpt #: 241 total cpu time spent up to now is 157.8 secs Computing kpt #: 242 total cpu time spent up to now is 158.4 secs Computing kpt #: 243 total cpu time spent up to now is 159.0 secs Computing kpt #: 244 total cpu time spent up to now is 159.6 secs Computing kpt #: 245 total cpu time spent up to now is 160.3 secs Computing kpt #: 246 total cpu time spent up to now is 160.9 secs Computing kpt #: 247 total cpu time spent up to now is 161.5 secs Computing kpt #: 248 total cpu time spent up to now is 162.2 secs Computing kpt #: 249 total cpu time spent up to now is 162.8 secs Computing kpt #: 250 total cpu time spent up to now is 163.4 secs Computing kpt #: 251 total cpu time spent up to now is 164.0 secs Computing kpt #: 252 total cpu time spent up to now is 164.7 secs Computing kpt #: 253 total cpu time spent up to now is 165.3 secs Computing kpt #: 254 total cpu time spent up to now is 165.9 secs Computing kpt #: 255 total cpu time spent up to now is 166.5 secs Computing kpt #: 256 total cpu time spent up to now is 167.2 secs Computing kpt #: 257 total cpu time spent up to now is 167.8 secs Computing kpt #: 258 total cpu time spent up to now is 168.4 secs Computing kpt #: 259 total cpu time spent up to now is 169.1 secs Computing kpt #: 260 total cpu time spent up to now is 169.7 secs Computing kpt #: 261 total cpu time spent up to now is 170.3 secs Computing kpt #: 262 total cpu time spent up to now is 170.9 secs Computing kpt #: 263 total cpu time spent up to now is 171.5 secs Computing kpt #: 264 total cpu time spent up to now is 172.1 secs Computing kpt #: 265 total cpu time spent up to now is 172.7 secs Computing kpt #: 266 total cpu time spent up to now is 173.3 secs Computing kpt #: 267 total cpu time spent up to now is 173.9 secs Computing kpt #: 268 total cpu time spent up to now is 174.5 secs Computing kpt #: 269 total cpu time spent up to now is 175.1 secs Computing kpt #: 270 total cpu time spent up to now is 175.7 secs Computing kpt #: 271 total cpu time spent up to now is 176.3 secs Computing kpt #: 272 total cpu time spent up to now is 176.9 secs Computing kpt #: 273 total cpu time spent up to now is 177.6 secs Computing kpt #: 274 total cpu time spent up to now is 178.2 secs Computing kpt #: 275 total cpu time spent up to now is 178.8 secs Computing kpt #: 276 total cpu time spent up to now is 179.5 secs Computing kpt #: 277 total cpu time spent up to now is 180.1 secs Computing kpt #: 278 total cpu time spent up to now is 180.7 secs Computing kpt #: 279 total cpu time spent up to now is 181.3 secs Computing kpt #: 280 total cpu time spent up to now is 182.0 secs Computing kpt #: 281 total cpu time spent up to now is 182.6 secs Computing kpt #: 282 total cpu time spent up to now is 183.3 secs Computing kpt #: 283 total cpu time spent up to now is 183.9 secs Computing kpt #: 284 total cpu time spent up to now is 184.6 secs Computing kpt #: 285 total cpu time spent up to now is 185.2 secs Computing kpt #: 286 total cpu time spent up to now is 185.9 secs Computing kpt #: 287 total cpu time spent up to now is 186.5 secs Computing kpt #: 288 total cpu time spent up to now is 187.2 secs Computing kpt #: 289 total cpu time spent up to now is 187.9 secs Computing kpt #: 290 total cpu time spent up to now is 188.5 secs Computing kpt #: 291 total cpu time spent up to now is 189.2 secs Computing kpt #: 292 total cpu time spent up to now is 189.9 secs Computing kpt #: 293 total cpu time spent up to now is 190.6 secs Computing kpt #: 294 total cpu time spent up to now is 191.3 secs Computing kpt #: 295 total cpu time spent up to now is 192.0 secs Computing kpt #: 296 total cpu time spent up to now is 192.7 secs Computing kpt #: 297 total cpu time spent up to now is 193.4 secs Computing kpt #: 298 total cpu time spent up to now is 194.1 secs Computing kpt #: 299 total cpu time spent up to now is 194.8 secs Computing kpt #: 300 total cpu time spent up to now is 195.5 secs Computing kpt #: 301 total cpu time spent up to now is 196.1 secs Computing kpt #: 302 total cpu time spent up to now is 196.8 secs Computing kpt #: 303 total cpu time spent up to now is 197.5 secs Computing kpt #: 304 total cpu time spent up to now is 198.2 secs Computing kpt #: 305 total cpu time spent up to now is 198.9 secs Computing kpt #: 306 total cpu time spent up to now is 199.5 secs Computing kpt #: 307 total cpu time spent up to now is 200.2 secs Computing kpt #: 308 total cpu time spent up to now is 200.8 secs Computing kpt #: 309 total cpu time spent up to now is 201.4 secs Computing kpt #: 310 total cpu time spent up to now is 202.1 secs Computing kpt #: 311 total cpu time spent up to now is 202.7 secs Computing kpt #: 312 total cpu time spent up to now is 203.4 secs Computing kpt #: 313 total cpu time spent up to now is 204.0 secs Computing kpt #: 314 total cpu time spent up to now is 204.6 secs Computing kpt #: 315 total cpu time spent up to now is 205.4 secs Computing kpt #: 316 total cpu time spent up to now is 206.1 secs Computing kpt #: 317 total cpu time spent up to now is 206.8 secs Computing kpt #: 318 total cpu time spent up to now is 207.6 secs Computing kpt #: 319 total cpu time spent up to now is 208.3 secs Computing kpt #: 320 total cpu time spent up to now is 209.0 secs Computing kpt #: 321 total cpu time spent up to now is 209.7 secs Computing kpt #: 322 total cpu time spent up to now is 210.5 secs Computing kpt #: 323 total cpu time spent up to now is 211.2 secs Computing kpt #: 324 total cpu time spent up to now is 211.9 secs Computing kpt #: 325 total cpu time spent up to now is 212.6 secs Computing kpt #: 326 total cpu time spent up to now is 213.3 secs Computing kpt #: 327 total cpu time spent up to now is 213.9 secs Computing kpt #: 328 total cpu time spent up to now is 214.6 secs Computing kpt #: 329 total cpu time spent up to now is 215.3 secs Computing kpt #: 330 total cpu time spent up to now is 215.9 secs Computing kpt #: 331 total cpu time spent up to now is 216.6 secs Computing kpt #: 332 total cpu time spent up to now is 217.3 secs Computing kpt #: 333 total cpu time spent up to now is 218.0 secs Computing kpt #: 334 total cpu time spent up to now is 218.6 secs Computing kpt #: 335 total cpu time spent up to now is 219.3 secs Computing kpt #: 336 total cpu time spent up to now is 220.0 secs Computing kpt #: 337 total cpu time spent up to now is 220.7 secs Computing kpt #: 338 total cpu time spent up to now is 221.5 secs Computing kpt #: 339 total cpu time spent up to now is 222.2 secs Computing kpt #: 340 total cpu time spent up to now is 222.9 secs Computing kpt #: 341 total cpu time spent up to now is 223.6 secs Computing kpt #: 342 total cpu time spent up to now is 224.3 secs Computing kpt #: 343 total cpu time spent up to now is 224.9 secs Computing kpt #: 344 total cpu time spent up to now is 225.6 secs Computing kpt #: 345 total cpu time spent up to now is 226.3 secs Computing kpt #: 346 total cpu time spent up to now is 227.0 secs Computing kpt #: 347 total cpu time spent up to now is 227.6 secs Computing kpt #: 348 total cpu time spent up to now is 228.3 secs Computing kpt #: 349 total cpu time spent up to now is 229.0 secs Computing kpt #: 350 total cpu time spent up to now is 229.6 secs Computing kpt #: 351 total cpu time spent up to now is 230.3 secs Computing kpt #: 352 total cpu time spent up to now is 230.9 secs Computing kpt #: 353 total cpu time spent up to now is 231.6 secs Computing kpt #: 354 total cpu time spent up to now is 232.2 secs Computing kpt #: 355 total cpu time spent up to now is 232.9 secs Computing kpt #: 356 total cpu time spent up to now is 233.5 secs Computing kpt #: 357 total cpu time spent up to now is 234.2 secs Computing kpt #: 358 total cpu time spent up to now is 234.8 secs Computing kpt #: 359 total cpu time spent up to now is 235.4 secs Computing kpt #: 360 total cpu time spent up to now is 236.1 secs Computing kpt #: 361 total cpu time spent up to now is 236.7 secs Computing kpt #: 362 total cpu time spent up to now is 237.4 secs Computing kpt #: 363 total cpu time spent up to now is 238.3 secs Computing kpt #: 364 total cpu time spent up to now is 239.1 secs Computing kpt #: 365 total cpu time spent up to now is 239.7 secs Computing kpt #: 366 total cpu time spent up to now is 240.3 secs Computing kpt #: 367 total cpu time spent up to now is 240.9 secs ethr = 2.08E-08, avg # of iterations = 15.9 total cpu time spent up to now is 240.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4425 PWs) bands (ev): -6.1128 -6.1128 -4.3657 -4.3657 -4.3089 -4.3089 -4.1157 -4.1157 2.2852 2.2852 2.6410 2.6410 2.9640 2.9640 5.3171 5.3171 5.5277 5.5277 5.6785 5.6785 5.8180 5.8180 6.2853 6.2853 6.4040 6.4040 7.3367 7.3367 7.5604 7.5604 7.6260 7.6260 7.8467 7.8467 7.8710 7.8710 8.1252 8.1252 8.2108 8.2108 8.2147 8.2147 8.7295 8.7295 8.8497 8.8497 8.9826 8.9826 9.1922 9.1922 9.2508 9.2508 9.4500 9.4500 10.0576 10.0576 10.4620 10.4620 k = 0.0179 0.0050-0.0096 ( 4417 PWs) bands (ev): -6.1117 -6.1117 -4.3664 -4.3664 -4.3100 -4.3100 -4.1160 -4.1160 2.2890 2.2890 2.6397 2.6397 2.9686 2.9686 5.3165 5.3165 5.5279 5.5279 5.6790 5.6790 5.8176 5.8176 6.2845 6.2845 6.4036 6.4036 7.3331 7.3331 7.5593 7.5593 7.6256 7.6256 7.8469 7.8469 7.8713 7.8713 8.1132 8.1132 8.1932 8.1932 8.2410 8.2410 8.7237 8.7237 8.8470 8.8470 8.9756 8.9756 9.1961 9.1961 9.2499 9.2499 9.4587 9.4587 10.0614 10.0614 10.4593 10.4593 k = 0.0357 0.0100-0.0192 ( 4422 PWs) bands (ev): -6.1087 -6.1087 -4.3686 -4.3686 -4.3136 -4.3136 -4.1171 -4.1171 2.3002 2.3002 2.6361 2.6361 2.9820 2.9820 5.3146 5.3146 5.5286 5.5286 5.6803 5.6803 5.8164 5.8164 6.2819 6.2819 6.4021 6.4021 7.3227 7.3227 7.5550 7.5550 7.6251 7.6251 7.8474 7.8474 7.8720 7.8720 8.0819 8.0819 8.1838 8.1838 8.2713 8.2713 8.7071 8.7071 8.8386 8.8386 8.9572 8.9572 9.2022 9.2022 9.2518 9.2518 9.4831 9.4831 10.0725 10.0725 10.4514 10.4514 k = 0.0536 0.0149-0.0289 ( 4421 PWs) bands (ev): -6.1035 -6.1035 -4.3725 -4.3725 -4.3194 -4.3194 -4.1186 -4.1186 2.3189 2.3189 2.6310 2.6310 3.0034 3.0034 5.3114 5.3114 5.5298 5.5298 5.6825 5.6825 5.8146 5.8146 6.2777 6.2777 6.3997 6.3997 7.3060 7.3060 7.5457 7.5457 7.6253 7.6253 7.8480 7.8480 7.8731 7.8731 8.0405 8.0405 8.1791 8.1791 8.3005 8.3005 8.6811 8.6811 8.8240 8.8240 8.9321 8.9321 9.2009 9.2009 9.2654 9.2654 9.5191 9.5191 10.0908 10.0908 10.4386 10.4386 k = 0.0714 0.0199-0.0385 ( 4420 PWs) bands (ev): -6.0963 -6.0963 -4.3784 -4.3784 -4.3272 -4.3272 -4.1204 -4.1204 2.3445 2.3445 2.6257 2.6257 3.0318 3.0318 5.3068 5.3068 5.5314 5.5314 5.6854 5.6854 5.8124 5.8124 6.2717 6.2717 6.3965 6.3965 7.2840 7.2840 7.5301 7.5301 7.6265 7.6265 7.8488 7.8488 7.8745 7.8745 7.9942 7.9942 8.1753 8.1753 8.3274 8.3274 8.6476 8.6476 8.8039 8.8039 8.9032 8.9032 9.1929 9.1929 9.2894 9.2894 9.5630 9.5630 10.1158 10.1158 10.4210 10.4210 k = 0.0893 0.0249-0.0481 ( 4415 PWs) bands (ev): -6.0871 -6.0871 -4.3871 -4.3871 -4.3366 -4.3366 -4.1221 -4.1221 2.3764 2.3764 2.6215 2.6215 3.0663 3.0663 5.3005 5.3005 5.5336 5.5336 5.6889 5.6889 5.8102 5.8102 6.2639 6.2639 6.3924 6.3924 7.2572 7.2572 7.5085 7.5085 7.6272 7.6272 7.8494 7.8494 7.8756 7.8756 7.9460 7.9460 8.1710 8.1710 8.3515 8.3515 8.6089 8.6089 8.7800 8.7800 8.8716 8.8716 9.1827 9.1827 9.3190 9.3190 9.6120 9.6120 10.1470 10.1470 10.3993 10.3993 k = 0.1071 0.0299-0.0577 ( 4413 PWs) bands (ev): -6.0758 -6.0758 -4.3995 -4.3995 -4.3464 -4.3464 -4.1236 -4.1236 2.4135 2.4135 2.6201 2.6201 3.1060 3.1060 5.2924 5.2924 5.5363 5.5363 5.6926 5.6926 5.8083 5.8083 6.2543 6.2543 6.3876 6.3876 7.2260 7.2260 7.4816 7.4816 7.6256 7.6256 7.8476 7.8476 7.8728 7.8728 7.9029 7.9029 8.1655 8.1655 8.3724 8.3724 8.5673 8.5673 8.7544 8.7544 8.8376 8.8376 9.1722 9.1722 9.3519 9.3519 9.6643 9.6643 10.1833 10.1833 10.3744 10.3744 k = 0.1250 0.0348-0.0674 ( 4413 PWs) bands (ev): -6.0625 -6.0625 -4.4165 -4.4165 -4.3559 -4.3559 -4.1247 -4.1247 2.4535 2.4535 2.6241 2.6241 3.1503 3.1503 5.2823 5.2823 5.5395 5.5395 5.6963 5.6963 5.8073 5.8073 6.2429 6.2429 6.3822 6.3822 7.1903 7.1903 7.4503 7.4503 7.6196 7.6196 7.8249 7.8249 7.8603 7.8603 7.8902 7.8902 8.1582 8.1582 8.3899 8.3899 8.5259 8.5259 8.7282 8.7282 8.8017 8.8017 9.1617 9.1617 9.3873 9.3873 9.7183 9.7183 10.2226 10.2226 10.3483 10.3483 k = 0.1429 0.0398-0.0770 ( 4421 PWs) bands (ev): -6.0473 -6.0473 -4.4385 -4.4385 -4.3644 -4.3644 -4.1253 -4.1253 2.4915 2.4915 2.6382 2.6382 3.1987 3.1987 5.2699 5.2699 5.5433 5.5433 5.6992 5.6992 5.8075 5.8075 6.2299 6.2299 6.3761 6.3761 7.1496 7.1496 7.4152 7.4152 7.6072 7.6072 7.7774 7.7774 7.8587 7.8587 7.8923 7.8923 8.1491 8.1491 8.4028 8.4028 8.4884 8.4884 8.7021 8.7021 8.7649 8.7649 9.1512 9.1512 9.4246 9.4246 9.7733 9.7733 10.2559 10.2559 10.3296 10.3296 k = 0.1607 0.0448-0.0866 ( 4415 PWs) bands (ev): -6.0300 -6.0300 -4.4652 -4.4652 -4.3720 -4.3720 -4.1254 -4.1254 2.5210 2.5210 2.6691 2.6691 3.2510 3.2510 5.2554 5.2554 5.5475 5.5475 5.7010 5.7010 5.8097 5.8097 6.2155 6.2155 6.3697 6.3697 7.1034 7.1034 7.3771 7.3771 7.5867 7.5867 7.7270 7.7270 7.8598 7.8598 7.8967 7.8967 8.1386 8.1386 8.4065 8.4065 8.4618 8.4618 8.6764 8.6764 8.7284 8.7284 9.1406 9.1406 9.4636 9.4636 9.8286 9.8286 10.2534 10.2534 10.3480 10.3480 k = 0.1786 0.0498-0.0962 ( 4413 PWs) bands (ev): -6.0108 -6.0108 -4.4960 -4.4960 -4.3791 -4.3791 -4.1250 -4.1250 2.5393 2.5393 2.7190 2.7190 3.3067 3.3067 5.2386 5.2386 5.5521 5.5521 5.7008 5.7008 5.8142 5.8142 6.2001 6.2001 6.3629 6.3629 7.0507 7.0507 7.3362 7.3362 7.5571 7.5571 7.6776 7.6776 7.8615 7.8615 7.9022 7.9022 8.1276 8.1276 8.3938 8.3938 8.4543 8.4543 8.6509 8.6509 8.6934 8.6934 9.1298 9.1298 9.5038 9.5038 9.8836 9.8836 10.2239 10.2239 10.3945 10.3945 k = 0.1964 0.0548-0.1058 ( 4403 PWs) bands (ev): -5.9897 -5.9897 -4.5303 -4.5303 -4.3857 -4.3857 -4.1243 -4.1243 2.5504 2.5504 2.7837 2.7837 3.3656 3.3656 5.2197 5.2197 5.5569 5.5569 5.6982 5.6982 5.8212 5.8212 6.1843 6.1843 6.3560 6.3560 6.9906 6.9906 7.2931 7.2931 7.5193 7.5193 7.6299 7.6299 7.8637 7.8637 7.9084 7.9084 8.1172 8.1172 8.3735 8.3735 8.4578 8.4578 8.6254 8.6254 8.6613 8.6613 9.1187 9.1187 9.5450 9.5450 9.9380 9.9380 10.1881 10.1881 10.4480 10.4480 k = 0.2143 0.0597-0.1155 ( 4411 PWs) bands (ev): -5.9668 -5.9668 -4.5677 -4.5677 -4.3920 -4.3920 -4.1232 -4.1232 2.5584 2.5584 2.8585 2.8585 3.4276 3.4276 5.1987 5.1987 5.5616 5.5616 5.6927 5.6927 5.8306 5.8306 6.1687 6.1687 6.3491 6.3491 6.9221 6.9221 7.2478 7.2478 7.4753 7.4753 7.5834 7.5834 7.8662 7.8662 7.9149 7.9149 8.1086 8.1086 8.3542 8.3542 8.4629 8.4629 8.5994 8.5994 8.6331 8.6331 9.1072 9.1072 9.5870 9.5870 9.9914 9.9914 10.1506 10.1506 10.5034 10.5034 k = 0.2321 0.0647-0.1251 ( 4412 PWs) bands (ev): -5.9419 -5.9419 -4.6077 -4.6077 -4.3981 -4.3981 -4.1220 -4.1220 2.5656 2.5656 2.9407 2.9407 3.4925 3.4925 5.1760 5.1760 5.5658 5.5658 5.6841 5.6841 5.8422 5.8422 6.1543 6.1543 6.3424 6.3424 6.8447 6.8447 7.2005 7.2005 7.4276 7.4276 7.5381 7.5381 7.8693 7.8693 7.9216 7.9216 8.1027 8.1027 8.3377 8.3377 8.4669 8.4669 8.5730 8.5730 8.6095 8.6095 9.0955 9.0955 9.6294 9.6294 10.0422 10.0422 10.1144 10.1144 10.5585 10.5585 k = 0.2500 0.0697-0.1347 ( 4417 PWs) bands (ev): -5.9153 -5.9153 -4.6499 -4.6499 -4.4038 -4.4038 -4.1205 -4.1205 2.5728 2.5728 3.0288 3.0288 3.5601 3.5601 5.1519 5.1519 5.5684 5.5684 5.6726 5.6726 5.8555 5.8555 6.1419 6.1419 6.3359 6.3359 6.7582 6.7582 7.1514 7.1514 7.3778 7.3778 7.4949 7.4949 7.8728 7.8728 7.9285 7.9285 8.0996 8.0996 8.3237 8.3237 8.4686 8.4686 8.5472 8.5472 8.5902 8.5902 9.0835 9.0835 9.6721 9.6721 10.0634 10.0634 10.1072 10.1072 10.6107 10.6107 k = 0.2679 0.0747-0.1443 ( 4425 PWs) bands (ev): -5.8869 -5.8869 -4.6940 -4.6940 -4.4094 -4.4094 -4.1190 -4.1190 2.5805 2.5805 3.1215 3.1215 3.6305 3.6305 5.1267 5.1267 5.5677 5.5677 5.6595 5.6595 5.8703 5.8703 6.1323 6.1323 6.3300 6.3300 6.6629 6.6629 7.1010 7.1010 7.3266 7.3266 7.4547 7.4547 7.8766 7.8766 7.9354 7.9354 8.0992 8.0992 8.3116 8.3116 8.4675 8.4675 8.5229 8.5229 8.5749 8.5749 9.0714 9.0714 9.7147 9.7147 10.0319 10.0319 10.1527 10.1527 10.6569 10.6569 k = 0.2857 0.0796-0.1539 ( 4420 PWs) bands (ev): -5.8569 -5.8569 -4.7397 -4.7397 -4.4146 -4.4146 -4.1175 -4.1175 2.5887 2.5887 3.2180 3.2180 3.7035 3.7035 5.1009 5.1009 5.5604 5.5604 5.6477 5.6477 5.8861 5.8861 6.1262 6.1262 6.3249 6.3249 6.5596 6.5596 7.0498 7.0498 7.2745 7.2745 7.4187 7.4187 7.8810 7.8810 7.9424 7.9424 8.1009 8.1009 8.3008 8.3008 8.4629 8.4629 8.5008 8.5008 8.5637 8.5637 9.0593 9.0593 9.7569 9.7569 9.9973 9.9973 10.2019 10.2019 10.6932 10.6932 k = 0.3036 0.0846-0.1636 ( 4420 PWs) bands (ev): -5.8252 -5.8252 -4.7866 -4.7866 -4.4196 -4.4196 -4.1160 -4.1160 2.5975 2.5975 3.3172 3.3172 3.7793 3.7793 5.0749 5.0749 5.5427 5.5427 5.6406 5.6406 5.9025 5.9025 6.1236 6.1236 6.3206 6.3206 6.4499 6.4499 6.9984 6.9984 7.2220 7.2220 7.3871 7.3871 7.8856 7.8856 7.9493 7.9493 8.1042 8.1042 8.2912 8.2912 8.4548 8.4548 8.4813 8.4813 8.5562 8.5562 9.0473 9.0473 9.7980 9.7980 9.9647 9.9647 10.2506 10.2506 10.7160 10.7160 k = 0.3214 0.0896-0.1732 ( 4425 PWs) bands (ev): -5.7921 -5.7921 -4.8344 -4.8344 -4.4242 -4.4242 -4.1145 -4.1145 2.6066 2.6066 3.4181 3.4181 3.8581 3.8581 5.0492 5.0492 5.5142 5.5142 5.6388 5.6388 5.9190 5.9190 6.1231 6.1231 6.3148 6.3148 6.3388 6.3388 6.9475 6.9475 7.1697 7.1697 7.3598 7.3598 7.8904 7.8904 7.9561 7.9561 8.1085 8.1085 8.2824 8.2824 8.4438 8.4438 8.4644 8.4644 8.5518 8.5518 9.0356 9.0356 9.8364 9.8364 9.9361 9.9361 10.2981 10.2981 10.7249 10.7249 k = 0.3393 0.0946-0.1828 ( 4415 PWs) bands (ev): -5.7575 -5.7575 -4.8828 -4.8828 -4.4284 -4.4284 -4.1132 -4.1132 2.6158 2.6158 3.5192 3.5192 3.9400 3.9400 5.0242 5.0242 5.4773 5.4773 5.6405 5.6405 5.9350 5.9350 6.1177 6.1177 6.2245 6.2245 6.3182 6.3182 6.8977 6.8977 7.1182 7.1182 7.3363 7.3363 7.8954 7.8954 7.9630 7.9630 8.1134 8.1134 8.2745 8.2745 8.4315 8.4315 8.4495 8.4495 8.5494 8.5494 9.0242 9.0242 9.8640 9.8640 9.9198 9.9198 10.3442 10.3442 10.7233 10.7233 k = 0.3571 0.0995-0.1924 ( 4420 PWs) bands (ev): -5.7217 -5.7217 -4.9315 -4.9315 -4.4323 -4.4323 -4.1119 -4.1119 2.6250 2.6250 3.6190 3.6190 4.0258 4.0258 5.0005 5.0005 5.4344 5.4344 5.6438 5.6438 5.9488 5.9488 6.0598 6.0598 6.1690 6.1690 6.3187 6.3187 6.8493 6.8493 7.0682 7.0682 7.3161 7.3161 7.9004 7.9004 7.9696 7.9696 8.1183 8.1183 8.2673 8.2673 8.4191 8.4191 8.4361 8.4361 8.5484 8.5484 9.0134 9.0134 9.8601 9.8601 9.9363 9.9363 10.3885 10.3885 10.7152 10.7152 k = 0.3750 0.1045-0.2021 ( 4420 PWs) bands (ev): -5.6848 -5.6848 -4.9800 -4.9800 -4.4358 -4.4358 -4.1107 -4.1107 2.6339 2.6339 3.7153 3.7153 4.1159 4.1159 4.9785 4.9785 5.3872 5.3872 5.6477 5.6477 5.9271 5.9271 5.9804 5.9804 6.1698 6.1698 6.3215 6.3215 6.8029 6.8029 7.0205 7.0205 7.2989 7.2989 7.9053 7.9053 7.9761 7.9761 8.1230 8.1230 8.2610 8.2610 8.4075 8.4075 8.4238 8.4238 8.5482 8.5482 9.0033 9.0033 9.8414 9.8414 9.9688 9.9688 10.4302 10.4302 10.7041 10.7041 k = 0.3929 0.1095-0.2117 ( 4416 PWs) bands (ev): -5.6472 -5.6472 -5.0281 -5.0281 -4.4389 -4.4389 -4.1097 -4.1097 2.6423 2.6423 3.8061 3.8061 4.2110 4.2110 4.9587 4.9587 5.3370 5.3370 5.6514 5.6514 5.8114 5.8114 5.9851 5.9851 6.1810 6.1810 6.3267 6.3267 6.7592 6.7592 6.9758 6.9758 7.2845 7.2845 7.9099 7.9099 7.9823 7.9823 8.1270 8.1270 8.2558 8.2558 8.3974 8.3974 8.4127 8.4127 8.5484 8.5484 8.9942 8.9942 9.8223 9.8223 10.0024 10.0024 10.4686 10.4686 10.6926 10.6926 k = 0.4107 0.1145-0.2213 ( 4412 PWs) bands (ev): -5.6092 -5.6092 -5.0751 -5.0751 -4.4415 -4.4415 -4.1088 -4.1088 2.6499 2.6499 3.8888 3.8888 4.3116 4.3116 4.9414 4.9414 5.2847 5.2847 5.6512 5.6512 5.6917 5.6917 5.9959 5.9959 6.1951 6.1951 6.3338 6.3338 6.7188 6.7188 6.9348 6.9348 7.2725 7.2725 7.9142 7.9142 7.9881 7.9881 8.1302 8.1302 8.2517 8.2517 8.3888 8.3888 8.4026 8.4026 8.5487 8.5487 8.9862 8.9862 9.8054 9.8054 10.0340 10.0340 10.5018 10.5018 10.6836 10.6836 k = 0.4286 0.1195-0.2309 ( 4416 PWs) bands (ev): -5.5715 -5.5715 -5.1202 -5.1202 -4.4437 -4.4437 -4.1081 -4.1081 2.6564 2.6564 3.9609 3.9609 4.4176 4.4176 4.9268 4.9268 5.2300 5.2300 5.5647 5.5647 5.6621 5.6621 6.0054 6.0054 6.2099 6.2099 6.3423 6.3423 6.6825 6.6825 6.8987 6.8987 7.2629 7.2629 7.9179 7.9179 7.9932 7.9932 8.1324 8.1324 8.2487 8.2487 8.3819 8.3819 8.3938 8.3938 8.5491 8.5491 8.9793 8.9793 9.7912 9.7912 10.0623 10.0623 10.5273 10.5273 10.6805 10.6805 k = 0.4464 0.1244-0.2405 ( 4416 PWs) bands (ev): -5.5356 -5.5356 -5.1621 -5.1621 -4.4454 -4.4454 -4.1075 -4.1075 2.6618 2.6618 4.0203 4.0203 4.5279 4.5279 4.9150 4.9150 5.1705 5.1705 5.4578 5.4578 5.6639 5.6639 6.0128 6.0128 6.2240 6.2240 6.3513 6.3513 6.6516 6.6516 6.8684 6.8684 7.2555 7.2555 7.9210 7.9210 7.9975 7.9975 8.1338 8.1338 8.2467 8.2467 8.3769 8.3769 8.3863 8.3863 8.5495 8.5495 8.9739 8.9739 9.7801 9.7801 10.0860 10.0860 10.5429 10.5429 10.6856 10.6856 k = 0.4643 0.1294-0.2502 ( 4420 PWs) bands (ev): -5.5035 -5.5035 -5.1984 -5.1984 -4.4466 -4.4466 -4.1071 -4.1071 2.6657 2.6657 4.0647 4.0647 4.6403 4.6403 4.9049 4.9049 5.1017 5.1017 5.3725 5.3725 5.6657 5.6657 6.0182 6.0182 6.2358 6.2358 6.3594 6.3594 6.6275 6.6275 6.8454 6.8454 7.2502 7.2502 7.9233 7.9233 8.0007 8.0007 8.1346 8.1346 8.2455 8.2455 8.3737 8.3737 8.3803 8.3803 8.5497 8.5497 8.9698 8.9698 9.7721 9.7721 10.1042 10.1042 10.5494 10.5494 10.6976 10.6976 k = 0.4821 0.1344-0.2598 ( 4416 PWs) bands (ev): -5.4799 -5.4799 -5.2247 -5.2247 -4.4474 -4.4474 -4.1068 -4.1068 2.6681 2.6681 4.0923 4.0923 4.7499 4.7499 4.8914 4.8914 5.0263 5.0263 5.3197 5.3197 5.6669 5.6669 6.0214 6.0214 6.2438 6.2438 6.3652 6.3652 6.6120 6.6120 6.8310 6.8310 7.2471 7.2471 7.9248 7.9248 8.0028 8.0028 8.1349 8.1349 8.2449 8.2449 8.3725 8.3725 8.3759 8.3759 8.5499 8.5499 8.9674 8.9674 9.7673 9.7673 10.1156 10.1156 10.5509 10.5509 10.7102 10.7102 k = 0.5000 0.1394-0.2694 ( 4418 PWs) bands (ev): -5.4708 -5.4708 -5.2346 -5.2346 -4.4476 -4.4476 -4.1067 -4.1067 2.6689 2.6689 4.1017 4.1017 4.8305 4.8305 4.8589 4.8589 4.9846 4.9846 5.3023 5.3023 5.6673 5.6673 6.0224 6.0224 6.2467 6.2467 6.3673 6.3673 6.6066 6.6066 6.8260 6.8260 7.2459 7.2459 7.9253 7.9253 8.0035 8.0035 8.1350 8.1350 8.2447 8.2447 8.3732 8.3732 8.3734 8.3734 8.5500 8.5500 8.9666 8.9666 9.7657 9.7657 10.1195 10.1195 10.5510 10.5510 10.7156 10.7156 k = 0.5000 0.1394-0.2694 ( 4418 PWs) bands (ev): -5.4708 -5.4708 -5.2346 -5.2346 -4.4476 -4.4476 -4.1067 -4.1067 2.6689 2.6689 4.1017 4.1017 4.8305 4.8305 4.8589 4.8589 4.9846 4.9846 5.3023 5.3023 5.6673 5.6673 6.0224 6.0224 6.2467 6.2467 6.3673 6.3673 6.6066 6.6066 6.8260 6.8260 7.2459 7.2459 7.9253 7.9253 8.0035 8.0035 8.1350 8.1350 8.2447 8.2447 8.3732 8.3732 8.3734 8.3734 8.5500 8.5500 8.9666 8.9666 9.7657 9.7657 10.1195 10.1195 10.5510 10.5510 10.7156 10.7156 k = 0.5091 0.1419-0.2511 ( 4419 PWs) bands (ev): -5.4700 -5.4700 -5.2339 -5.2339 -4.4518 -4.4518 -4.1045 -4.1045 2.6722 2.6722 4.1028 4.1028 4.8218 4.8218 4.8582 4.8582 4.9786 4.9786 5.3144 5.3144 5.6672 5.6672 6.0227 6.0227 6.2465 6.2465 6.3675 6.3675 6.6065 6.6065 6.8257 6.8257 7.2463 7.2463 7.9254 7.9254 8.0031 8.0031 8.1335 8.1335 8.2447 8.2447 8.3715 8.3715 8.3781 8.3781 8.5501 8.5501 8.9672 8.9672 9.7661 9.7661 10.1186 10.1186 10.5490 10.5490 10.7118 10.7118 k = 0.5183 0.1445-0.2329 ( 4413 PWs) bands (ev): -5.4675 -5.4675 -5.2316 -5.2316 -4.4641 -4.4641 -4.0980 -4.0980 2.6820 2.6820 4.1058 4.1058 4.7965 4.7965 4.8536 4.8536 4.9661 4.9661 5.3463 5.3463 5.6668 5.6668 6.0236 6.0236 6.2460 6.2460 6.3681 6.3681 6.6062 6.6062 6.8246 6.8246 7.2472 7.2472 7.9259 7.9259 8.0022 8.0022 8.1292 8.1292 8.2447 8.2447 8.3714 8.3714 8.3869 8.3869 8.5504 8.5504 8.9690 8.9690 9.7674 9.7674 10.1157 10.1157 10.5427 10.5427 10.7008 10.7008 k = 0.5274 0.1470-0.2146 ( 4411 PWs) bands (ev): -5.4635 -5.4635 -5.2279 -5.2279 -4.4835 -4.4835 -4.0882 -4.0882 2.6983 2.6983 4.1108 4.1108 4.7555 4.7555 4.8441 4.8441 4.9558 4.9558 5.3901 5.3901 5.6661 5.6661 6.0251 6.0251 6.2452 6.2452 6.3692 6.3692 6.6055 6.6055 6.8228 6.8228 7.2487 7.2487 7.9268 7.9268 8.0007 8.0007 8.1224 8.1224 8.2448 8.2448 8.3722 8.3722 8.4000 8.4000 8.5510 8.5510 8.9719 8.9719 9.7693 9.7693 10.1109 10.1109 10.5314 10.5314 10.6842 10.6842 k = 0.5365 0.1496-0.1963 ( 4418 PWs) bands (ev): -5.4579 -5.4579 -5.2227 -5.2227 -4.5088 -4.5088 -4.0762 -4.0762 2.7211 2.7211 4.1177 4.1177 4.7013 4.7013 4.8307 4.8307 4.9500 4.9500 5.4396 5.4396 5.6653 5.6653 6.0270 6.0270 6.2441 6.2441 6.3710 6.3710 6.6042 6.6042 6.8201 6.8201 7.2508 7.2508 7.9279 7.9279 7.9987 7.9987 8.1138 8.1138 8.2451 8.2451 8.3734 8.3734 8.4168 8.4168 8.5519 8.5519 8.9758 8.9758 9.7718 9.7718 10.1043 10.1043 10.5138 10.5138 10.6645 10.6645 k = 0.5457 0.1521-0.1780 ( 4412 PWs) bands (ev): -5.4507 -5.4507 -5.2160 -5.2160 -4.5389 -4.5389 -4.0632 -4.0632 2.7501 2.7501 4.1261 4.1261 4.6379 4.6379 4.8150 4.8150 4.9470 4.9470 5.4912 5.4912 5.6646 5.6646 6.0292 6.0292 6.2429 6.2429 6.3736 6.3736 6.6022 6.6022 6.8167 6.8167 7.2537 7.2537 7.9295 7.9295 7.9965 7.9965 8.1038 8.1038 8.2458 8.2458 8.3750 8.3750 8.4370 8.4370 8.5534 8.5534 8.9809 8.9809 9.7747 9.7747 10.0959 10.0959 10.4887 10.4887 10.6442 10.6442 k = 0.5548 0.1547-0.1598 ( 4408 PWs) bands (ev): -5.4420 -5.4420 -5.2079 -5.2079 -4.5728 -4.5728 -4.0499 -4.0499 2.7853 2.7853 4.1358 4.1358 4.5690 4.5690 4.7972 4.7972 4.9451 4.9451 5.5425 5.5425 5.6644 5.6644 6.0316 6.0316 6.2414 6.2414 6.3773 6.3773 6.5991 6.5991 6.8124 6.8124 7.2573 7.2573 7.9314 7.9314 7.9938 7.9938 8.0931 8.0931 8.2466 8.2466 8.3765 8.3765 8.4599 8.4599 8.5556 8.5556 8.9869 8.9869 9.7775 9.7775 10.0858 10.0858 10.4556 10.4556 10.6252 10.6252 k = 0.5640 0.1572-0.1415 ( 4404 PWs) bands (ev): -5.4318 -5.4318 -5.1983 -5.1983 -4.6097 -4.6097 -4.0369 -4.0369 2.8266 2.8266 4.1461 4.1461 4.4972 4.4972 4.7778 4.7778 4.9430 4.9430 5.5908 5.5908 5.6665 5.6665 6.0339 6.0339 6.2399 6.2399 6.3823 6.3823 6.5947 6.5947 6.8072 6.8072 7.2619 7.2619 7.9337 7.9337 7.9908 7.9908 8.0822 8.0822 8.2476 8.2476 8.3779 8.3779 8.4851 8.4851 8.5588 8.5588 8.9938 8.9938 9.7800 9.7800 10.0739 10.0739 10.4155 10.4155 10.6083 10.6083 k = 0.5731 0.1597-0.1232 ( 4401 PWs) bands (ev): -5.4200 -5.4200 -5.1873 -5.1873 -4.6491 -4.6491 -4.0247 -4.0247 2.8737 2.8737 4.1556 4.1556 4.4250 4.4250 4.7566 4.7566 4.9404 4.9404 5.6277 5.6277 5.6787 5.6787 6.0360 6.0360 6.2383 6.2383 6.3887 6.3887 6.5890 6.5890 6.8010 6.8010 7.2676 7.2676 7.9361 7.9361 7.9873 7.9873 8.0718 8.0718 8.2487 8.2487 8.3789 8.3789 8.5117 8.5117 8.5635 8.5635 9.0016 9.0016 9.7813 9.7813 10.0604 10.0604 10.3705 10.3705 10.5929 10.5929 k = 0.5822 0.1623-0.1049 ( 4395 PWs) bands (ev): -5.4069 -5.4069 -5.1750 -5.1750 -4.6904 -4.6904 -4.0136 -4.0136 2.9263 2.9263 4.1610 4.1610 4.3563 4.3563 4.7337 4.7337 4.9370 4.9370 5.6410 5.6410 5.7129 5.7129 6.0376 6.0376 6.2367 6.2367 6.3966 6.3966 6.5818 6.5818 6.7939 6.7939 7.2744 7.2744 7.9386 7.9386 7.9831 7.9831 8.0627 8.0627 8.2498 8.2498 8.3793 8.3793 8.5383 8.5383 8.5713 8.5713 9.0102 9.0102 9.7805 9.7805 10.0453 10.0453 10.3230 10.3230 10.5787 10.5787 k = 0.5914 0.1648-0.0867 ( 4392 PWs) bands (ev): -5.3924 -5.3924 -5.1613 -5.1613 -4.7333 -4.7333 -4.0037 -4.0037 2.9844 2.9844 4.1531 4.1531 4.3007 4.3007 4.7090 4.7090 4.9329 4.9329 5.6429 5.6429 5.7567 5.7567 6.0386 6.0386 6.2351 6.2351 6.4062 6.4062 6.5734 6.5734 6.7857 6.7857 7.2825 7.2825 7.9407 7.9407 7.9783 7.9783 8.0553 8.0553 8.2509 8.2509 8.3789 8.3789 8.5595 8.5595 8.5874 8.5874 9.0195 9.0195 9.7762 9.7762 10.0288 10.0288 10.2757 10.2757 10.5650 10.5650 k = 0.6005 0.1674-0.0684 ( 4392 PWs) bands (ev): -5.3766 -5.3766 -5.1462 -5.1462 -4.7773 -4.7773 -3.9952 -3.9952 3.0474 3.0474 4.1168 4.1168 4.2733 4.2733 4.6825 4.6825 4.9281 4.9281 5.6418 5.6418 5.8012 5.8012 6.0388 6.0388 6.2335 6.2335 6.4172 6.4172 6.5642 6.5642 6.7767 6.7767 7.2919 7.2919 7.9412 7.9412 7.9737 7.9737 8.0500 8.0500 8.2518 8.2518 8.3776 8.3776 8.5723 8.5723 8.6146 8.6146 9.0294 9.0294 9.7669 9.7669 10.0110 10.0110 10.2311 10.2311 10.5516 10.5516 k = 0.6096 0.1699-0.0501 ( 4394 PWs) bands (ev): -5.3596 -5.3596 -5.1299 -5.1299 -4.8220 -4.8220 -3.9882 -3.9882 3.1151 3.1151 4.0551 4.0551 4.2710 4.2710 4.6542 4.6542 4.9230 4.9230 5.6398 5.6398 5.8442 5.8442 6.0382 6.0382 6.2321 6.2321 6.4294 6.4294 6.5550 6.5550 6.7670 6.7670 7.3027 7.3027 7.9383 7.9383 7.9713 7.9713 8.0469 8.0469 8.2525 8.2525 8.3754 8.3754 8.5827 8.5827 8.6467 8.6467 9.0399 9.0399 9.7505 9.7505 9.9924 9.9924 10.1916 10.1916 10.5385 10.5385 k = 0.6188 0.1725-0.0318 ( 4397 PWs) bands (ev): -5.3417 -5.3417 -5.1125 -5.1125 -4.8672 -4.8672 -3.9826 -3.9826 3.1870 3.1870 3.9828 3.9828 4.2786 4.2786 4.6242 4.6242 4.9182 4.9182 5.6373 5.6373 5.8847 5.8847 6.0369 6.0369 6.2310 6.2310 6.4421 6.4421 6.5470 6.5470 6.7567 6.7567 7.3146 7.3146 7.9313 7.9313 7.9722 7.9722 8.0457 8.0457 8.2530 8.2530 8.3721 8.3721 8.5934 8.5934 8.6808 8.6808 9.0508 9.0508 9.7257 9.7257 9.9735 9.9735 10.1589 10.1589 10.5255 10.5255 k = 0.6279 0.1750-0.0136 ( 4394 PWs) bands (ev): -5.3230 -5.3230 -5.0939 -5.0939 -4.9122 -4.9122 -3.9785 -3.9785 3.2626 3.2626 3.9068 3.9068 4.2885 4.2885 4.5927 4.5927 4.9142 4.9142 5.6346 5.6346 5.9215 5.9215 6.0350 6.0350 6.2305 6.2305 6.4542 6.4542 6.5422 6.5422 6.7461 6.7461 7.3276 7.3276 7.9211 7.9211 7.9755 7.9755 8.0461 8.0461 8.2532 8.2532 8.3680 8.3680 8.6052 8.6052 8.7159 8.7159 9.0623 9.0623 9.6922 9.6922 9.9545 9.9545 10.1336 10.1336 10.5128 10.5128 k = 0.6371 0.1776 0.0047 ( 4392 PWs) bands (ev): -5.3041 -5.3041 -5.0747 -5.0747 -4.9562 -4.9562 -3.9758 -3.9758 3.3412 3.3412 3.8301 3.8301 4.2972 4.2972 4.5600 4.5600 4.9120 4.9120 5.6317 5.6317 5.9528 5.9528 6.0331 6.0331 6.2312 6.2312 6.4642 6.4642 6.5428 6.5428 6.7356 6.7356 7.3414 7.3414 7.9091 7.9091 7.9803 7.9803 8.0478 8.0478 8.2531 8.2531 8.3630 8.3630 8.6181 8.6181 8.7516 8.7516 9.0743 9.0743 9.6510 9.6510 9.9354 9.9354 10.1154 10.1154 10.5001 10.5001 k = 0.6462 0.1801 0.0230 ( 4394 PWs) bands (ev): -5.2856 -5.2856 -5.0561 -5.0561 -4.9968 -4.9968 -3.9745 -3.9745 3.4213 3.4213 3.7542 3.7542 4.3024 4.3024 4.5265 4.5265 4.9126 4.9126 5.6286 5.6286 5.9760 5.9760 6.0326 6.0326 6.2338 6.2338 6.4716 6.4716 6.5501 6.5501 6.7259 6.7259 7.3558 7.3558 7.8961 7.8961 7.9858 7.9858 8.0507 8.0507 8.2527 8.2527 8.3571 8.3571 8.6321 8.6321 8.7874 8.7874 9.0865 9.0865 9.6040 9.6040 9.9160 9.9160 10.1031 10.1031 10.4874 10.4874 k = 0.6553 0.1827 0.0413 ( 4396 PWs) bands (ev): -5.2694 -5.2694 -5.0531 -5.0531 -5.0175 -5.0175 -3.9745 -3.9745 3.4995 3.4995 3.6826 3.6826 4.3022 4.3022 4.4931 4.4931 4.9172 4.9172 5.6255 5.6255 5.9876 5.9876 6.0356 6.0356 6.2388 6.2388 6.4784 6.4784 6.5626 6.5626 6.7178 6.7178 7.3704 7.3704 7.8826 7.8826 7.9917 7.9917 8.0546 8.0546 8.2521 8.2521 8.3506 8.3506 8.6471 8.6471 8.8229 8.8229 9.0990 9.0990 9.5536 9.5536 9.8959 9.8959 10.0956 10.0956 10.4744 10.4744 k = 0.6645 0.1852 0.0595 ( 4399 PWs) bands (ev): -5.2587 -5.2587 -5.0789 -5.0789 -5.0017 -5.0017 -3.9757 -3.9757 3.5488 3.5488 3.6413 3.6413 4.2946 4.2946 4.4608 4.4608 4.9269 4.9269 5.6222 5.6222 5.9886 5.9886 6.0405 6.0405 6.2461 6.2461 6.4878 6.4878 6.5771 6.5771 6.7130 6.7130 7.3850 7.3850 7.8688 7.8688 7.9980 7.9980 8.0595 8.0595 8.2513 8.2513 8.3436 8.3436 8.6630 8.6630 8.8575 8.8575 9.1116 9.1116 9.5021 9.5021 9.8751 9.8751 10.0917 10.0917 10.4610 10.4610 k = 0.6645 0.1852 0.0595 ( 4399 PWs) bands (ev): -5.2587 -5.2587 -5.0789 -5.0789 -5.0017 -5.0017 -3.9757 -3.9757 3.5488 3.5488 3.6413 3.6413 4.2946 4.2946 4.4608 4.4608 4.9269 4.9269 5.6222 5.6222 5.9886 5.9886 6.0405 6.0405 6.2461 6.2461 6.4878 6.4878 6.5771 6.5771 6.7130 6.7130 7.3850 7.3850 7.8688 7.8688 7.9980 7.9980 8.0595 8.0595 8.2513 8.2513 8.3436 8.3436 8.6630 8.6630 8.8575 8.8575 9.1116 9.1116 9.5021 9.5021 9.8751 9.8751 10.0917 10.0917 10.4610 10.4610 k = 0.6542 0.1823 0.0764 ( 4399 PWs) bands (ev): -5.2520 -5.2520 -5.0976 -5.0976 -4.9865 -4.9865 -3.9797 -3.9797 3.5112 3.5112 3.6793 3.6793 4.2722 4.2722 4.4664 4.4664 4.9373 4.9373 5.6293 5.6293 5.9649 5.9649 6.0405 6.0405 6.2478 6.2478 6.5084 6.5084 6.6123 6.6123 6.6927 6.6927 7.4033 7.4033 7.8487 7.8487 8.0009 8.0009 8.0625 8.0625 8.2557 8.2557 8.3315 8.3315 8.6952 8.6952 8.8805 8.8805 9.1209 9.1209 9.4722 9.4722 9.8522 9.8522 10.0591 10.0591 10.4578 10.4578 k = 0.6439 0.1795 0.0932 ( 4400 PWs) bands (ev): -5.2524 -5.2524 -5.1168 -5.1168 -4.9617 -4.9617 -3.9853 -3.9853 3.4600 3.4600 3.7329 3.7329 4.2327 4.2327 4.4862 4.4862 4.9468 4.9468 5.6366 5.6366 5.9375 5.9375 6.0273 6.0273 6.2631 6.2631 6.5305 6.5305 6.6411 6.6411 6.6854 6.6854 7.4233 7.4233 7.8290 7.8290 8.0038 8.0038 8.0655 8.0655 8.2589 8.2589 8.3192 8.3192 8.7293 8.7293 8.9022 8.9022 9.1310 9.1310 9.4424 9.4424 9.8281 9.8281 10.0288 10.0288 10.4544 10.4544 k = 0.6336 0.1766 0.1101 ( 4403 PWs) bands (ev): -5.2575 -5.2575 -5.1356 -5.1356 -4.9304 -4.9304 -3.9924 -3.9924 3.4082 3.4082 3.7886 3.7886 4.1872 4.1872 4.5115 4.5115 4.9537 4.9537 5.6440 5.6440 5.9069 5.9069 6.0067 6.0067 6.2843 6.2843 6.5506 6.5506 6.6491 6.6491 6.7097 6.7097 7.4445 7.4445 7.8097 7.8097 8.0066 8.0066 8.0685 8.0685 8.2600 8.2600 8.3077 8.3077 8.7647 8.7647 8.9221 8.9221 9.1414 9.1414 9.4134 9.4134 9.8034 9.8034 10.0015 10.0015 10.4504 10.4504 k = 0.6234 0.1738 0.1269 ( 4407 PWs) bands (ev): -5.2653 -5.2653 -5.1535 -5.1535 -4.8951 -4.8951 -4.0010 -4.0010 3.3586 3.3586 3.8427 3.8427 4.1426 4.1426 4.5380 4.5380 4.9572 4.9572 5.6516 5.6516 5.8735 5.8735 5.9840 5.9840 6.3044 6.3044 6.5602 6.5602 6.6606 6.6606 6.7509 6.7509 7.4666 7.4666 7.7909 7.7909 8.0093 8.0093 8.0711 8.0711 8.2575 8.2575 8.2988 8.2988 8.8012 8.8012 8.9397 8.9397 9.1509 9.1509 9.3865 9.3865 9.7783 9.7783 9.9781 9.9781 10.4454 10.4454 k = 0.6131 0.1709 0.1437 ( 4397 PWs) bands (ev): -5.2746 -5.2746 -5.1704 -5.1704 -4.8576 -4.8576 -4.0110 -4.0110 3.3120 3.3120 3.8906 3.8906 4.1057 4.1057 4.5642 4.5642 4.9566 4.9566 5.6591 5.6591 5.8382 5.8382 5.9619 5.9619 6.3203 6.3203 6.5562 6.5562 6.6881 6.6881 6.7987 6.7987 7.4889 7.4889 7.7727 7.7727 8.0118 8.0118 8.0734 8.0734 8.2502 8.2502 8.2939 8.2939 8.8382 8.8382 8.9548 8.9548 9.1577 9.1577 9.3633 9.3633 9.7533 9.7533 9.9592 9.9592 10.4394 10.4394 k = 0.6028 0.1680 0.1606 ( 4398 PWs) bands (ev): -5.2843 -5.2843 -5.1861 -5.1861 -4.8192 -4.8192 -4.0226 -4.0226 3.2688 3.2688 3.9210 3.9210 4.0884 4.0884 4.5892 4.5892 4.9517 4.9517 5.6662 5.6662 5.8025 5.8025 5.9411 5.9411 6.3312 6.3312 6.5454 6.5454 6.7239 6.7239 6.8525 6.8525 7.5110 7.5110 7.7551 7.7551 8.0137 8.0137 8.0748 8.0748 8.2389 8.2389 8.2922 8.2922 8.8753 8.8753 8.9670 8.9670 9.1595 9.1595 9.3456 9.3456 9.7283 9.7283 9.9455 9.9455 10.4323 10.4323 k = 0.5925 0.1652 0.1774 ( 4398 PWs) bands (ev): -5.2939 -5.2939 -5.2005 -5.2005 -4.7807 -4.7807 -4.0354 -4.0354 3.2294 3.2294 3.9208 3.9208 4.1046 4.1046 4.6127 4.6127 4.9425 4.9425 5.6721 5.6721 5.7684 5.7684 5.9216 5.9216 6.3377 6.3377 6.5325 6.5325 6.7609 6.7609 6.9120 6.9120 7.5320 7.5320 7.7383 7.7383 8.0151 8.0151 8.0755 8.0755 8.2258 8.2258 8.2922 8.2922 8.9119 8.9119 8.9764 8.9764 9.1551 9.1551 9.3347 9.3347 9.7037 9.7037 9.9375 9.9375 10.4241 10.4241 k = 0.5822 0.1623 0.1942 ( 4399 PWs) bands (ev): -5.3031 -5.3031 -5.2135 -5.2135 -4.7429 -4.7429 -4.0493 -4.0493 3.1938 3.1938 3.8984 3.8984 4.1459 4.1459 4.6343 4.6343 4.9290 4.9290 5.6742 5.6742 5.7397 5.7397 5.9034 5.9034 6.3409 6.3409 6.5198 6.5198 6.7957 6.7957 6.9761 6.9761 7.5511 7.5511 7.7231 7.7231 8.0156 8.0156 8.0751 8.0751 8.2120 8.2120 8.2927 8.2927 8.9470 8.9470 8.9830 8.9830 9.1451 9.1451 9.3301 9.3301 9.6795 9.6795 9.9352 9.9352 10.4151 10.4151 k = 0.5720 0.1594 0.2111 ( 4398 PWs) bands (ev): -5.3115 -5.3115 -5.2250 -5.2250 -4.7063 -4.7063 -4.0641 -4.0641 3.1624 3.1624 3.8694 3.8694 4.1972 4.1972 4.6540 4.6540 4.9112 4.9112 5.6662 5.6662 5.7235 5.7235 5.8863 5.8863 6.3418 6.3418 6.5079 6.5079 6.8272 6.8272 7.0427 7.0427 7.5666 7.5666 7.7107 7.7107 8.0150 8.0150 8.0737 8.0737 8.1985 8.1985 8.2931 8.2931 8.9750 8.9750 8.9918 8.9918 9.1322 9.1322 9.3299 9.3299 9.6558 9.6558 9.9384 9.9384 10.4056 10.4056 k = 0.5617 0.1566 0.2279 ( 4399 PWs) bands (ev): -5.3191 -5.3191 -5.2351 -5.2351 -4.6717 -4.6717 -4.0793 -4.0793 3.1350 3.1350 3.8404 3.8404 4.2513 4.2513 4.6715 4.6715 4.8894 4.8894 5.6466 5.6466 5.7222 5.7222 5.8703 5.8703 6.3411 6.3411 6.4973 6.4973 6.8551 6.8551 7.1097 7.1097 7.5760 7.5760 7.7032 7.7032 8.0129 8.0129 8.0715 8.0715 8.1858 8.1858 8.2934 8.2934 8.9797 8.9797 9.0178 9.0178 9.1194 9.1194 9.3319 9.3319 9.6331 9.6331 9.9460 9.9460 10.3960 10.3960 k = 0.5514 0.1537 0.2448 ( 4405 PWs) bands (ev): -5.3256 -5.3256 -5.2437 -5.2437 -4.6398 -4.6398 -4.0945 -4.0945 3.1119 3.1119 3.8142 3.8142 4.3054 4.3054 4.6868 4.6868 4.8641 4.8641 5.6239 5.6239 5.7278 5.7278 5.8552 5.8552 6.3396 6.3396 6.4880 6.4880 6.8792 6.8792 7.1751 7.1751 7.5763 7.5763 7.7028 7.7028 8.0090 8.0090 8.0688 8.0688 8.1743 8.1743 8.2934 8.2934 8.9758 8.9758 9.0459 9.0459 9.1090 9.1090 9.3348 9.3348 9.6116 9.6116 9.9566 9.9566 10.3867 10.3867 k = 0.5411 0.1508 0.2616 ( 4408 PWs) bands (ev): -5.3310 -5.3310 -5.2508 -5.2508 -4.6115 -4.6115 -4.1089 -4.1089 3.0929 3.0929 3.7918 3.7918 4.3574 4.3574 4.6997 4.6997 4.8361 4.8361 5.6032 5.6032 5.7357 5.7357 5.8410 5.8410 6.3377 6.3377 6.4804 6.4804 6.8993 6.8993 7.2373 7.2373 7.5669 7.5669 7.7096 7.7096 8.0033 8.0033 8.0660 8.0660 8.1644 8.1644 8.2932 8.2932 8.9688 8.9688 9.0702 9.0702 9.1024 9.1024 9.3382 9.3382 9.5919 9.5919 9.9686 9.9686 10.3783 10.3783 k = 0.5308 0.1480 0.2784 ( 4414 PWs) bands (ev): -5.3353 -5.3353 -5.2563 -5.2563 -4.5877 -4.5877 -4.1218 -4.1218 3.0781 3.0781 3.7739 3.7739 4.4054 4.4054 4.7103 4.7103 4.8067 4.8067 5.5862 5.5862 5.7445 5.7445 5.8279 5.8279 6.3359 6.3359 6.4744 6.4744 6.9151 6.9151 7.2947 7.2947 7.5496 7.5496 7.7205 7.7205 7.9962 7.9962 8.0636 8.0636 8.1564 8.1564 8.2929 8.2929 8.9609 8.9609 9.0861 9.0861 9.1024 9.1024 9.3417 9.3417 9.5748 9.5748 9.9803 9.9803 10.3711 10.3711 k = 0.5206 0.1451 0.2953 ( 4418 PWs) bands (ev): -5.3384 -5.3384 -5.2602 -5.2602 -4.5695 -4.5695 -4.1321 -4.1321 3.0676 3.0676 3.7610 3.7610 4.4464 4.4464 4.7188 4.7188 4.7784 4.7784 5.5737 5.5737 5.7532 5.7532 5.8162 5.8162 6.3344 6.3344 6.4701 6.4701 6.9267 6.9267 7.3455 7.3455 7.5271 7.5271 7.7317 7.7317 7.9890 7.9890 8.0618 8.0618 8.1506 8.1506 8.2926 8.2926 8.9538 8.9538 9.0891 9.0891 9.1121 9.1121 9.3449 9.3449 9.5612 9.5612 9.9900 9.9900 10.3658 10.3658 k = 0.5103 0.1422 0.3121 ( 4418 PWs) bands (ev): -5.3403 -5.3403 -5.2626 -5.2626 -4.5581 -4.5581 -4.1388 -4.1388 3.0613 3.0613 3.7531 3.7531 4.4754 4.4754 4.7259 4.7259 4.7549 4.7549 5.5660 5.5660 5.7605 5.7605 5.8072 5.8072 6.3335 6.3335 6.4675 6.4675 6.9337 6.9337 7.3864 7.3864 7.5034 7.5034 7.7401 7.7401 7.9834 7.9834 8.0607 8.0607 8.1471 8.1471 8.2924 8.2924 8.9490 8.9490 9.0887 9.0887 9.1205 9.1205 9.3473 9.3473 9.5523 9.5523 9.9964 9.9964 10.3624 10.3624 k = 0.5000 0.1394 0.3290 ( 4424 PWs) bands (ev): -5.3409 -5.3409 -5.2634 -5.2634 -4.5541 -4.5541 -4.1412 -4.1412 3.0592 3.0592 3.7505 3.7505 4.4862 4.4862 4.7314 4.7314 4.7430 4.7430 5.5635 5.5635 5.7637 5.7637 5.8035 5.8035 6.3331 6.3331 6.4666 6.4666 6.9360 6.9360 7.4051 7.4051 7.4904 7.4904 7.7432 7.7432 7.9813 7.9813 8.0603 8.0603 8.1459 8.1459 8.2923 8.2923 8.9473 8.9473 9.0885 9.0885 9.1235 9.1235 9.3481 9.3481 9.5492 9.5492 9.9987 9.9987 10.3613 10.3613 k = 0.5000 0.1394 0.3290 ( 4424 PWs) bands (ev): -5.3409 -5.3409 -5.2634 -5.2634 -4.5541 -4.5541 -4.1412 -4.1412 3.0592 3.0592 3.7505 3.7505 4.4862 4.4862 4.7314 4.7314 4.7430 4.7430 5.5635 5.5635 5.7637 5.7637 5.8035 5.8035 6.3331 6.3331 6.4666 6.4666 6.9360 6.9360 7.4051 7.4051 7.4904 7.4904 7.7432 7.7432 7.9813 7.9813 8.0603 8.0603 8.1459 8.1459 8.2923 8.2923 8.9473 8.9473 9.0885 9.0885 9.1235 9.1235 9.3481 9.3481 9.5492 9.5492 9.9987 9.9987 10.3613 10.3613 k = 0.5055 0.1196 0.3290 ( 4414 PWs) bands (ev): -5.3401 -5.3401 -5.2626 -5.2626 -4.5537 -4.5537 -4.1408 -4.1408 3.0599 3.0599 3.7510 3.7510 4.4869 4.4869 4.7300 4.7300 4.7418 4.7418 5.5636 5.5636 5.7629 5.7629 5.8014 5.8014 6.3326 6.3326 6.4640 6.4640 6.9276 6.9276 7.4095 7.4095 7.4874 7.4874 7.7423 7.7423 7.9817 7.9817 8.0607 8.0607 8.1497 8.1497 8.2930 8.2930 8.9473 8.9473 9.0859 9.0859 9.1279 9.1279 9.3456 9.3456 9.5506 9.5506 10.0000 10.0000 10.3468 10.3468 k = 0.5110 0.0997 0.3290 ( 4412 PWs) bands (ev): -5.3377 -5.3377 -5.2600 -5.2600 -4.5525 -4.5525 -4.1398 -4.1398 3.0621 3.0621 3.7524 3.7524 4.4889 4.4889 4.7259 4.7259 4.7384 4.7384 5.5637 5.5637 5.7599 5.7599 5.7956 5.7956 6.3307 6.3307 6.4563 6.4563 6.9038 6.9038 7.4198 7.4198 7.4798 7.4798 7.7405 7.7405 7.9830 7.9830 8.0615 8.0615 8.1609 8.1609 8.2949 8.2949 8.9470 8.9470 9.0803 9.0803 9.1387 9.1387 9.3384 9.3384 9.5544 9.5544 10.0038 10.0038 10.3101 10.3101 k = 0.5166 0.0799 0.3290 ( 4406 PWs) bands (ev): -5.3336 -5.3336 -5.2558 -5.2558 -4.5506 -4.5506 -4.1380 -4.1380 3.0658 3.0658 3.7547 3.7547 4.4922 4.4922 4.7190 4.7190 4.7325 4.7325 5.5638 5.5638 5.7534 5.7534 5.7878 5.7878 6.3270 6.3270 6.4442 6.4442 6.8680 6.8680 7.4233 7.4233 7.4768 7.4768 7.7401 7.7401 7.9847 7.9847 8.0616 8.0616 8.1789 8.1789 8.2982 8.2982 8.9466 8.9466 9.0742 9.0742 9.1533 9.1533 9.3271 9.3271 9.5603 9.5603 10.0098 10.0098 10.2613 10.2613 k = 0.5221 0.0601 0.3290 ( 4400 PWs) bands (ev): -5.3280 -5.3280 -5.2500 -5.2500 -4.5478 -4.5478 -4.1356 -4.1356 3.0708 3.0708 3.7579 3.7579 4.4967 4.4967 4.7094 4.7094 4.7241 4.7241 5.5635 5.5635 5.7415 5.7415 5.7805 5.7805 6.3207 6.3207 6.4289 6.4289 6.8239 6.8239 7.4043 7.4043 7.4907 7.4907 7.7431 7.7431 7.9866 7.9866 8.0607 8.0607 8.2020 8.2020 8.3027 8.3027 8.9462 8.9462 9.0682 9.0682 9.1700 9.1700 9.3127 9.3127 9.5682 9.5682 10.0177 10.0177 10.2064 10.2064 k = 0.5276 0.0403 0.3290 ( 4396 PWs) bands (ev): -5.3207 -5.3207 -5.2425 -5.2425 -4.5443 -4.5443 -4.1325 -4.1325 3.0772 3.0772 3.7619 3.7619 4.5023 4.5023 4.6972 4.6972 4.7128 4.7128 5.5620 5.5620 5.7237 5.7237 5.7750 5.7750 6.3104 6.3104 6.4122 6.4122 6.7747 6.7747 7.3695 7.3695 7.5131 7.5131 7.7504 7.7504 7.9885 7.9885 8.0588 8.0588 8.2285 8.2285 8.3085 8.3085 8.9460 8.9460 9.0624 9.0624 9.1877 9.1877 9.2966 9.2966 9.5775 9.5775 10.0265 10.0265 10.1488 10.1488 k = 0.5331 0.0205 0.3290 ( 4392 PWs) bands (ev): -5.3119 -5.3119 -5.2333 -5.2333 -4.5400 -4.5400 -4.1287 -4.1287 3.0849 3.0849 3.7667 3.7667 4.5087 4.5087 4.6823 4.6823 4.6984 4.6984 5.5584 5.5584 5.7023 5.7023 5.7708 5.7708 6.2946 6.2946 6.3960 6.3960 6.7227 6.7227 7.3259 7.3259 7.5368 7.5368 7.7619 7.7619 7.9902 7.9902 8.0562 8.0562 8.2565 8.2565 8.3157 8.3157 8.9460 8.9460 9.0568 9.0568 9.2035 9.2035 9.2818 9.2818 9.5882 9.5882 10.0338 10.0338 10.0926 10.0926 k = 0.5387 0.0006 0.3290 ( 4394 PWs) bands (ev): -5.3015 -5.3015 -5.2225 -5.2225 -4.5349 -4.5349 -4.1244 -4.1244 3.0937 3.0937 3.7721 3.7721 4.5156 4.5156 4.6647 4.6647 4.6810 4.6810 5.5508 5.5508 5.6801 5.6801 5.7669 5.7669 6.2728 6.2728 6.3816 6.3816 6.6699 6.6699 7.2763 7.2763 7.5591 7.5591 7.7769 7.7769 7.9914 7.9914 8.0532 8.0532 8.2843 8.2843 8.3248 8.3248 8.9461 8.9461 9.0512 9.0512 9.2103 9.2103 9.2754 9.2754 9.5999 9.5999 10.0165 10.0165 10.0617 10.0617 k = 0.5442-0.0192 0.3290 ( 4392 PWs) bands (ev): -5.2896 -5.2896 -5.2101 -5.2101 -4.5292 -4.5292 -4.1194 -4.1194 3.1036 3.1036 3.7782 3.7782 4.5221 4.5221 4.6441 4.6441 4.6611 4.6611 5.5371 5.5371 5.6600 5.6600 5.7633 5.7633 6.2455 6.2455 6.3690 6.3690 6.6178 6.6178 7.2225 7.2225 7.5788 7.5788 7.7949 7.7949 7.9917 7.9917 8.0505 8.0505 8.3088 8.3088 8.3379 8.3379 8.9464 8.9464 9.0457 9.0457 9.2014 9.2014 9.2840 9.2840 9.6124 9.6124 9.9644 9.9644 10.0675 10.0675 k = 0.5497-0.0390 0.3290 ( 4386 PWs) bands (ev): -5.2761 -5.2761 -5.1962 -5.1962 -4.5228 -4.5228 -4.1139 -4.1139 3.1145 3.1145 3.7847 3.7847 4.5263 4.5263 4.6195 4.6195 4.6412 4.6412 5.5159 5.5159 5.6438 5.6438 5.7598 5.7598 6.2146 6.2146 6.3573 6.3573 6.5675 6.5675 7.1660 7.1660 7.5953 7.5953 7.8150 7.8150 7.9907 7.9907 8.0489 8.0489 8.3262 8.3262 8.3582 8.3582 8.9467 8.9467 9.0402 9.0402 9.1825 9.1825 9.3011 9.3011 9.6254 9.6254 9.9107 9.9107 10.0782 10.0782 k = 0.5552-0.0588 0.3290 ( 4392 PWs) bands (ev): -5.2612 -5.2612 -5.1807 -5.1807 -4.5157 -4.5157 -4.1080 -4.1080 3.1261 3.1261 3.7915 3.7915 4.5244 4.5244 4.5893 4.5893 4.6260 4.6260 5.4879 5.4879 5.6310 5.6310 5.7570 5.7570 6.1818 6.1818 6.3452 6.3452 6.5201 6.5201 7.1075 7.1075 7.6082 7.6082 7.8366 7.8366 7.9879 7.9879 8.0489 8.0489 8.3381 8.3381 8.3832 8.3832 8.9466 8.9466 9.0348 9.0348 9.1599 9.1599 9.3197 9.3197 9.6384 9.6384 9.8611 9.8611 10.0893 10.0893 k = 0.5608-0.0786 0.3290 ( 4388 PWs) bands (ev): -5.2448 -5.2448 -5.1637 -5.1637 -4.5080 -4.5080 -4.1015 -4.1015 3.1382 3.1382 3.7985 3.7985 4.5115 4.5115 4.5532 4.5532 4.6203 4.6203 5.4555 5.4555 5.6191 5.6191 5.7553 5.7553 6.1489 6.1489 6.3317 6.3317 6.4765 6.4765 7.0481 7.0481 7.6173 7.6173 7.8592 7.8592 7.9832 7.9832 8.0512 8.0512 8.3480 8.3480 8.4091 8.4091 8.9458 8.9458 9.0297 9.0297 9.1360 9.1360 9.3359 9.3359 9.6506 9.6506 9.8185 9.8185 10.1002 10.1002 k = 0.5663-0.0985 0.3290 ( 4388 PWs) bands (ev): -5.2269 -5.2269 -5.1452 -5.1452 -4.4998 -4.4998 -4.0947 -4.0947 3.1507 3.1507 3.8055 3.8055 4.4865 4.4865 4.5118 4.5118 4.6246 4.6246 5.4210 5.4210 5.6059 5.6059 5.7552 5.7552 6.1172 6.1172 6.3157 6.3157 6.4378 6.4378 6.9882 6.9882 7.6227 7.6227 7.8823 7.8823 7.9766 7.9766 8.0560 8.0560 8.3573 8.3573 8.4344 8.4344 8.9439 8.9439 9.0251 9.0251 9.1120 9.1120 9.3469 9.3469 9.6611 9.6611 9.7862 9.7862 10.1105 10.1105 k = 0.5718-0.1183 0.3290 ( 4388 PWs) bands (ev): -5.2077 -5.2077 -5.1253 -5.1253 -4.4909 -4.4909 -4.0875 -4.0875 3.1631 3.1631 3.8123 3.8123 4.4510 4.4510 4.4666 4.4666 4.6354 4.6354 5.3862 5.3862 5.5897 5.5897 5.7571 5.7571 6.0877 6.0877 6.2966 6.2966 6.4045 6.4045 6.9286 6.9286 7.6243 7.6243 7.9050 7.9050 7.9689 7.9689 8.0630 8.0630 8.3661 8.3661 8.4588 8.4588 8.9402 8.9402 9.0210 9.0210 9.0887 9.0887 9.3501 9.3501 9.6691 9.6691 9.7668 9.7668 10.1201 10.1201 k = 0.5773-0.1381 0.3290 ( 4392 PWs) bands (ev): -5.1872 -5.1872 -5.1041 -5.1041 -4.4816 -4.4816 -4.0800 -4.0800 3.1751 3.1751 3.8188 3.8188 4.4046 4.4046 4.4212 4.4212 4.6502 4.6502 5.3519 5.3519 5.5701 5.5701 5.7610 5.7610 6.0610 6.0610 6.2746 6.2746 6.3767 6.3767 6.8695 6.8695 7.6224 7.6224 7.9248 7.9248 7.9627 7.9627 8.0721 8.0721 8.3744 8.3744 8.4818 8.4818 8.9343 8.9343 9.0169 9.0169 9.0672 9.0672 9.3438 9.3438 9.6755 9.6755 9.7603 9.7603 10.1288 10.1288 k = 0.5829-0.1579 0.3290 ( 4390 PWs) bands (ev): -5.1653 -5.1653 -5.0815 -5.0815 -4.4718 -4.4718 -4.0723 -4.0723 3.1862 3.1862 3.8246 3.8246 4.3498 4.3498 4.3749 4.3749 4.6675 4.6675 5.3191 5.3191 5.5474 5.5474 5.7666 5.7666 6.0374 6.0374 6.2507 6.2507 6.3536 6.3536 6.8115 6.8115 7.6173 7.6173 7.9321 7.9321 7.9677 7.9677 8.0829 8.0829 8.3825 8.3825 8.5035 8.5035 8.9261 8.9261 9.0108 9.0108 9.0501 9.0501 9.3283 9.3283 9.6830 9.6830 9.7633 9.7633 10.1368 10.1368 k = 0.5884-0.1777 0.3290 ( 4388 PWs) bands (ev): -5.1422 -5.1422 -5.0577 -5.0577 -4.4616 -4.4616 -4.0645 -4.0645 3.1960 3.1960 3.8296 3.8296 4.2906 4.2906 4.3254 4.3254 4.6864 4.6864 5.2879 5.2879 5.5223 5.5223 5.7731 5.7731 6.0169 6.0169 6.2263 6.2263 6.3339 6.3339 6.7547 6.7547 7.6092 7.6092 7.9246 7.9246 7.9861 7.9861 8.0952 8.0952 8.3901 8.3901 8.5239 8.5239 8.9155 8.9155 8.9991 8.9991 9.0408 9.0408 9.3054 9.3054 9.6926 9.6926 9.7719 9.7719 10.1446 10.1446 k = 0.5939-0.1975 0.3290 ( 4388 PWs) bands (ev): -5.1179 -5.1179 -5.0326 -5.0326 -4.4511 -4.4511 -4.0567 -4.0567 3.2036 3.2036 3.8334 3.8334 4.2292 4.2292 4.2723 4.2723 4.7067 4.7067 5.2585 5.2585 5.4958 5.4958 5.7802 5.7802 5.9993 5.9993 6.2029 6.2029 6.3164 6.3164 6.6996 6.6996 7.5987 7.5987 7.9124 7.9124 8.0077 8.0077 8.1087 8.1087 8.3973 8.3973 8.5432 8.5432 8.9027 8.9027 8.9825 8.9825 9.0386 9.0386 9.2776 9.2776 9.7024 9.7024 9.7847 9.7847 10.1527 10.1527 k = 0.5994-0.2174 0.3290 ( 4382 PWs) bands (ev): -5.0925 -5.0925 -5.0064 -5.0064 -4.4403 -4.4403 -4.0488 -4.0488 3.2082 3.2082 3.8357 3.8357 4.1671 4.1671 4.2157 4.2157 4.7280 4.7280 5.2310 5.2310 5.4692 5.4692 5.7870 5.7870 5.9840 5.9840 6.1815 6.1815 6.3007 6.3007 6.6464 6.6464 7.5860 7.5860 7.8984 7.8984 8.0297 8.0297 8.1232 8.1232 8.4041 8.4041 8.5614 8.5614 8.8882 8.8882 8.9644 8.9644 9.0399 9.0399 9.2474 9.2474 9.7095 9.7095 9.8020 9.8020 10.1620 10.1620 k = 0.6050-0.2372 0.3290 ( 4374 PWs) bands (ev): -5.0660 -5.0660 -4.9791 -4.9791 -4.4292 -4.4292 -4.0411 -4.0411 3.2090 3.2090 3.8363 3.8363 4.1060 4.1060 4.1559 4.1559 4.7500 4.7500 5.2054 5.2054 5.4434 5.4434 5.7930 5.7930 5.9708 5.9708 6.1623 6.1623 6.2866 6.2866 6.5953 6.5953 7.5715 7.5715 7.8835 7.8835 8.0512 8.0512 8.1384 8.1384 8.4103 8.4103 8.5788 8.5788 8.8724 8.8724 8.9463 8.9463 9.0428 9.0428 9.2163 9.2163 9.7119 9.7119 9.8240 9.8240 10.1730 10.1730 k = 0.6105-0.2570 0.3290 ( 4384 PWs) bands (ev): -5.0385 -5.0385 -4.9509 -4.9509 -4.4179 -4.4179 -4.0335 -4.0335 3.2048 3.2048 3.8345 3.8345 4.0475 4.0475 4.0935 4.0935 4.7725 4.7725 5.1818 5.1818 5.4192 5.4192 5.7977 5.7977 5.9589 5.9589 6.1456 6.1456 6.2744 6.2744 6.5465 6.5465 7.5555 7.5555 7.8677 7.8677 8.0719 8.0719 8.1541 8.1541 8.4161 8.4161 8.5953 8.5953 8.8557 8.8557 8.9287 8.9287 9.0463 9.0463 9.1853 9.1853 9.7091 9.7091 9.8501 9.8501 10.1860 10.1860 k = 0.6160-0.2768 0.3290 ( 4382 PWs) bands (ev): -5.0101 -5.0101 -4.9217 -4.9217 -4.4065 -4.4065 -4.0263 -4.0263 3.1945 3.1945 3.8296 3.8296 3.9932 3.9932 4.0297 4.0297 4.7952 4.7952 5.1602 5.1602 5.3976 5.3976 5.8007 5.8007 5.9480 5.9480 6.1310 6.1310 6.2646 6.2646 6.5004 6.5004 7.5384 7.5384 7.8515 7.8515 8.0916 8.0916 8.1701 8.1701 8.4214 8.4214 8.6111 8.6111 8.8386 8.8386 8.9119 8.9119 9.0498 9.0498 9.1555 9.1555 9.7021 9.7021 9.8793 9.8793 10.2009 10.2009 k = 0.6215-0.2966 0.3290 ( 4386 PWs) bands (ev): -4.9809 -4.9809 -4.8917 -4.8917 -4.3951 -4.3951 -4.0194 -4.0194 3.1771 3.1771 3.8203 3.8203 3.9433 3.9433 3.9670 3.9670 4.8180 4.8180 5.1408 5.1408 5.3789 5.3789 5.8018 5.8018 5.9378 5.9378 6.1180 6.1180 6.2580 6.2580 6.4571 6.4571 7.5204 7.5204 7.8347 7.8347 8.1103 8.1103 8.1863 8.1863 8.4261 8.4261 8.6263 8.6263 8.8216 8.8216 8.8957 8.8957 9.0524 9.0524 9.1276 9.1276 9.6921 9.6921 9.9106 9.9106 10.2171 10.2171 k = 0.6271-0.3165 0.3290 ( 4388 PWs) bands (ev): -4.9510 -4.9510 -4.8610 -4.8610 -4.3836 -4.3836 -4.0130 -4.0130 3.1521 3.1521 3.8028 3.8028 3.8937 3.8937 3.9148 3.9148 4.8406 4.8406 5.1239 5.1239 5.3636 5.3636 5.8007 5.8007 5.9279 5.9279 6.1059 6.1059 6.2549 6.2549 6.4170 6.4170 7.5018 7.5018 7.8177 7.8177 8.1278 8.1278 8.2024 8.2024 8.4304 8.4304 8.6408 8.6408 8.8049 8.8049 8.8803 8.8803 9.0519 9.0519 9.1039 9.1039 9.6801 9.6801 9.9435 9.9435 10.2339 10.2339 k = 0.6326-0.3363 0.3290 ( 4390 PWs) bands (ev): -4.9204 -4.9204 -4.8296 -4.8296 -4.3722 -4.3722 -4.0073 -4.0073 3.1194 3.1194 3.7682 3.7682 3.8479 3.8479 3.8795 3.8795 4.8626 4.8626 5.1097 5.1097 5.3519 5.3519 5.7976 5.7976 5.9181 5.9181 6.0941 6.0941 6.2556 6.2556 6.3803 6.3803 7.4827 7.4827 7.8003 7.8003 8.1442 8.1442 8.2183 8.2183 8.4342 8.4342 8.6546 8.6546 8.7892 8.7892 8.8658 8.8658 9.0433 9.0433 9.0894 9.0894 9.6667 9.6667 9.9774 9.9774 10.2503 10.2503 k = 0.6381-0.3561 0.3290 ( 4396 PWs) bands (ev): -4.8893 -4.8893 -4.7977 -4.7977 -4.3608 -4.3608 -4.0022 -4.0022 3.0795 3.0795 3.7122 3.7122 3.8172 3.8172 3.8538 3.8538 4.8839 4.8839 5.0988 5.0988 5.3439 5.3439 5.7925 5.7925 5.9085 5.9085 6.0822 6.0822 6.2596 6.2596 6.3477 6.3477 7.4633 7.4633 7.7829 7.7829 8.1593 8.1593 8.2336 8.2336 8.4376 8.4376 8.6670 8.6670 8.7748 8.7748 8.8521 8.8521 9.0250 9.0250 9.0857 9.0857 9.6527 9.6527 10.0123 10.0123 10.2657 10.2657 k = 0.6436-0.3759 0.3290 ( 4396 PWs) bands (ev): -4.8578 -4.8578 -4.7654 -4.7654 -4.3497 -4.3497 -3.9979 -3.9979 3.0335 3.0335 3.6454 3.6454 3.7954 3.7954 3.8334 3.8334 4.9041 4.9041 5.0912 5.0912 5.3395 5.3395 5.7855 5.7855 5.8990 5.8990 6.0702 6.0702 6.2651 6.2651 6.3208 6.3208 7.4440 7.4440 7.7654 7.7654 8.1732 8.1732 8.2483 8.2483 8.4406 8.4406 8.6774 8.6774 8.7626 8.7626 8.8396 8.8396 9.0025 9.0025 9.0871 9.0871 9.6385 9.6385 10.0478 10.0478 10.2796 10.2796 k = 0.6492-0.3957 0.3290 ( 4400 PWs) bands (ev): -4.8260 -4.8260 -4.7327 -4.7327 -4.3387 -4.3387 -3.9945 -3.9945 2.9829 2.9829 3.5750 3.5750 3.7774 3.7774 3.8155 3.8155 4.9232 4.9232 5.0874 5.0874 5.3386 5.3386 5.7767 5.7767 5.8896 5.8896 6.0583 6.0583 6.2659 6.2659 6.3050 6.3050 7.4247 7.4247 7.7480 7.7480 8.1860 8.1860 8.2620 8.2620 8.4435 8.4435 8.6840 8.6840 8.7541 8.7541 8.8282 8.8282 8.9793 8.9793 9.0903 9.0903 9.6242 9.6242 10.0839 10.0839 10.2917 10.2917 k = 0.6547-0.4155 0.3290 ( 4404 PWs) bands (ev): -4.7941 -4.7941 -4.6999 -4.6999 -4.3280 -4.3280 -3.9921 -3.9921 2.9291 2.9291 3.5036 3.5036 3.7615 3.7615 3.7986 3.7986 4.9410 4.9410 5.0873 5.0873 5.3410 5.3410 5.7662 5.7662 5.8805 5.8805 6.0466 6.0466 6.2547 6.2547 6.3071 6.3071 7.4059 7.4059 7.7309 7.7309 8.1977 8.1977 8.2744 8.2744 8.4464 8.4464 8.6850 8.6850 8.7506 8.7506 8.8186 8.8186 8.9566 8.9566 9.0941 9.0941 9.6101 9.6101 10.1204 10.1204 10.3021 10.3021 k = 0.6602-0.4354 0.3290 ( 4404 PWs) bands (ev): -4.7623 -4.7623 -4.6670 -4.6670 -4.3175 -4.3175 -3.9908 -3.9908 2.8737 2.8737 3.4325 3.4325 3.7463 3.7463 3.7823 3.7823 4.9578 4.9578 5.0908 5.0908 5.3464 5.3464 5.7542 5.7542 5.8717 5.8717 6.0353 6.0353 6.2397 6.2397 6.3183 6.3183 7.3875 7.3875 7.7140 7.7140 8.2083 8.2083 8.2850 8.2850 8.4497 8.4497 8.6802 8.6802 8.7516 8.7516 8.8113 8.8113 8.9349 8.9349 9.0981 9.0981 9.5963 9.5963 10.1573 10.1573 10.3110 10.3110 k = 0.6657-0.4552 0.3290 ( 4402 PWs) bands (ev): -4.7306 -4.7306 -4.6342 -4.6342 -4.3073 -4.3073 -3.9906 -3.9906 2.8178 2.8178 3.3624 3.3624 3.7307 3.7307 3.7668 3.7668 4.9738 4.9738 5.0973 5.0973 5.3544 5.3544 5.7408 5.7408 5.8632 5.8632 6.0246 6.0246 6.2268 6.2268 6.3320 6.3320 7.3700 7.3700 7.6975 7.6975 8.2178 8.2178 8.2935 8.2935 8.4536 8.4536 8.6716 8.6716 8.7538 8.7538 8.8073 8.8073 8.9145 8.9145 9.1023 9.1023 9.5827 9.5827 10.1944 10.1944 10.3185 10.3185 k = 0.6712-0.4750 0.3290 ( 4410 PWs) bands (ev): -4.6994 -4.6994 -4.6016 -4.6016 -4.2974 -4.2974 -3.9918 -3.9918 2.7626 2.7626 3.2938 3.2938 3.7141 3.7141 3.7523 3.7523 4.9896 4.9896 5.1063 5.1063 5.3647 5.3647 5.7262 5.7262 5.8550 5.8550 6.0146 6.0146 6.2175 6.2175 6.3461 6.3461 7.3536 7.3536 7.6814 7.6814 8.2263 8.2263 8.2994 8.2994 8.4583 8.4583 8.6613 8.6613 8.7541 8.7541 8.8073 8.8073 8.8958 8.8958 9.1066 9.1066 9.5694 9.5694 10.2313 10.2313 10.3251 10.3251 k = 0.6768-0.4948 0.3290 ( 4410 PWs) bands (ev): -4.6688 -4.6688 -4.5694 -4.5694 -4.2876 -4.2876 -3.9942 -3.9942 2.7089 2.7089 3.2272 3.2272 3.6962 3.6962 3.7389 3.7389 5.0054 5.0054 5.1170 5.1170 5.3771 5.3771 5.7106 5.7106 5.8472 5.8472 6.0051 6.0051 6.2120 6.2120 6.3596 6.3596 7.3385 7.3385 7.6660 7.6660 8.2339 8.2339 8.3027 8.3027 8.4641 8.4641 8.6502 8.6502 8.7518 8.7518 8.8103 8.8103 8.8793 8.8793 9.1110 9.1110 9.5562 9.5562 10.2675 10.2675 10.3312 10.3312 k = 0.6823-0.5146 0.3290 ( 4408 PWs) bands (ev): -4.6391 -4.6391 -4.5377 -4.5377 -4.2781 -4.2781 -3.9981 -3.9981 2.6575 2.6575 3.1630 3.1630 3.6773 3.6773 3.7261 3.7261 5.0213 5.0213 5.1289 5.1289 5.3912 5.3912 5.6941 5.6941 5.8397 5.8397 5.9964 5.9964 6.2106 6.2106 6.3718 6.3718 7.3250 7.3250 7.6512 7.6512 8.2404 8.2404 8.3033 8.3033 8.4710 8.4710 8.6391 8.6391 8.7479 8.7479 8.8137 8.8137 8.8662 8.8662 9.1156 9.1156 9.5431 9.5431 10.3012 10.3012 10.3388 10.3388 k = 0.6878-0.5345 0.3290 ( 4408 PWs) bands (ev): -4.6107 -4.6107 -4.5066 -4.5066 -4.2686 -4.2686 -4.0033 -4.0033 2.6090 2.6090 3.1015 3.1015 3.6580 3.6580 3.7139 3.7139 5.0373 5.0373 5.1416 5.1416 5.4069 5.4069 5.6770 5.6770 5.8326 5.8326 5.9883 5.9883 6.2130 6.2130 6.3822 6.3822 7.3134 7.3134 7.6372 7.6372 8.2458 8.2458 8.3014 8.3014 8.4787 8.4787 8.6282 8.6282 8.7432 8.7432 8.8142 8.8142 8.8586 8.8586 9.1206 9.1206 9.5299 9.5299 10.3243 10.3243 10.3553 10.3553 k = 0.6933-0.5543 0.3290 ( 4406 PWs) bands (ev): -4.5837 -4.5837 -4.4765 -4.4765 -4.2590 -4.2590 -4.0100 -4.0100 2.5639 2.5639 3.0431 3.0431 3.6388 3.6388 3.7021 3.7021 5.0526 5.0526 5.1550 5.1550 5.4240 5.4240 5.6592 5.6592 5.8257 5.8257 5.9810 5.9810 6.2189 6.2189 6.3903 6.3903 7.3040 7.3040 7.6241 7.6241 8.2499 8.2499 8.2975 8.2975 8.4870 8.4870 8.6178 8.6178 8.7386 8.7386 8.8095 8.8095 8.8576 8.8576 9.1260 9.1260 9.5165 9.5165 10.3329 10.3329 10.3844 10.3844 k = 0.6989-0.5741 0.3290 ( 4404 PWs) bands (ev): -4.5587 -4.5587 -4.4474 -4.4474 -4.2491 -4.2491 -4.0182 -4.0182 2.5226 2.5226 2.9880 2.9880 3.6200 3.6200 3.6907 3.6907 5.0667 5.0667 5.1692 5.1692 5.4425 5.4425 5.6411 5.6411 5.8191 5.8191 5.9742 5.9742 6.2282 6.2282 6.3959 6.3959 7.2970 7.2970 7.6119 7.6119 8.2523 8.2523 8.2924 8.2924 8.4955 8.4955 8.6078 8.6078 8.7344 8.7344 8.8015 8.8015 8.8610 8.8610 9.1319 9.1319 9.5028 9.5028 10.3365 10.3365 10.4156 10.4156 k = 0.7044-0.5939 0.3290 ( 4404 PWs) bands (ev): -4.5359 -4.5359 -4.4196 -4.4196 -4.2387 -4.2387 -4.0277 -4.0277 2.4855 2.4855 2.9365 2.9365 3.6021 3.6021 3.6799 3.6799 5.0786 5.0786 5.1844 5.1844 5.4622 5.4622 5.6226 5.6226 5.8128 5.8128 5.9683 5.9683 6.2402 6.2402 6.3989 6.3989 7.2925 7.2925 7.6007 7.6007 8.2525 8.2525 8.2868 8.2868 8.5038 8.5038 8.5986 8.5986 8.7307 8.7307 8.7926 8.7926 8.8661 8.8661 9.1385 9.1385 9.4886 9.4886 10.3383 10.3383 10.4445 10.4445 k = 0.7099-0.6137 0.3290 ( 4400 PWs) bands (ev): -4.5159 -4.5159 -4.3933 -4.3933 -4.2277 -4.2277 -4.0386 -4.0386 2.4529 2.4529 2.8887 2.8887 3.5854 3.5854 3.6697 3.6697 5.0877 5.0877 5.2007 5.2007 5.4831 5.4831 5.6037 5.6037 5.8067 5.8067 5.9631 5.9631 6.2544 6.2544 6.3994 6.3994 7.2906 7.2906 7.5906 7.5906 8.2501 8.2501 8.2817 8.2817 8.5115 8.5115 8.5902 8.5902 8.7277 8.7277 8.7841 8.7841 8.8714 8.8714 9.1459 9.1459 9.4738 9.4738 10.3385 10.3385 10.4688 10.4688 k = 0.7154-0.6336 0.3290 ( 4404 PWs) bands (ev): -4.4989 -4.4989 -4.3690 -4.3690 -4.2157 -4.2157 -4.0505 -4.0505 2.4250 2.4250 2.8450 2.8450 3.5702 3.5702 3.6604 3.6604 5.0936 5.0936 5.2180 5.2180 5.5050 5.5050 5.5846 5.5846 5.8007 5.8007 5.9588 5.9588 6.2701 6.2701 6.3978 6.3978 7.2913 7.2913 7.5817 7.5817 8.2447 8.2447 8.2775 8.2775 8.5185 8.5185 8.5826 8.5826 8.7255 8.7255 8.7763 8.7763 8.8765 8.8765 9.1543 9.1543 9.4583 9.4583 10.3371 10.3371 10.4864 10.4864 k = 0.7210-0.6534 0.3290 ( 4406 PWs) bands (ev): -4.4852 -4.4852 -4.3469 -4.3469 -4.2027 -4.2027 -4.0633 -4.0633 2.4021 2.4021 2.8056 2.8056 3.5567 3.5567 3.6522 3.6522 5.0962 5.0962 5.2358 5.2358 5.5278 5.5278 5.5654 5.5654 5.7948 5.7948 5.9555 5.9555 6.2861 6.2861 6.3949 6.3949 7.2944 7.2944 7.5740 7.5740 8.2372 8.2372 8.2738 8.2738 8.5244 8.5244 8.5760 8.5760 8.7242 8.7242 8.7693 8.7693 8.8810 8.8810 9.1639 9.1639 9.4422 9.4422 10.3334 10.3334 10.4958 10.4958 k = 0.7265-0.6732 0.3290 ( 4410 PWs) bands (ev): -4.4750 -4.4750 -4.3276 -4.3276 -4.1886 -4.1886 -4.0764 -4.0764 2.3843 2.3843 2.7704 2.7704 3.5451 3.5451 3.6452 3.6452 5.0959 5.0959 5.2533 5.2533 5.5431 5.5431 5.5542 5.5542 5.7891 5.7891 5.9530 5.9530 6.3008 6.3008 6.3924 6.3924 7.2997 7.2997 7.5676 7.5676 8.2283 8.2283 8.2700 8.2700 8.5291 8.5291 8.5704 8.5704 8.7239 8.7239 8.7631 8.7631 8.8850 8.8850 9.1748 9.1748 9.4254 9.4254 10.3268 10.3268 10.4962 10.4962 k = 0.7320-0.6930 0.3290 ( 4406 PWs) bands (ev): -4.4684 -4.4684 -4.3120 -4.3120 -4.1735 -4.1735 -4.0893 -4.0893 2.3718 2.3718 2.7398 2.7398 3.5358 3.5358 3.6396 3.6396 5.0930 5.0930 5.2698 5.2698 5.5248 5.5248 5.5773 5.5773 5.7833 5.7833 5.9515 5.9515 6.3112 6.3112 6.3931 6.3931 7.3069 7.3069 7.5625 7.5625 8.2189 8.2189 8.2656 8.2656 8.5328 8.5328 8.5658 8.5658 8.7246 8.7246 8.7579 8.7579 8.8884 8.8884 9.1871 9.1871 9.4081 9.4081 10.3166 10.3166 10.4886 10.4886 k = 0.7375-0.7128 0.3290 ( 4410 PWs) bands (ev): -4.4652 -4.4652 -4.3009 -4.3009 -4.1577 -4.1577 -4.1008 -4.1008 2.3646 2.3646 2.7138 2.7138 3.5288 3.5288 3.6354 3.6354 5.0877 5.0877 5.2847 5.2847 5.5049 5.5049 5.6025 5.6025 5.7776 5.7776 5.9509 5.9509 6.3144 6.3144 6.4001 6.4001 7.3159 7.3159 7.5589 7.5589 8.2094 8.2094 8.2604 8.2604 8.5353 8.5353 8.5620 8.5620 8.7259 8.7259 8.7535 8.7535 8.8913 8.8913 9.2010 9.2010 9.3904 9.3904 10.3023 10.3023 10.4749 10.4749 k = 0.7431-0.7326 0.3290 ( 4408 PWs) bands (ev): -4.4652 -4.4652 -4.2957 -4.2957 -4.1414 -4.1414 -4.1100 -4.1100 2.3629 2.3629 2.6926 2.6926 3.5242 3.5242 3.6326 3.6326 5.0805 5.0805 5.2973 5.2973 5.4851 5.4851 5.6283 5.6283 5.7720 5.7720 5.9508 5.9508 6.3106 6.3106 6.4133 6.4133 7.3262 7.3262 7.5566 7.5566 8.2001 8.2001 8.2544 8.2544 8.5368 8.5368 8.5589 8.5589 8.7271 8.7271 8.7510 8.7510 8.8939 8.8939 9.2166 9.2166 9.3723 9.3723 10.2837 10.2837 10.4570 10.4570 k = 0.7486-0.7525 0.3290 ( 4412 PWs) bands (ev): -4.4683 -4.4683 -4.2973 -4.2973 -4.1250 -4.1250 -4.1157 -4.1157 2.3666 2.3666 2.6761 2.6761 3.5223 3.5223 3.6313 3.6313 5.0715 5.0715 5.3068 5.3068 5.4659 5.4659 5.6545 5.6545 5.7666 5.7666 5.9510 5.9510 6.3024 6.3024 6.4305 6.4305 7.3377 7.3377 7.5559 7.5559 8.1910 8.1910 8.2477 8.2477 8.5370 8.5370 8.5565 8.5565 8.7268 8.7268 8.7515 8.7515 8.8961 8.8961 9.2338 9.2338 9.3542 9.3542 10.2607 10.2607 10.4363 10.4363 k = 0.2514-0.9020 0.5984 ( 4412 PWs) bands (ev): -4.4683 -4.4683 -4.2973 -4.2973 -4.1250 -4.1250 -4.1157 -4.1157 2.3666 2.3666 2.6761 2.6761 3.5223 3.5223 3.6313 3.6313 5.0715 5.0715 5.3068 5.3068 5.4659 5.4659 5.6545 5.6545 5.7666 5.7666 5.9510 5.9510 6.3024 6.3024 6.4305 6.4305 7.3377 7.3377 7.5559 7.5559 8.1910 8.1910 8.2477 8.2477 8.5370 8.5370 8.5565 8.5565 8.7268 8.7268 8.7515 8.7515 8.8961 8.8961 9.2338 9.2338 9.3542 9.3542 10.2607 10.2607 10.4363 10.4363 k = 0.2458-0.8819 0.5984 ( 4422 PWs) bands (ev): -4.4743 -4.4743 -4.3062 -4.3062 -4.1177 -4.1177 -4.1084 -4.1084 2.3759 2.3759 2.6644 2.6644 3.5231 3.5231 3.6314 3.6314 5.0608 5.0608 5.3126 5.3126 5.4481 5.4481 5.6807 5.6807 5.7616 5.7616 5.9507 5.9507 6.2924 6.2924 6.4495 6.4495 7.3502 7.3502 7.5566 7.5566 8.1823 8.1823 8.2404 8.2404 8.5358 8.5358 8.5550 8.5550 8.7240 8.7240 8.7559 8.7559 8.8980 8.8980 9.2528 9.2528 9.3362 9.3362 10.2331 10.2331 10.4138 10.4138 k = 0.2402-0.8619 0.5984 ( 4416 PWs) bands (ev): -4.4828 -4.4828 -4.3217 -4.3217 -4.1165 -4.1165 -4.0923 -4.0923 2.3907 2.3907 2.6576 2.6576 3.5266 3.5266 3.6329 3.6329 5.0488 5.0488 5.3132 5.3132 5.4333 5.4333 5.7051 5.7051 5.7586 5.7586 5.9495 5.9495 6.2823 6.2823 6.4690 6.4690 7.3635 7.3635 7.5589 7.5589 8.1741 8.1741 8.2329 8.2329 8.5333 8.5333 8.5543 8.5543 8.7193 8.7193 8.7636 8.7636 8.8997 8.8997 9.2729 9.2729 9.3193 9.3193 10.2019 10.2019 10.3903 10.3903 k = 0.2347-0.8418 0.5984 ( 4414 PWs) bands (ev): -4.4936 -4.4936 -4.3426 -4.3426 -4.1132 -4.1132 -4.0770 -4.0770 2.4111 2.4111 2.6559 2.6559 3.5331 3.5331 3.6356 3.6356 5.0356 5.0356 5.3079 5.3079 5.4227 5.4227 5.7223 5.7223 5.7630 5.7630 5.9466 5.9466 6.2734 6.2734 6.4881 6.4881 7.3773 7.3773 7.5626 7.5626 8.1663 8.1663 8.2253 8.2253 8.5294 8.5294 8.5542 8.5542 8.7134 8.7134 8.7738 8.7738 8.9011 8.9011 9.2883 9.2883 9.3094 9.3094 10.1674 10.1674 10.3665 10.3665 k = 0.2291-0.8218 0.5984 ( 4418 PWs) bands (ev): -4.5066 -4.5066 -4.3676 -4.3676 -4.1090 -4.1090 -4.0625 -4.0625 2.4369 2.4369 2.6591 2.6591 3.5424 3.5424 3.6393 3.6393 5.0213 5.0213 5.2966 5.2966 5.4168 5.4168 5.7258 5.7258 5.7808 5.7808 5.9415 5.9415 6.2664 6.2664 6.5065 6.5065 7.3915 7.3915 7.5678 7.5678 8.1589 8.1589 8.2179 8.2179 8.5246 8.5246 8.5543 8.5543 8.7065 8.7065 8.7861 8.7861 8.9022 8.9022 9.2799 9.2799 9.3258 9.3258 10.1301 10.1301 10.3428 10.3428 k = 0.2235-0.8017 0.5984 ( 4412 PWs) bands (ev): -4.5215 -4.5215 -4.3958 -4.3958 -4.1048 -4.1048 -4.0491 -4.0491 2.4679 2.4679 2.6672 2.6672 3.5545 3.5545 3.6438 3.6438 5.0063 5.0063 5.2807 5.2807 5.4149 5.4149 5.7217 5.7217 5.8054 5.8054 5.9341 5.9341 6.2620 6.2620 6.5238 6.5238 7.4060 7.4060 7.5744 7.5744 8.1518 8.1518 8.2108 8.2108 8.5191 8.5191 8.5545 8.5545 8.6989 8.6989 8.8001 8.8001 8.9030 8.9030 9.2653 9.2653 9.3510 9.3510 10.0909 10.0909 10.3194 10.3194 k = 0.2179-0.7817 0.5984 ( 4410 PWs) bands (ev): -4.5381 -4.5381 -4.4265 -4.4265 -4.1011 -4.1011 -4.0369 -4.0369 2.5042 2.5042 2.6800 2.6800 3.5694 3.5694 3.6487 3.6487 4.9904 4.9904 5.2621 5.2621 5.4158 5.4158 5.7150 5.7150 5.8304 5.8304 5.9254 5.9254 6.2600 6.2600 6.5398 6.5398 7.4209 7.4209 7.5824 7.5824 8.1452 8.1452 8.2043 8.2043 8.5131 8.5131 8.5544 8.5544 8.6906 8.6906 8.8157 8.8157 8.9032 8.9032 9.2511 9.2511 9.3784 9.3784 10.0503 10.0503 10.2968 10.2968 k = 0.2123-0.7617 0.5984 ( 4416 PWs) bands (ev): -4.5563 -4.5563 -4.4591 -4.4591 -4.0984 -4.0984 -4.0260 -4.0260 2.5453 2.5453 2.6976 2.6976 3.5869 3.5869 3.6540 3.6540 4.9741 4.9741 5.2425 5.2425 5.4186 5.4186 5.7071 5.7071 5.8503 5.8503 5.9197 5.9197 6.2605 6.2605 6.5546 6.5546 7.4360 7.4360 7.5915 7.5915 8.1389 8.1389 8.1985 8.1985 8.5068 8.5068 8.5538 8.5538 8.6817 8.6817 8.8324 8.8324 8.9029 8.9029 9.2380 9.2380 9.4073 9.4073 10.0089 10.0089 10.2751 10.2751 k = 0.2067-0.7416 0.5984 ( 4412 PWs) bands (ev): -4.5759 -4.5759 -4.4933 -4.4933 -4.0968 -4.0968 -4.0165 -4.0165 2.5913 2.5913 2.7197 2.7197 3.6068 3.6068 3.6594 3.6594 4.9572 4.9572 5.2230 5.2230 5.4227 5.4227 5.6984 5.6984 5.8548 5.8548 5.9271 5.9271 6.2629 6.2629 6.5681 6.5681 7.4513 7.4513 7.6019 7.6019 8.1328 8.1328 8.1934 8.1934 8.5003 8.5003 8.5530 8.5530 8.6723 8.6723 8.8499 8.8499 8.9021 8.9021 9.2262 9.2262 9.4373 9.4373 9.9673 9.9673 10.2549 10.2549 k = 0.2011-0.7216 0.5984 ( 4416 PWs) bands (ev): -4.5967 -4.5967 -4.5286 -4.5286 -4.0965 -4.0965 -4.0084 -4.0084 2.6417 2.6417 2.7461 2.7461 3.6284 3.6284 3.6654 3.6654 4.9402 4.9402 5.2045 5.2045 5.4280 5.4280 5.6890 5.6890 5.8426 5.8426 5.9491 5.9491 6.2668 6.2668 6.5802 6.5802 7.4668 7.4668 7.6134 7.6134 8.1270 8.1270 8.1891 8.1891 8.4938 8.4938 8.5516 8.5516 8.6626 8.6626 8.8670 8.8670 8.9014 8.9014 9.2158 9.2158 9.4680 9.4680 9.9262 9.9262 10.2363 10.2363 k = 0.1955-0.7015 0.5984 ( 4412 PWs) bands (ev): -4.6187 -4.6187 -4.5650 -4.5650 -4.0975 -4.0975 -4.0018 -4.0018 2.6962 2.6962 2.7766 2.7766 3.6485 3.6485 3.6744 3.6744 4.9231 4.9231 5.1877 5.1877 5.4344 5.4344 5.6789 5.6789 5.8224 5.8224 5.9777 5.9777 6.2716 6.2716 6.5912 6.5912 7.4825 7.4825 7.6258 7.6258 8.1214 8.1214 8.1859 8.1859 8.4872 8.4872 8.5496 8.5496 8.6526 8.6526 8.8794 8.8794 8.9046 8.9046 9.2067 9.2067 9.4990 9.4990 9.8865 9.8865 10.2198 10.2198 k = 0.1900-0.6815 0.5984 ( 4412 PWs) bands (ev): -4.6417 -4.6417 -4.6020 -4.6020 -4.0998 -4.0998 -3.9965 -3.9965 2.7546 2.7546 2.8110 2.8110 3.6598 3.6598 3.6938 3.6938 4.9061 4.9061 5.1731 5.1731 5.4419 5.4419 5.6683 5.6683 5.7985 5.7985 6.0087 6.0087 6.2770 6.2770 6.6011 6.6011 7.4984 7.4984 7.6391 7.6391 8.1159 8.1159 8.1836 8.1836 8.4807 8.4807 8.5472 8.5472 8.6426 8.6426 8.8807 8.8807 8.9177 8.9177 9.1989 9.1989 9.5297 9.5297 9.8486 9.8486 10.2057 10.2057 k = 0.1844-0.6614 0.5984 ( 4412 PWs) bands (ev): -4.6655 -4.6655 -4.6396 -4.6396 -4.1035 -4.1035 -3.9927 -3.9927 2.8161 2.8161 2.8491 2.8491 3.6634 3.6634 3.7217 3.7217 4.8894 4.8894 5.1611 5.1611 5.4505 5.4505 5.6573 5.6573 5.7726 5.7726 6.0410 6.0410 6.2826 6.2826 6.6099 6.6099 7.5144 7.5144 7.6531 7.6531 8.1104 8.1104 8.1824 8.1824 8.4742 8.4742 8.5443 8.5443 8.6327 8.6327 8.8752 8.8752 8.9360 8.9360 9.1923 9.1923 9.5598 9.5598 9.8134 9.8134 10.1944 10.1944 k = 0.1788-0.6414 0.5984 ( 4412 PWs) bands (ev): -4.6900 -4.6900 -4.6776 -4.6776 -4.1084 -4.1084 -3.9903 -3.9903 2.8794 2.8794 2.8915 2.8915 3.6640 3.6640 3.7537 3.7537 4.8733 4.8733 5.1521 5.1521 5.4602 5.4602 5.6460 5.6460 5.7455 5.7455 6.0741 6.0741 6.2881 6.2881 6.6177 6.6177 7.5305 7.5305 7.6679 7.6679 8.1049 8.1049 8.1824 8.1824 8.4679 8.4679 8.5408 8.5408 8.6234 8.6234 8.8664 8.8664 8.9554 8.9554 9.1865 9.1865 9.5884 9.5884 9.7814 9.7814 10.1864 10.1864 k = 0.1732-0.6214 0.5984 ( 4410 PWs) bands (ev): -4.7163 -4.7163 -4.7147 -4.7147 -4.1145 -4.1145 -3.9891 -3.9891 2.9319 2.9319 2.9497 2.9497 3.6626 3.6626 3.7884 3.7884 4.8581 4.8581 5.1463 5.1463 5.4709 5.4709 5.6345 5.6345 5.7179 5.7179 6.1077 6.1077 6.2934 6.2934 6.6246 6.6246 7.5468 7.5468 7.6832 7.6832 8.0992 8.0992 8.1834 8.1834 8.4616 8.4616 8.5367 8.5367 8.6149 8.6149 8.8551 8.8551 8.9749 8.9749 9.1815 9.1815 9.6150 9.6150 9.7535 9.7535 10.1819 10.1819 k = 0.1676-0.6013 0.5984 ( 4418 PWs) bands (ev): -4.7542 -4.7542 -4.7406 -4.7406 -4.1218 -4.1218 -3.9892 -3.9892 2.9787 2.9787 3.0173 3.0173 3.6600 3.6600 3.8254 3.8254 4.8438 4.8438 5.1437 5.1437 5.4820 5.4820 5.6233 5.6233 5.6905 5.6905 6.1415 6.1415 6.2985 6.2985 6.6307 6.6307 7.5628 7.5628 7.6990 7.6990 8.0935 8.0935 8.1856 8.1856 8.4553 8.4553 8.5320 8.5320 8.6076 8.6076 8.8413 8.8413 8.9939 8.9939 9.1771 9.1771 9.6390 9.6390 9.7300 9.7300 10.1812 10.1812 k = 0.1620-0.5813 0.5984 ( 4420 PWs) bands (ev): -4.7924 -4.7924 -4.7666 -4.7666 -4.1300 -4.1300 -3.9905 -3.9905 3.0267 3.0267 3.0857 3.0857 3.6569 3.6569 3.8645 3.8645 4.8310 4.8310 5.1446 5.1446 5.4928 5.4928 5.6129 5.6129 5.6641 5.6641 6.1751 6.1751 6.3034 6.3034 6.6362 6.6362 7.5789 7.5789 7.7152 7.7152 8.0877 8.0877 8.1889 8.1889 8.4487 8.4487 8.5266 8.5266 8.6022 8.6022 8.8251 8.8251 9.0122 9.0122 9.1733 9.1733 9.6601 9.6601 9.7115 9.7115 10.1843 10.1843 k = 0.1564-0.5612 0.5984 ( 4422 PWs) bands (ev): -4.8304 -4.8304 -4.7928 -4.7928 -4.1392 -4.1392 -3.9929 -3.9929 3.0758 3.0758 3.1530 3.1530 3.6544 3.6544 3.9055 3.9055 4.8197 4.8197 5.1489 5.1489 5.5014 5.5014 5.6039 5.6039 5.6404 5.6404 6.2079 6.2079 6.3086 6.3086 6.6411 6.6411 7.5948 7.5948 7.7317 7.7317 8.0818 8.0818 8.1932 8.1932 8.4418 8.4418 8.5203 8.5203 8.5990 8.5990 8.8064 8.8064 9.0296 9.0296 9.1703 9.1703 9.6778 9.6778 9.6982 9.6982 10.1909 10.1909 k = 0.1508-0.5412 0.5984 ( 4414 PWs) bands (ev): -4.8680 -4.8680 -4.8190 -4.8190 -4.1492 -4.1492 -3.9963 -3.9963 3.1255 3.1255 3.2169 3.2169 3.6542 3.6542 3.9484 3.9484 4.8104 4.8104 5.1567 5.1567 5.5052 5.5052 5.5937 5.5937 5.6251 5.6251 6.2386 6.2386 6.3151 6.3151 6.6456 6.6456 7.6102 7.6102 7.7485 7.7485 8.0759 8.0759 8.1985 8.1985 8.4345 8.4345 8.5133 8.5133 8.5986 8.5986 8.7853 8.7853 9.0460 9.0460 9.1682 9.1682 9.6882 9.6882 9.6947 9.6947 10.2004 10.2004 k = 0.1453-0.5211 0.5984 ( 4420 PWs) bands (ev): -4.9052 -4.9052 -4.8453 -4.8453 -4.1599 -4.1599 -4.0005 -4.0005 3.1751 3.1751 3.2742 3.2742 3.6591 3.6591 3.9930 3.9930 4.8033 4.8033 5.1681 5.1681 5.5020 5.5020 5.5777 5.5777 5.6255 5.6255 6.2642 6.2642 6.3255 6.3255 6.6499 6.6499 7.6251 7.6251 7.7653 7.7653 8.0699 8.0699 8.2046 8.2046 8.4267 8.4267 8.5055 8.5055 8.6010 8.6010 8.7620 8.7620 9.0610 9.0610 9.1674 9.1674 9.6860 9.6860 9.7059 9.7059 10.2118 10.2118 k = 0.1397-0.5011 0.5984 ( 4422 PWs) bands (ev): -4.9418 -4.9418 -4.8715 -4.8715 -4.1712 -4.1712 -4.0057 -4.0057 3.2238 3.2238 3.3209 3.3209 3.6727 3.6727 4.0394 4.0394 4.7988 4.7988 5.1831 5.1831 5.4920 5.4920 5.5594 5.5594 5.6380 5.6380 6.2811 6.2811 6.3432 6.3432 6.6544 6.6544 7.6394 7.6394 7.7822 7.7822 8.0641 8.0641 8.2114 8.2114 8.4182 8.4182 8.4972 8.4972 8.6064 8.6064 8.7365 8.7365 9.0748 9.0748 9.1682 9.1682 9.6877 9.6877 9.7161 9.7161 10.2242 10.2242 k = 0.1341-0.4810 0.5984 ( 4426 PWs) bands (ev): -4.9777 -4.9777 -4.8974 -4.8974 -4.1831 -4.1831 -4.0115 -4.0115 3.2708 3.2708 3.3535 3.3535 3.6983 3.6983 4.0875 4.0875 4.7971 4.7971 5.2016 5.2016 5.4774 5.4774 5.5424 5.5424 5.6575 5.6575 6.2895 6.2895 6.3673 6.3673 6.6594 6.6594 7.6527 7.6527 7.7991 7.7991 8.0583 8.0583 8.2188 8.2188 8.4091 8.4091 8.4883 8.4883 8.6148 8.6148 8.7095 8.7095 9.0871 9.0871 9.1708 9.1708 9.6937 9.6937 9.7251 9.7251 10.2363 10.2363 k = 0.1285-0.4610 0.5984 ( 4422 PWs) bands (ev): -5.0128 -5.0128 -4.9231 -4.9231 -4.1953 -4.1953 -4.0180 -4.0180 3.3149 3.3149 3.3714 3.3714 3.7361 3.7361 4.1372 4.1372 4.7985 4.7985 5.2236 5.2236 5.4608 5.4608 5.5271 5.5271 5.6813 5.6813 6.2930 6.2930 6.3932 6.3932 6.6659 6.6659 7.6651 7.6651 7.8158 7.8158 8.0526 8.0526 8.2268 8.2268 8.3995 8.3995 8.4789 8.4789 8.6257 8.6257 8.6817 8.6817 9.0981 9.0981 9.1755 9.1755 9.7035 9.7035 9.7336 9.7336 10.2470 10.2470 k = 0.1229-0.4410 0.5984 ( 4418 PWs) bands (ev): -5.0471 -5.0471 -4.9483 -4.9483 -4.2078 -4.2078 -4.0249 -4.0249 3.3511 3.3511 3.3813 3.3813 3.7834 3.7834 4.1884 4.1884 4.8034 4.8034 5.2487 5.2487 5.4444 5.4444 5.5137 5.5137 5.7082 5.7082 6.2940 6.2940 6.4175 6.4175 6.6748 6.6748 7.6761 7.6761 7.8322 7.8322 8.0472 8.0472 8.2351 8.2351 8.3897 8.3897 8.4690 8.4690 8.6343 8.6343 8.6585 8.6585 9.1076 9.1076 9.1822 9.1822 9.7165 9.7165 9.7426 9.7426 10.2556 10.2556 k = 0.1173-0.4209 0.5984 ( 4422 PWs) bands (ev): -5.0804 -5.0804 -4.9731 -4.9731 -4.2205 -4.2205 -4.0323 -4.0323 3.3601 3.3601 3.4058 3.4058 3.8356 3.8356 4.2408 4.2408 4.8118 4.8118 5.2753 5.2753 5.4308 5.4308 5.5022 5.5022 5.7374 5.7374 6.2936 6.2936 6.4378 6.4378 6.6871 6.6871 7.6855 7.6855 7.8482 7.8482 8.0419 8.0419 8.2435 8.2435 8.3796 8.3796 8.4583 8.4583 8.6165 8.6165 8.6645 8.6645 9.1158 9.1158 9.1910 9.1910 9.7309 9.7309 9.7536 9.7536 10.2612 10.2612 k = 0.1117-0.4009 0.5984 ( 4418 PWs) bands (ev): -5.1127 -5.1127 -4.9972 -4.9972 -4.2333 -4.2333 -4.0401 -4.0401 3.3508 3.3508 3.4387 3.4387 3.8892 3.8892 4.2942 4.2942 4.8240 4.8240 5.2998 5.2998 5.4244 5.4244 5.4930 5.4930 5.7686 5.7686 6.2922 6.2922 6.4527 6.4527 6.7040 6.7040 7.6933 7.6933 7.8638 7.8638 8.0369 8.0369 8.2519 8.2519 8.3695 8.3695 8.4466 8.4466 8.5886 8.5886 8.6839 8.6839 9.1226 9.1226 9.2020 9.2020 9.7446 9.7446 9.7690 9.7690 10.2637 10.2637 k = 0.1062-0.3808 0.5984 ( 4420 PWs) bands (ev): -5.1439 -5.1439 -5.0207 -5.0207 -4.2460 -4.2460 -4.0481 -4.0481 3.3358 3.3358 3.4695 3.4695 3.9412 3.9412 4.3481 4.3481 4.8400 4.8400 5.3149 5.3149 5.4314 5.4314 5.4875 5.4875 5.8015 5.8015 6.2900 6.2900 6.4615 6.4615 6.7259 6.7259 7.6991 7.6991 7.8788 7.8788 8.0322 8.0322 8.2602 8.2602 8.3596 8.3596 8.4336 8.4336 8.5608 8.5608 8.7070 8.7070 9.1279 9.1279 9.2149 9.2149 9.7564 9.7564 9.7896 9.7896 10.2629 10.2629 k = 0.1006-0.3608 0.5984 ( 4424 PWs) bands (ev): -5.1738 -5.1738 -5.0434 -5.0434 -4.2587 -4.2587 -4.0562 -4.0562 3.3180 3.3180 3.4965 3.4965 3.9899 3.9899 4.4018 4.4018 4.8600 4.8600 5.3164 5.3164 5.4491 5.4491 5.4927 5.4927 5.8363 5.8363 6.2872 6.2872 6.4642 6.4642 6.7523 6.7523 7.7027 7.7027 7.8933 7.8933 8.0278 8.0278 8.2679 8.2679 8.3500 8.3500 8.4191 8.4191 8.5346 8.5346 8.7325 8.7325 9.1320 9.1320 9.2297 9.2297 9.7674 9.7674 9.8137 9.8137 10.2592 10.2592 k = 0.0950-0.3407 0.5984 ( 4412 PWs) bands (ev): -5.2025 -5.2025 -5.0653 -5.0653 -4.2712 -4.2712 -4.0644 -4.0644 3.2988 3.2988 3.5196 3.5196 4.0343 4.0343 4.4547 4.4547 4.8840 4.8840 5.3092 5.3092 5.4575 5.4575 5.5236 5.5236 5.8733 5.8733 6.2839 6.2839 6.4617 6.4617 6.7825 6.7825 7.7041 7.7041 7.9071 7.9071 8.0239 8.0239 8.2748 8.2748 8.3407 8.3407 8.4030 8.4030 8.5109 8.5109 8.7601 8.7601 9.1349 9.1349 9.2463 9.2463 9.7782 9.7782 9.8399 9.8399 10.2533 10.2533 k = 0.0894-0.3207 0.5984 ( 4410 PWs) bands (ev): -5.2299 -5.2299 -5.0864 -5.0864 -4.2834 -4.2834 -4.0726 -4.0726 3.2787 3.2787 3.5389 3.5389 4.0736 4.0736 4.5059 4.5059 4.9118 4.9118 5.2985 5.2985 5.4585 5.4585 5.5718 5.5718 5.9132 5.9132 6.2801 6.2801 6.4547 6.4547 6.8154 6.8154 7.7030 7.7030 7.9202 7.9202 8.0203 8.0203 8.2803 8.2803 8.3315 8.3315 8.3859 8.3859 8.4902 8.4902 8.7891 8.7891 9.1366 9.1366 9.2645 9.2645 9.7887 9.7887 9.8666 9.8666 10.2462 10.2462 k = 0.0838-0.3007 0.5984 ( 4416 PWs) bands (ev): -5.2559 -5.2559 -5.1064 -5.1064 -4.2952 -4.2952 -4.0807 -4.0807 3.2585 3.2585 3.5546 3.5546 4.1077 4.1077 4.5543 4.5543 4.9435 4.9435 5.2870 5.2870 5.4595 5.4595 5.6261 5.6261 5.9570 5.9570 6.2758 6.2758 6.4444 6.4444 6.8500 6.8500 7.6991 7.6991 7.9327 7.9327 8.0171 8.0171 8.2837 8.2837 8.3215 8.3215 8.3697 8.3697 8.4722 8.4722 8.8190 8.8190 9.1373 9.1373 9.2840 9.2840 9.7984 9.7984 9.8927 9.8927 10.2390 10.2390 k = 0.0782-0.2806 0.5984 ( 4412 PWs) bands (ev): -5.2804 -5.2804 -5.1255 -5.1255 -4.3067 -4.3067 -4.0886 -4.0886 3.2386 3.2386 3.5670 3.5670 4.1367 4.1367 4.5993 4.5993 4.9786 4.9786 5.2755 5.2755 5.4621 5.4621 5.6816 5.6816 6.0064 6.0064 6.2712 6.2712 6.4316 6.4316 6.8855 6.8855 7.6925 7.6925 7.9445 7.9445 8.0143 8.0143 8.2840 8.2840 8.3095 8.3095 8.3574 8.3574 8.4567 8.4567 8.8491 8.8491 9.1373 9.1373 9.3049 9.3049 9.8062 9.8062 9.9166 9.9166 10.2335 10.2335 k = 0.0726-0.2606 0.5984 ( 4406 PWs) bands (ev): -5.3035 -5.3035 -5.1435 -5.1435 -4.3176 -4.3176 -4.0963 -4.0963 3.2191 3.2191 3.5765 3.5765 4.1609 4.1609 4.6402 4.6402 5.0168 5.0168 5.2647 5.2647 5.4669 5.4669 5.7349 5.7349 6.0624 6.0624 6.2663 6.2663 6.4171 6.4171 6.9212 6.9212 7.6829 7.6829 7.9556 7.9556 8.0122 8.0122 8.2790 8.2790 8.2966 8.2966 8.3508 8.3508 8.4432 8.4432 8.8790 8.8790 9.1365 9.1365 9.3269 9.3269 9.8110 9.8110 9.9368 9.9368 10.2312 10.2312 k = 0.0670-0.2405 0.5984 ( 4404 PWs) bands (ev): -5.3250 -5.3250 -5.1603 -5.1603 -4.3280 -4.3280 -4.1036 -4.1036 3.2004 3.2004 3.5836 3.5836 4.1808 4.1808 4.6765 4.6765 5.0575 5.0575 5.2547 5.2547 5.4739 5.4739 5.7834 5.7834 6.1260 6.1260 6.2612 6.2612 6.4017 6.4017 6.9565 6.9565 7.6702 7.6702 7.9659 7.9659 8.0106 8.0106 8.2646 8.2646 8.2887 8.2887 8.3481 8.3481 8.4315 8.4315 8.9079 8.9079 9.1352 9.1352 9.3498 9.3498 9.8115 9.8115 9.9517 9.9517 10.2336 10.2336 k = 0.0615-0.2205 0.5984 ( 4412 PWs) bands (ev): -5.3449 -5.3449 -5.1760 -5.1760 -4.3377 -4.3377 -4.1106 -4.1106 3.1826 3.1826 3.5886 3.5886 4.1968 4.1968 4.7081 4.7081 5.0998 5.0998 5.2456 5.2456 5.4829 5.4829 5.8259 5.8259 6.1952 6.1952 6.2566 6.2566 6.3872 6.3872 6.9908 6.9908 7.6541 7.6541 7.9751 7.9751 8.0100 8.0100 8.2453 8.2453 8.2841 8.2841 8.3467 8.3467 8.4215 8.4215 8.9355 8.9355 9.1335 9.1335 9.3737 9.3737 9.8067 9.8067 9.9603 9.9603 10.2417 10.2417 k = 0.0559-0.2004 0.5984 ( 4406 PWs) bands (ev): -5.3633 -5.3633 -5.1905 -5.1905 -4.3468 -4.3468 -4.1172 -4.1172 3.1659 3.1659 3.5920 3.5920 4.2095 4.2095 4.7352 4.7352 5.1429 5.1429 5.2376 5.2376 5.4935 5.4935 5.8624 5.8624 6.2445 6.2445 6.2725 6.2725 6.3787 6.3787 7.0237 7.0237 7.6347 7.6347 7.9829 7.9829 8.0107 8.0107 8.2257 8.2257 8.2803 8.2803 8.3447 8.3447 8.4137 8.4137 8.9612 8.9612 9.1316 9.1316 9.3985 9.3985 9.7967 9.7967 9.9618 9.9618 10.2558 10.2558 k = 0.0503-0.1804 0.5984 ( 4406 PWs) bands (ev): -5.3800 -5.3800 -5.2037 -5.2037 -4.3552 -4.3552 -4.1233 -4.1233 3.1505 3.1505 3.5940 3.5940 4.2195 4.2195 4.7580 4.7580 5.1854 5.1854 5.2311 5.2311 5.5050 5.5050 5.8933 5.8933 6.2419 6.2419 6.3132 6.3132 6.4026 6.4026 7.0547 7.0547 7.6114 7.6114 7.9884 7.9884 8.0135 8.0135 8.2071 8.2071 8.2770 8.2770 8.3408 8.3408 8.4084 8.4084 8.9847 8.9847 9.1295 9.1295 9.4240 9.4240 9.7819 9.7819 9.9565 9.9565 10.2754 10.2754 k = 0.0447-0.1603 0.5984 ( 4404 PWs) bands (ev): -5.3950 -5.3950 -5.2156 -5.2156 -4.3628 -4.3628 -4.1289 -4.1289 3.1365 3.1365 3.5950 3.5950 4.2272 4.2272 4.7770 4.7770 5.2173 5.2173 5.2355 5.2355 5.5165 5.5165 5.9195 5.9195 6.2366 6.2366 6.3125 6.3125 6.4750 6.4750 7.0835 7.0835 7.5843 7.5843 7.9914 7.9914 8.0186 8.0186 8.1906 8.1906 8.2741 8.2741 8.3343 8.3343 8.4056 8.4056 9.0057 9.0057 9.1275 9.1275 9.4503 9.4503 9.7635 9.7635 9.9448 9.9448 10.2992 10.2992 k = 0.0391-0.1403 0.5984 ( 4398 PWs) bands (ev): -5.4083 -5.4083 -5.2261 -5.2261 -4.3696 -4.3696 -4.1339 -4.1339 3.1239 3.1239 3.5953 3.5953 4.2330 4.2330 4.7924 4.7924 5.2162 5.2162 5.2726 5.2726 5.5270 5.5270 5.9416 5.9416 6.2314 6.2314 6.3007 6.3007 6.5613 6.5613 7.1097 7.1097 7.5531 7.5531 7.9928 7.9928 8.0249 8.0249 8.1766 8.1766 8.2717 8.2717 8.3256 8.3256 8.4048 8.4048 9.0240 9.0240 9.1257 9.1257 9.4772 9.4772 9.7430 9.7430 9.9278 9.9278 10.3256 10.3256 k = 0.0335-0.1203 0.5984 ( 4402 PWs) bands (ev): -5.4199 -5.4199 -5.2354 -5.2354 -4.3756 -4.3756 -4.1383 -4.1383 3.1129 3.1129 3.5951 3.5951 4.2373 4.2373 4.8048 4.8048 5.2120 5.2120 5.3118 5.3118 5.5354 5.5354 5.9602 5.9602 6.2267 6.2267 6.2875 6.2875 6.6504 6.6504 7.1329 7.1329 7.5175 7.5175 7.9932 7.9932 8.0313 8.0313 8.1658 8.1658 8.2697 8.2697 8.3153 8.3153 8.4052 8.4052 9.0395 9.0395 9.1242 9.1242 9.5047 9.5047 9.7218 9.7218 9.9066 9.9066 10.3530 10.3530 k = 0.0279-0.1002 0.5984 ( 4404 PWs) bands (ev): -5.4297 -5.4297 -5.2432 -5.2432 -4.3807 -4.3807 -4.1421 -4.1421 3.1034 3.1034 3.5946 3.5946 4.2405 4.2405 4.8146 4.8146 5.2083 5.2083 5.3494 5.3494 5.5407 5.5407 5.9755 5.9755 6.2229 6.2229 6.2748 6.2748 6.7389 6.7389 7.1531 7.1531 7.4776 7.4776 7.9933 7.9933 8.0368 8.0368 8.1584 8.1584 8.2679 8.2679 8.3042 8.3042 8.4063 8.4063 9.0521 9.0521 9.1230 9.1230 9.5324 9.5324 9.7013 9.7013 9.8823 9.8823 10.3797 10.3797 k = 0.0223-0.0802 0.5984 ( 4398 PWs) bands (ev): -5.4378 -5.4378 -5.2497 -5.2497 -4.3849 -4.3849 -4.1453 -4.1453 3.0956 3.0956 3.5940 3.5940 4.2427 4.2427 4.8221 4.8221 5.2052 5.2052 5.3847 5.3847 5.5421 5.5421 5.9877 5.9877 6.2205 6.2205 6.2632 6.2632 6.8246 6.8246 7.1702 7.1702 7.4334 7.4334 7.9934 7.9934 8.0410 8.0410 8.1548 8.1548 8.2663 8.2663 8.2932 8.2932 8.4075 8.4075 9.0620 9.0620 9.1223 9.1223 9.5601 9.5601 9.6829 9.6829 9.8564 9.8564 10.4040 10.4040 k = 0.0168-0.0601 0.5984 ( 4402 PWs) bands (ev): -5.4441 -5.4441 -5.2547 -5.2547 -4.3882 -4.3882 -4.1477 -4.1477 3.0895 3.0895 3.5934 3.5934 4.2442 4.2442 4.8276 4.8276 5.2028 5.2028 5.4172 5.4172 5.5390 5.5390 5.9971 5.9971 6.2197 6.2197 6.2530 6.2530 6.9052 6.9052 7.1844 7.1844 7.3856 7.3856 7.9934 7.9934 8.0435 8.0435 8.1542 8.1542 8.2642 8.2642 8.2836 8.2836 8.4087 8.4087 9.0692 9.0692 9.1219 9.1219 9.5868 9.5868 9.6674 9.6674 9.8302 9.8302 10.4246 10.4246 k = 0.0112-0.0401 0.5984 ( 4404 PWs) bands (ev): -5.4486 -5.4486 -5.2583 -5.2583 -4.3906 -4.3906 -4.1495 -4.1495 3.0851 3.0851 3.5928 3.5928 4.2452 4.2452 4.8314 4.8314 5.2011 5.2011 5.4463 5.4463 5.5314 5.5314 6.0037 6.0037 6.2204 6.2204 6.2442 6.2442 6.9770 6.9770 7.1969 7.1969 7.3357 7.3357 7.9933 7.9933 8.0448 8.0448 8.1558 8.1558 8.2612 8.2612 8.2769 8.2769 8.4096 8.4096 9.0740 9.0740 9.1219 9.1219 9.6111 9.6111 9.6557 9.6557 9.8060 9.8060 10.4402 10.4402 k = 0.0056-0.0200 0.5984 ( 4402 PWs) bands (ev): -5.4513 -5.4513 -5.2605 -5.2605 -4.3920 -4.3920 -4.1506 -4.1506 3.0825 3.0825 3.5925 3.5925 4.2457 4.2457 4.8336 4.8336 5.2001 5.2001 5.4706 5.4706 5.5201 5.5201 6.0077 6.0077 6.2225 6.2225 6.2374 6.2374 7.0321 7.0321 7.2103 7.2103 7.2881 7.2881 7.9933 7.9933 8.0453 8.0453 8.1578 8.1578 8.2578 8.2578 8.2735 8.2735 8.4102 8.4102 9.0767 9.0767 9.1220 9.1220 9.6298 9.6298 9.6483 9.6483 9.7874 9.7874 10.4499 10.4499 k = 0.0000 0.0000 0.5984 ( 4404 PWs) bands (ev): -5.4522 -5.4522 -5.2612 -5.2612 -4.3925 -4.3925 -4.1509 -4.1509 3.0816 3.0816 3.5924 3.5924 4.2459 4.2459 4.8343 4.8343 5.1997 5.1997 5.4832 5.4832 5.5118 5.5118 6.0090 6.0090 6.2241 6.2241 6.2342 6.2342 7.0545 7.0545 7.2224 7.2224 7.2606 7.2606 7.9933 7.9933 8.0455 8.0455 8.1587 8.1587 8.2563 8.2563 8.2727 8.2727 8.4104 8.4104 9.0776 9.0776 9.1221 9.1221 9.6374 9.6374 9.6455 9.6455 9.7800 9.7800 10.4532 10.4532 k = 0.0000 0.0000 0.5984 ( 4404 PWs) bands (ev): -5.4522 -5.4522 -5.2612 -5.2612 -4.3925 -4.3925 -4.1509 -4.1509 3.0816 3.0816 3.5924 3.5924 4.2459 4.2459 4.8343 4.8343 5.1997 5.1997 5.4832 5.4832 5.5118 5.5118 6.0090 6.0090 6.2241 6.2241 6.2342 6.2342 7.0545 7.0545 7.2224 7.2224 7.2606 7.2606 7.9933 7.9933 8.0455 8.0455 8.1587 8.1587 8.2563 8.2563 8.2727 8.2727 8.4104 8.4104 9.0776 9.0776 9.1221 9.1221 9.6374 9.6374 9.6455 9.6455 9.7800 9.7800 10.4532 10.4532 k = 0.0197 0.0055 0.5984 ( 4400 PWs) bands (ev): -5.4513 -5.4513 -5.2604 -5.2604 -4.3986 -4.3986 -4.1468 -4.1468 3.0835 3.0835 3.5955 3.5955 4.2451 4.2451 4.8241 4.8241 5.2074 5.2074 5.4810 5.4810 5.5129 5.5129 6.0132 6.0132 6.2148 6.2148 6.2442 6.2442 7.0518 7.0518 7.2119 7.2119 7.2679 7.2679 7.9922 7.9922 8.0457 8.0457 8.1593 8.1593 8.2390 8.2390 8.2909 8.2909 8.4102 8.4102 9.0793 9.0793 9.1217 9.1217 9.5836 9.5836 9.6986 9.6986 9.7813 9.7813 10.4528 10.4528 k = 0.0395 0.0110 0.5984 ( 4407 PWs) bands (ev): -5.4488 -5.4488 -5.2582 -5.2582 -4.4158 -4.4158 -4.1355 -4.1355 3.0893 3.0893 3.6046 3.6046 4.2427 4.2427 4.7963 4.7963 5.2265 5.2265 5.4757 5.4757 5.5161 5.5161 6.0253 6.0253 6.2026 6.2026 6.2585 6.2585 7.0439 7.0439 7.1898 7.1898 7.2805 7.2805 7.9888 7.9888 8.0459 8.0459 8.1611 8.1611 8.2167 8.2167 8.3161 8.3161 8.4093 8.4093 9.0837 9.0837 9.1209 9.1209 9.5262 9.5262 9.7518 9.7518 9.7868 9.7868 10.4514 10.4514 k = 0.0592 0.0165 0.5984 ( 4404 PWs) bands (ev): -5.4446 -5.4446 -5.2544 -5.2544 -4.4416 -4.4416 -4.1197 -4.1197 3.0990 3.0990 3.6196 3.6196 4.2384 4.2384 4.7571 4.7571 5.2483 5.2483 5.4717 5.4717 5.5212 5.5212 6.0439 6.0439 6.1912 6.1912 6.2737 6.2737 7.0303 7.0303 7.1622 7.1622 7.2928 7.2928 7.9838 7.9838 8.0460 8.0460 8.1638 8.1638 8.1956 8.1956 8.3421 8.3421 8.4078 8.4078 9.0894 9.0894 9.1208 9.1208 9.4706 9.4706 9.7809 9.7809 9.8165 9.8165 10.4492 10.4492 k = 0.0789 0.0220 0.5984 ( 4412 PWs) bands (ev): -5.4387 -5.4387 -5.2492 -5.2492 -4.4734 -4.4734 -4.1016 -4.1016 3.1125 3.1125 3.6402 3.6402 4.2318 4.2318 4.7120 4.7120 5.2628 5.2628 5.4744 5.4744 5.5293 5.5293 6.0667 6.0667 6.1815 6.1815 6.2896 6.2896 7.0105 7.0105 7.1311 7.1311 7.3038 7.3038 7.9774 7.9774 8.0456 8.0456 8.1655 8.1655 8.1781 8.1781 8.3684 8.3684 8.4058 8.4058 9.0925 9.0925 9.1240 9.1240 9.4181 9.4181 9.7894 9.7894 9.8660 9.8660 10.4463 10.4463 k = 0.0987 0.0275 0.5984 ( 4403 PWs) bands (ev): -5.4312 -5.4312 -5.2424 -5.2424 -4.5096 -4.5096 -4.0829 -4.0829 3.1300 3.1300 3.6658 3.6658 4.2224 4.2224 4.6649 4.6649 5.2630 5.2630 5.4865 5.4865 5.5428 5.5428 6.0900 6.0900 6.1756 6.1756 6.3063 6.3063 6.9834 6.9834 7.0979 7.0979 7.3137 7.3137 7.9701 7.9701 8.0446 8.0446 8.1544 8.1544 8.1758 8.1758 8.3938 8.3938 8.4043 8.4043 9.0893 9.0893 9.1328 9.1328 9.3712 9.3712 9.7970 9.7970 9.9150 9.9150 10.4430 10.4430 k = 0.1184 0.0330 0.5984 ( 4407 PWs) bands (ev): -5.4220 -5.4220 -5.2343 -5.2343 -4.5489 -4.5489 -4.0647 -4.0647 3.1514 3.1514 3.6959 3.6959 4.2097 4.2097 4.6190 4.6190 5.2487 5.2487 5.5026 5.5026 5.5665 5.5665 6.1071 6.1071 6.1788 6.1788 6.3238 6.3238 6.9481 6.9481 7.0639 7.0639 7.3225 7.3225 7.9622 7.9622 8.0427 8.0427 8.1387 8.1387 8.1806 8.1806 8.3991 8.3991 8.4220 8.4220 9.0798 9.0798 9.1442 9.1442 9.3329 9.3329 9.8054 9.8054 9.9613 9.9613 10.4395 10.4395 k = 0.1382 0.0385 0.5984 ( 4405 PWs) bands (ev): -5.4113 -5.4113 -5.2247 -5.2247 -4.5906 -4.5906 -4.0476 -4.0476 3.1767 3.1767 3.7291 3.7291 4.1932 4.1932 4.5765 4.5765 5.2243 5.2243 5.5165 5.5165 5.6021 5.6021 6.1115 6.1115 6.1965 6.1965 6.3420 6.3420 6.9042 6.9042 7.0303 7.0303 7.3305 7.3305 7.9540 7.9540 8.0401 8.0401 8.1242 8.1242 8.1865 8.1865 8.3958 8.3958 8.4476 8.4476 9.0648 9.0648 9.1536 9.1536 9.3074 9.3074 9.8145 9.8145 10.0044 10.0044 10.4362 10.4362 k = 0.1579 0.0440 0.5984 ( 4405 PWs) bands (ev): -5.3990 -5.3990 -5.2137 -5.2137 -4.6340 -4.6340 -4.0320 -4.0320 3.2059 3.2059 3.7639 3.7639 4.1734 4.1734 4.5392 4.5392 5.1938 5.1938 5.5277 5.5277 5.6460 5.6460 6.1067 6.1067 6.2241 6.2241 6.3610 6.3610 6.8521 6.8521 6.9972 6.9972 7.3379 7.3379 7.9455 7.9455 8.0367 8.0367 8.1115 8.1115 8.1928 8.1928 8.3917 8.3917 8.4728 8.4728 9.0445 9.0445 9.1570 9.1570 9.2986 9.2986 9.8241 9.8241 10.0438 10.0438 10.4333 10.4333 k = 0.1776 0.0495 0.5984 ( 4405 PWs) bands (ev): -5.3853 -5.3853 -5.2013 -5.2013 -4.6788 -4.6788 -4.0182 -4.0182 3.2387 3.2387 3.7970 3.7970 4.1526 4.1526 4.5079 4.5079 5.1598 5.1598 5.5379 5.5379 5.6942 5.6942 6.0981 6.0981 6.2550 6.2550 6.3809 6.3809 6.7932 6.7932 6.9643 6.9643 7.3448 7.3448 7.9369 7.9369 8.0327 8.0327 8.1006 8.1006 8.1993 8.1993 8.3872 8.3872 8.4975 8.4975 9.0200 9.0200 9.1542 9.1542 9.3058 9.3058 9.8339 9.8339 10.0791 10.0791 10.4310 10.4310 k = 0.1974 0.0550 0.5984 ( 4403 PWs) bands (ev): -5.3703 -5.3703 -5.1877 -5.1877 -4.7244 -4.7244 -4.0062 -4.0062 3.2752 3.2752 3.8231 3.8231 4.1359 4.1359 4.4828 4.4828 5.1239 5.1239 5.5479 5.5479 5.7442 5.7442 6.0879 6.0879 6.2861 6.2861 6.4016 6.4016 6.7294 6.7294 6.9313 6.9313 7.3512 7.3512 7.9282 7.9282 8.0281 8.0281 8.0913 8.0913 8.2059 8.2059 8.3823 8.3823 8.5214 8.5214 8.9931 8.9931 9.1481 9.1481 9.3239 9.3239 9.8436 9.8436 10.1096 10.1096 10.4298 10.4298 k = 0.2171 0.0605 0.5984 ( 4397 PWs) bands (ev): -5.3541 -5.3541 -5.1728 -5.1728 -4.7705 -4.7705 -3.9962 -3.9962 3.3149 3.3149 3.8343 3.8343 4.1315 4.1315 4.4632 4.4632 5.0873 5.0873 5.5580 5.5580 5.7948 5.7948 6.0771 6.0771 6.3155 6.3155 6.4230 6.4230 6.6627 6.6627 6.8980 6.8980 7.3571 7.3571 7.9195 7.9195 8.0233 8.0233 8.0837 8.0837 8.2126 8.2126 8.3772 8.3772 8.5444 8.5444 8.9661 8.9661 9.1413 9.1413 9.3480 9.3480 9.8526 9.8526 10.1346 10.1346 10.4298 10.4298 k = 0.2368 0.0660 0.5984 ( 4397 PWs) bands (ev): -5.3368 -5.3368 -5.1569 -5.1569 -4.8165 -4.8165 -3.9881 -3.9881 3.3576 3.3576 3.8247 3.8247 4.1457 4.1457 4.4481 4.4481 5.0510 5.0510 5.5684 5.5684 5.8451 5.8451 6.0657 6.0657 6.3408 6.3408 6.4444 6.4444 6.5966 6.5966 6.8646 6.8646 7.3626 7.3626 7.9108 7.9108 8.0184 8.0184 8.0773 8.0773 8.2192 8.2192 8.3717 8.3717 8.5666 8.5666 8.9405 8.9405 9.1349 9.1349 9.3750 9.3750 9.8607 9.8607 10.1526 10.1526 10.4312 10.4312 k = 0.2566 0.0715 0.5984 ( 4403 PWs) bands (ev): -5.3189 -5.3189 -5.1400 -5.1400 -4.8620 -4.8620 -3.9820 -3.9820 3.4027 3.4027 3.7957 3.7957 4.1768 4.1768 4.4369 4.4369 5.0161 5.0161 5.5789 5.5789 5.8941 5.8941 6.0540 6.0540 6.3576 6.3576 6.4636 6.4636 6.5391 6.5391 6.8313 6.8313 7.3677 7.3677 7.9022 7.9022 8.0135 8.0135 8.0720 8.0720 8.2258 8.2258 8.3660 8.3660 8.5878 8.5878 8.9175 8.9175 9.1291 9.1291 9.4031 9.4031 9.8674 9.8674 10.1618 10.1618 10.4341 10.4341 k = 0.2763 0.0770 0.5984 ( 4398 PWs) bands (ev): -5.3008 -5.3008 -5.1224 -5.1224 -4.9059 -4.9059 -3.9778 -3.9778 3.4493 3.4493 3.7542 3.7542 4.2168 4.2168 4.4300 4.4300 4.9838 4.9838 5.5897 5.5897 5.9406 5.9406 6.0421 6.0421 6.3538 6.3538 6.4689 6.4689 6.5155 6.5155 6.7986 6.7986 7.3724 7.3724 7.8937 7.8937 8.0091 8.0091 8.0678 8.0678 8.2323 8.2323 8.3603 8.3603 8.6080 8.6080 8.8976 8.8976 9.1239 9.1239 9.4309 9.4309 9.8725 9.8725 10.1602 10.1602 10.4384 10.4384 k = 0.2961 0.0825 0.5984 ( 4392 PWs) bands (ev): -5.2834 -5.2834 -5.1049 -5.1049 -4.9467 -4.9467 -3.9754 -3.9754 3.4959 3.4959 3.7064 3.7064 4.2562 4.2562 4.4293 4.4293 4.9562 4.9562 5.6006 5.6006 5.9813 5.9813 6.0309 6.0309 6.3196 6.3196 6.4684 6.4684 6.5301 6.5301 6.7671 6.7671 7.3768 7.3768 7.8852 7.8852 8.0050 8.0050 8.0644 8.0644 8.2387 8.2387 8.3546 8.3546 8.6273 8.6273 8.8809 8.8809 9.1192 9.1192 9.4573 9.4573 9.8757 9.8757 10.1469 10.1469 10.4443 10.4443 k = 0.3158 0.0880 0.5984 ( 4398 PWs) bands (ev): -5.2684 -5.2684 -5.0891 -5.0891 -4.9809 -4.9809 -3.9747 -3.9747 3.5373 3.5373 3.6603 3.6603 4.2845 4.2845 4.4392 4.4392 4.9359 4.9359 5.6114 5.6114 6.0011 6.0011 6.0300 6.0300 6.2753 6.2753 6.4773 6.4773 6.5530 6.5530 6.7380 6.7380 7.3810 7.3810 7.8769 7.8769 8.0013 8.0013 8.0616 8.0616 8.2450 8.2450 8.3490 8.3490 8.6456 8.6456 8.8676 8.8676 9.1151 9.1151 9.4813 9.4813 9.8766 9.8766 10.1229 10.1229 10.4517 10.4517 k = 0.3355 0.0935 0.5984 ( 4399 PWs) bands (ev): -5.2587 -5.2587 -5.0789 -5.0789 -5.0017 -5.0017 -3.9757 -3.9757 3.5488 3.5488 3.6413 3.6413 4.2946 4.2946 4.4608 4.4608 4.9269 4.9269 5.6222 5.6222 5.9886 5.9886 6.0405 6.0405 6.2461 6.2461 6.4878 6.4878 6.5771 6.5771 6.7130 6.7130 7.3850 7.3850 7.8688 7.8688 7.9980 7.9980 8.0595 8.0595 8.2513 8.2513 8.3436 8.3436 8.6630 8.6630 8.8575 8.8575 9.1116 9.1116 9.5021 9.5021 9.8751 9.8751 10.0917 10.0917 10.4610 10.4610 k = 0.5000 0.1394-0.2694 ( 4418 PWs) bands (ev): -5.4708 -5.4708 -5.2346 -5.2346 -4.4476 -4.4476 -4.1067 -4.1067 2.6689 2.6689 4.1017 4.1017 4.8305 4.8305 4.8589 4.8589 4.9846 4.9846 5.3023 5.3023 5.6673 5.6673 6.0224 6.0224 6.2467 6.2467 6.3673 6.3673 6.6066 6.6066 6.8260 6.8260 7.2459 7.2459 7.9253 7.9253 8.0035 8.0035 8.1350 8.1350 8.2447 8.2447 8.3732 8.3732 8.3734 8.3734 8.5500 8.5500 8.9666 8.9666 9.7657 9.7657 10.1195 10.1195 10.5510 10.5510 10.7156 10.7156 k = 0.5056 0.1192-0.2694 ( 4414 PWs) bands (ev): -5.4699 -5.4699 -5.2339 -5.2339 -4.4471 -4.4471 -4.1064 -4.1064 2.6698 2.6698 4.1016 4.1016 4.8309 4.8309 4.8583 4.8583 4.9844 4.9844 5.3005 5.3005 5.6669 5.6669 6.0233 6.0233 6.2460 6.2460 6.3533 6.3533 6.6060 6.6060 6.8241 6.8241 7.2576 7.2576 7.9240 7.9240 8.0048 8.0048 8.1347 8.1347 8.2452 8.2452 8.3720 8.3720 8.3751 8.3751 8.5511 8.5511 8.9668 8.9668 9.7649 9.7649 10.1167 10.1167 10.5477 10.5477 10.7124 10.7124 k = 0.5113 0.0989-0.2694 ( 4404 PWs) bands (ev): -5.4671 -5.4671 -5.2316 -5.2316 -4.4455 -4.4455 -4.1056 -4.1056 2.6726 2.6726 4.1011 4.1011 4.8319 4.8319 4.8562 4.8562 4.9839 4.9839 5.2951 5.2951 5.6654 5.6654 6.0258 6.0258 6.2428 6.2428 6.3149 6.3149 6.6042 6.6042 6.8182 6.8182 7.2901 7.2901 7.9206 7.9206 8.0085 8.0085 8.1336 8.1336 8.2466 8.2466 8.3704 8.3704 8.3781 8.3781 8.5546 8.5546 8.9673 8.9673 9.7625 9.7625 10.1083 10.1083 10.5378 10.5378 10.7034 10.7034 k = 0.5169 0.0787-0.2694 ( 4404 PWs) bands (ev): -5.4626 -5.4626 -5.2279 -5.2279 -4.4429 -4.4429 -4.1041 -4.1041 2.6772 2.6772 4.1002 4.1002 4.8335 4.8335 4.8526 4.8526 4.9831 4.9831 5.2864 5.2864 5.6630 5.6630 6.0290 6.0290 6.2263 6.2263 6.2699 6.2699 6.6009 6.6009 6.8082 6.8082 7.3382 7.3382 7.9152 7.9152 8.0141 8.0141 8.1317 8.1317 8.2489 8.2489 8.3682 8.3682 8.3826 8.3826 8.5603 8.5603 8.9682 8.9682 9.7582 9.7582 10.0944 10.0944 10.5209 10.5209 10.6901 10.6901 k = 0.5225 0.0585-0.2694 ( 4414 PWs) bands (ev): -5.4562 -5.4562 -5.2228 -5.2228 -4.4393 -4.4393 -4.1021 -4.1021 2.6836 2.6836 4.0990 4.0990 4.8354 4.8354 4.8473 4.8473 4.9821 4.9821 5.2747 5.2747 5.6596 5.6596 6.0295 6.0295 6.1695 6.1695 6.2542 6.2542 6.5959 6.5959 6.7941 6.7941 7.3961 7.3961 7.9087 7.9087 8.0213 8.0213 8.1291 8.1291 8.2521 8.2521 8.3651 8.3651 8.3887 8.3887 8.5683 8.5683 8.9693 8.9693 9.7521 9.7521 10.0756 10.0756 10.4969 10.4969 10.6740 10.6740 k = 0.5282 0.0383-0.2694 ( 4420 PWs) bands (ev): -5.4480 -5.4480 -5.2161 -5.2161 -4.4347 -4.4347 -4.0995 -4.0995 2.6918 2.6918 4.0975 4.0975 4.8357 4.8357 4.8417 4.8417 4.9807 4.9807 5.2603 5.2603 5.6555 5.6555 6.0125 6.0125 6.1102 6.1102 6.2497 6.2497 6.5892 6.5892 6.7764 6.7764 7.4591 7.4591 7.9014 7.9014 8.0299 8.0299 8.1258 8.1258 8.2558 8.2558 8.3612 8.3612 8.3964 8.3964 8.5785 8.5785 8.9708 8.9708 9.7438 9.7438 10.0522 10.0522 10.4662 10.4662 10.6556 10.6556 k = 0.5338 0.0181-0.2694 ( 4420 PWs) bands (ev): -5.4381 -5.4381 -5.2080 -5.2080 -4.4291 -4.4291 -4.0964 -4.0964 2.7017 2.7017 4.0955 4.0955 4.8276 4.8276 4.8418 4.8418 4.9793 4.9793 5.2438 5.2438 5.6504 5.6504 5.9497 5.9497 6.0903 6.0903 6.2465 6.2465 6.5806 6.5806 6.7555 6.7555 7.5236 7.5236 7.8937 7.8937 8.0399 8.0399 8.1218 8.1218 8.2602 8.2602 8.3566 8.3566 8.4057 8.4057 8.5910 8.5910 8.9725 8.9725 9.7330 9.7330 10.0247 10.0247 10.4301 10.4301 10.6343 10.6343 k = 0.5394-0.0021-0.2694 ( 4420 PWs) bands (ev): -5.4264 -5.4264 -5.1985 -5.1985 -4.4224 -4.4224 -4.0929 -4.0929 2.7133 2.7133 4.0931 4.0931 4.8142 4.8142 4.8436 4.8436 4.9779 4.9779 5.2255 5.2255 5.6444 5.6444 5.8608 5.8608 6.0938 6.0938 6.2432 6.2432 6.5701 6.5701 6.7321 6.7321 7.5868 7.5868 7.8860 7.8860 8.0513 8.0513 8.1171 8.1171 8.2649 8.2649 8.3513 8.3513 8.4162 8.4162 8.6057 8.6057 8.9746 8.9746 9.7195 9.7195 9.9937 9.9937 10.3901 10.3901 10.6085 10.6085 k = 0.5451-0.0223-0.2694 ( 4412 PWs) bands (ev): -5.4129 -5.4129 -5.1876 -5.1876 -4.4149 -4.4149 -4.0890 -4.0890 2.7266 2.7266 4.0902 4.0902 4.7965 4.7965 4.8447 4.8447 4.9767 4.9767 5.2058 5.2058 5.6372 5.6372 5.7662 5.7662 6.1035 6.1035 6.2394 6.2394 6.5577 6.5577 6.7067 6.7067 7.6465 7.6465 7.8791 7.8791 8.0643 8.0643 8.1121 8.1121 8.2698 8.2698 8.3453 8.3453 8.4279 8.4279 8.6228 8.6228 8.9770 8.9770 9.7029 9.7029 9.9597 9.9597 10.3478 10.3478 10.5747 10.5747 k = 0.5507-0.0425-0.2694 ( 4410 PWs) bands (ev): -5.3977 -5.3977 -5.1753 -5.1753 -4.4064 -4.4064 -4.0847 -4.0847 2.7414 2.7414 4.0867 4.0867 4.7740 4.7740 4.8443 4.8443 4.9762 4.9762 5.1847 5.1847 5.6246 5.6246 5.6760 5.6760 6.1151 6.1151 6.2351 6.2351 6.5433 6.5433 6.6801 6.6801 7.7001 7.7001 7.8738 7.8738 8.0787 8.0787 8.1072 8.1072 8.2747 8.2747 8.3389 8.3389 8.4403 8.4403 8.6421 8.6421 8.9797 8.9797 9.6827 9.6827 9.9233 9.9233 10.3050 10.3050 10.5291 10.5291 k = 0.5563-0.0627-0.2694 ( 4404 PWs) bands (ev): -5.3809 -5.3809 -5.1617 -5.1617 -4.3970 -4.3970 -4.0801 -4.0801 2.7576 2.7576 4.0827 4.0827 4.7461 4.7461 4.8416 4.8416 4.9765 4.9765 5.1620 5.1620 5.5675 5.5675 5.6332 5.6332 6.1268 6.1268 6.2305 6.2305 6.5270 6.5270 6.6529 6.6529 7.7445 7.7445 7.8727 7.8727 8.0911 8.0911 8.1061 8.1061 8.2792 8.2792 8.3323 8.3323 8.4532 8.4532 8.6638 8.6638 8.9827 8.9827 9.6587 9.6587 9.8848 9.8848 10.2630 10.2630 10.4694 10.4694 k = 0.5620-0.0830-0.2694 ( 4406 PWs) bands (ev): -5.3623 -5.3623 -5.1468 -5.1468 -4.3867 -4.3867 -4.0754 -4.0754 2.7752 2.7752 4.0781 4.0781 4.7120 4.7120 4.8358 4.8358 4.9779 4.9779 5.1367 5.1367 5.4848 5.4848 5.6223 5.6223 6.1371 6.1371 6.2263 6.2263 6.5089 6.5089 6.6256 6.6256 7.7744 7.7744 7.8799 7.8799 8.0903 8.0903 8.1207 8.1207 8.2828 8.2828 8.3262 8.3262 8.4665 8.4665 8.6878 8.6878 8.9859 8.9859 9.6307 9.6307 9.8447 9.8447 10.2230 10.2230 10.3973 10.3973 k = 0.5676-0.1032-0.2694 ( 4408 PWs) bands (ev): -5.3421 -5.3421 -5.1306 -5.1306 -4.3756 -4.3756 -4.0704 -4.0704 2.7940 2.7940 4.0728 4.0728 4.6714 4.6714 4.8262 4.8262 4.9798 4.9798 5.1074 5.1074 5.4097 5.4097 5.6139 5.6139 6.1440 6.1440 6.2240 6.2240 6.4896 6.4896 6.5986 6.5986 7.7872 7.7872 7.8979 7.8979 8.0845 8.0845 8.1426 8.1426 8.2847 8.2847 8.3215 8.3215 8.4798 8.4798 8.7140 8.7140 8.9894 8.9894 9.5988 9.5988 9.8033 9.8033 10.1853 10.1853 10.3175 10.3175 k = 0.5732-0.1234-0.2694 ( 4410 PWs) bands (ev): -5.3204 -5.3204 -5.1131 -5.1131 -4.3637 -4.3637 -4.0655 -4.0655 2.8139 2.8139 4.0667 4.0667 4.6240 4.6240 4.8123 4.8123 4.9798 4.9798 5.0743 5.0743 5.3479 5.3479 5.6058 5.6058 6.1454 6.1454 6.2253 6.2253 6.4694 6.4694 6.5719 6.5719 7.7877 7.7877 7.9217 7.9217 8.0782 8.0782 8.1670 8.1670 8.2840 8.2840 8.3195 8.3195 8.4931 8.4931 8.7424 8.7424 8.9931 8.9931 9.5632 9.5632 9.7611 9.7611 10.1496 10.1496 10.2352 10.2352 k = 0.5789-0.1436-0.2694 ( 4416 PWs) bands (ev): -5.2971 -5.2971 -5.0945 -5.0945 -4.3511 -4.3511 -4.0605 -4.0605 2.8346 2.8346 4.0597 4.0597 4.5698 4.5698 4.7940 4.7940 4.9694 4.9694 5.0451 5.0451 5.3012 5.3012 5.5979 5.5979 6.1406 6.1406 6.2305 6.2305 6.4491 6.4491 6.5456 6.5456 7.7823 7.7823 7.9456 7.9456 8.0716 8.0716 8.1920 8.1920 8.2808 8.2808 8.3209 8.3209 8.5062 8.5062 8.7730 8.7730 8.9970 8.9970 9.5244 9.5244 9.7181 9.7181 10.1104 10.1104 10.1590 10.1590 k = 0.5845-0.1638-0.2694 ( 4416 PWs) bands (ev): -5.2722 -5.2722 -5.0747 -5.0747 -4.3377 -4.3377 -4.0558 -4.0558 2.8560 2.8560 4.0518 4.0518 4.5096 4.5096 4.7709 4.7709 4.9356 4.9356 5.0345 5.0345 5.2681 5.2681 5.5902 5.5902 6.1310 6.1310 6.2382 6.2382 6.4294 6.4294 6.5195 6.5195 7.7740 7.7740 7.9672 7.9672 8.0651 8.0651 8.2146 8.2146 8.2777 8.2777 8.3252 8.3252 8.5190 8.5190 8.8055 8.8055 9.0013 9.0013 9.4832 9.4832 9.6748 9.6748 10.0481 10.0481 10.1104 10.1104 k = 0.5901-0.1840-0.2694 ( 4420 PWs) bands (ev): -5.2459 -5.2459 -5.0539 -5.0539 -4.3237 -4.3237 -4.0512 -4.0512 2.8777 2.8777 4.0428 4.0428 4.4442 4.4442 4.7430 4.7430 4.8860 4.8860 5.0379 5.0379 5.2452 5.2452 5.5826 5.5826 6.1184 6.1184 6.2461 6.2461 6.4108 6.4108 6.4937 6.4937 7.7642 7.7642 7.9862 7.9862 8.0589 8.0589 8.2290 8.2290 8.2792 8.2792 8.3325 8.3325 8.5315 8.5315 8.8398 8.8398 9.0057 9.0057 9.4403 9.4403 9.6311 9.6311 9.9711 9.9711 10.0820 10.0820 k = 0.5958-0.2042-0.2694 ( 4418 PWs) bands (ev): -5.2182 -5.2182 -5.0320 -5.0320 -4.3091 -4.3091 -4.0471 -4.0471 2.8995 2.8995 4.0327 4.0327 4.3752 4.3752 4.7103 4.7103 4.8321 4.8321 5.0466 5.0466 5.2289 5.2289 5.5753 5.5753 6.1045 6.1045 6.2521 6.2521 6.3941 6.3941 6.4684 6.4684 7.7535 7.7535 8.0027 8.0027 8.0531 8.0531 8.2313 8.2313 8.2876 8.2876 8.3438 8.3438 8.5436 8.5436 8.8757 8.8757 9.0105 9.0105 9.3965 9.3965 9.5874 9.5874 9.8942 9.8942 10.0596 10.0596 k = 0.6014-0.2244-0.2694 ( 4408 PWs) bands (ev): -5.1892 -5.1892 -5.0092 -5.0092 -4.2939 -4.2939 -4.0434 -4.0434 2.9209 2.9209 4.0211 4.0211 4.3044 4.3044 4.6730 4.6730 4.7784 4.7784 5.0574 5.0574 5.2168 5.2168 5.5683 5.5683 6.0905 6.0905 6.2541 6.2541 6.3798 6.3798 6.4444 6.4444 7.7421 7.7421 8.0163 8.0163 8.0486 8.0486 8.2261 8.2261 8.2970 8.2970 8.3597 8.3597 8.5555 8.5555 8.9129 8.9129 9.0155 9.0155 9.3524 9.3524 9.5437 9.5437 9.8208 9.8208 10.0402 10.0402 k = 0.6070-0.2446-0.2694 ( 4406 PWs) bands (ev): -5.1589 -5.1589 -4.9855 -4.9855 -4.2782 -4.2782 -4.0403 -4.0403 2.9414 2.9414 4.0078 4.0078 4.2337 4.2337 4.6316 4.6316 4.7260 4.7260 5.0690 5.0690 5.2073 5.2073 5.5617 5.5617 6.0771 6.0771 6.2501 6.2501 6.3668 6.3668 6.4235 6.4235 7.7303 7.7303 8.0249 8.0249 8.0478 8.0478 8.2182 8.2182 8.3038 8.3038 8.3786 8.3786 8.5670 8.5670 8.9511 8.9511 9.0208 9.0208 9.3087 9.3087 9.5001 9.5001 9.7520 9.7520 10.0230 10.0230 k = 0.6127-0.2649-0.2694 ( 4403 PWs) bands (ev): -5.1273 -5.1273 -4.9610 -4.9610 -4.2621 -4.2621 -4.0379 -4.0379 2.9605 2.9605 3.9924 3.9924 4.1652 4.1652 4.5870 4.5870 4.6751 4.6751 5.0809 5.0809 5.1994 5.1994 5.5555 5.5555 6.0652 6.0652 6.2395 6.2395 6.3515 6.3515 6.4095 6.4095 7.7181 7.7181 8.0253 8.0253 8.0542 8.0542 8.2096 8.2096 8.3079 8.3079 8.3982 8.3982 8.5780 8.5780 8.9895 8.9895 9.0264 9.0264 9.2659 9.2659 9.4569 9.4569 9.6887 9.6887 10.0076 10.0076 k = 0.6183-0.2851-0.2694 ( 4399 PWs) bands (ev): -5.0947 -5.0947 -4.9358 -4.9358 -4.2457 -4.2457 -4.0364 -4.0364 2.9776 2.9776 3.9738 3.9738 4.1013 4.1013 4.5405 4.5405 4.6252 4.6252 5.0924 5.0924 5.1926 5.1926 5.5498 5.5498 6.0550 6.0550 6.2230 6.2230 6.3307 6.3307 6.4044 6.4044 7.7056 7.7056 8.0211 8.0211 8.0642 8.0642 8.2010 8.2010 8.3104 8.3104 8.4168 8.4168 8.5887 8.5887 9.0245 9.0245 9.0352 9.0352 9.2244 9.2244 9.4143 9.4143 9.6315 9.6315 9.9938 9.9938 k = 0.6239-0.3053-0.2694 ( 4393 PWs) bands (ev): -5.0609 -5.0609 -4.9099 -4.9099 -4.2290 -4.2290 -4.0358 -4.0358 2.9919 2.9919 3.9506 3.9506 4.0449 4.0449 4.4931 4.4931 4.5761 4.5761 5.1027 5.1027 5.1870 5.1870 5.5447 5.5447 6.0467 6.0467 6.2018 6.2018 6.3057 6.3057 6.4055 6.4055 7.6929 7.6929 8.0156 8.0156 8.0749 8.0749 8.1930 8.1930 8.3117 8.3117 8.4336 8.4336 8.5990 8.5990 9.0349 9.0349 9.0673 9.0673 9.1846 9.1846 9.3726 9.3726 9.5814 9.5814 9.9814 9.9814 k = 0.6296-0.3255-0.2694 ( 4395 PWs) bands (ev): -5.0261 -5.0261 -4.8835 -4.8835 -4.2120 -4.2120 -4.0363 -4.0363 3.0027 3.0027 3.9208 3.9208 3.9989 3.9989 4.4456 4.4456 4.5279 4.5279 5.1104 5.1104 5.1830 5.1830 5.5403 5.5403 6.0400 6.0400 6.1769 6.1769 6.2785 6.2785 6.4092 6.4092 7.6801 7.6801 8.0094 8.0094 8.0855 8.0855 8.1861 8.1861 8.3121 8.3121 8.4483 8.4483 8.6086 8.6086 9.0396 9.0396 9.1013 9.1013 9.1474 9.1474 9.3324 9.3324 9.5397 9.5397 9.9705 9.9705 k = 0.6352-0.3457-0.2694 ( 4399 PWs) bands (ev): -4.9905 -4.9905 -4.8566 -4.8566 -4.1949 -4.1949 -4.0381 -4.0381 3.0093 3.0093 3.8855 3.8855 3.9629 3.9629 4.3987 4.3987 4.4811 4.4811 5.1140 5.1140 5.1819 5.1819 5.5366 5.5366 6.0343 6.0343 6.1492 6.1492 6.2508 6.2508 6.4135 6.4135 7.6672 7.6672 8.0027 8.0027 8.0956 8.0956 8.1804 8.1804 8.3117 8.3117 8.4607 8.4607 8.6177 8.6177 9.0422 9.0422 9.1098 9.1098 9.1335 9.1335 9.2947 9.2947 9.5081 9.5081 9.9612 9.9612 k = 0.6408-0.3659-0.2694 ( 4395 PWs) bands (ev): -4.9540 -4.9540 -4.8294 -4.8294 -4.1777 -4.1777 -4.0411 -4.0411 3.0112 3.0112 3.8495 3.8495 3.9325 3.9325 4.3529 4.3529 4.4367 4.4367 5.1120 5.1120 5.1847 5.1847 5.5338 5.5338 6.0284 6.0284 6.1194 6.1194 6.2238 6.2238 6.4173 6.4173 7.6544 7.6544 7.9956 7.9956 8.1053 8.1053 8.1763 8.1763 8.3108 8.3108 8.4709 8.4709 8.6260 8.6260 9.0395 9.0395 9.0829 9.0829 9.1518 9.1518 9.2614 9.2614 9.4895 9.4895 9.9537 9.9537 k = 0.6465-0.3861-0.2694 ( 4395 PWs) bands (ev): -4.9168 -4.9168 -4.8019 -4.8019 -4.1605 -4.1605 -4.0456 -4.0456 3.0081 3.0081 3.8168 3.8168 3.9034 3.9034 4.3085 4.3085 4.3959 4.3959 5.1045 5.1045 5.1907 5.1907 5.5319 5.5319 6.0200 6.0200 6.0880 6.0880 6.1994 6.1994 6.4197 6.4197 7.6417 7.6417 7.9879 7.9879 8.1143 8.1143 8.1742 8.1742 8.3095 8.3095 8.4790 8.4790 8.6337 8.6337 9.0236 9.0236 9.0688 9.0688 9.1551 9.1551 9.2362 9.2362 9.4864 9.4864 9.9481 9.9481 k = 0.6521-0.4063-0.2694 ( 4393 PWs) bands (ev): -4.8790 -4.8790 -4.7744 -4.7744 -4.1434 -4.1434 -4.0516 -4.0516 3.0004 3.0004 3.7889 3.7889 3.8733 3.8733 4.2660 4.2660 4.3601 4.3601 5.0927 5.0927 5.1987 5.1987 5.5311 5.5311 6.0058 6.0058 6.0560 6.0560 6.1801 6.1801 6.4203 6.4203 7.6292 7.6292 7.9799 7.9799 8.1227 8.1227 8.1741 8.1741 8.3079 8.3079 8.4853 8.4853 8.6405 8.6405 8.9979 8.9979 9.0648 9.0648 9.1408 9.1408 9.2205 9.2205 9.4995 9.4995 9.9446 9.9446 k = 0.6577-0.4265-0.2694 ( 4387 PWs) bands (ev): -4.8406 -4.8406 -4.7469 -4.7469 -4.1265 -4.1265 -4.0592 -4.0592 2.9886 2.9886 3.7655 3.7655 3.8412 3.8412 4.2259 4.2259 4.3303 4.3303 5.0774 5.0774 5.2072 5.2072 5.5313 5.5313 5.9828 5.9828 6.0237 6.0237 6.1683 6.1683 6.4186 6.4186 7.6170 7.6170 7.9714 7.9714 8.1305 8.1305 8.1762 8.1762 8.3061 8.3061 8.4901 8.4901 8.6464 8.6464 8.9707 8.9707 9.0619 9.0619 9.1174 9.1174 9.2091 9.2091 9.5264 9.5264 9.9430 9.9430 k = 0.6634-0.4468-0.2694 ( 4387 PWs) bands (ev): -4.8019 -4.8019 -4.7196 -4.7196 -4.1099 -4.1099 -4.0684 -4.0684 2.9738 2.9738 3.7454 3.7454 3.8066 3.8066 4.1888 4.1888 4.3076 4.3076 5.0591 5.0591 5.2156 5.2156 5.5326 5.5326 5.9516 5.9516 5.9900 5.9900 6.1649 6.1649 6.4143 6.4143 7.6051 7.6051 7.9624 7.9624 8.1379 8.1379 8.1801 8.1801 8.3045 8.3045 8.4935 8.4935 8.6513 8.6513 8.9445 8.9445 9.0545 9.0545 9.0951 9.0951 9.1981 9.1981 9.5633 9.5633 9.9431 9.9431 k = 0.6690-0.4670-0.2694 ( 4385 PWs) bands (ev): -4.7628 -4.7628 -4.6927 -4.6927 -4.0937 -4.0937 -4.0791 -4.0791 2.9570 2.9570 3.7271 3.7271 3.7696 3.7696 4.1552 4.1552 4.2929 4.2929 5.0382 5.0382 5.2233 5.2233 5.5351 5.5351 5.9152 5.9152 5.9533 5.9533 6.1687 6.1687 6.4074 6.4074 7.5935 7.5935 7.9531 7.9531 8.1452 8.1452 8.1855 8.1855 8.3032 8.3032 8.4959 8.4959 8.6550 8.6550 8.9201 8.9201 9.0381 9.0381 9.0813 9.0813 9.1879 9.1879 9.6070 9.6070 9.9448 9.9448 k = 0.6746-0.4872-0.2694 ( 4387 PWs) bands (ev): -4.7236 -4.7236 -4.6664 -4.6664 -4.0921 -4.0921 -4.0772 -4.0772 2.9397 2.9397 3.7083 3.7083 3.7314 3.7314 4.1255 4.1255 4.2863 4.2863 5.0146 5.0146 5.2296 5.2296 5.5385 5.5385 5.8760 5.8760 5.9133 5.9133 6.1777 6.1777 6.3975 6.3975 7.5824 7.5824 7.9436 7.9436 8.1526 8.1526 8.1918 8.1918 8.3026 8.3026 8.4975 8.4975 8.6574 8.6574 8.8977 8.8977 9.0153 9.0153 9.0745 9.0745 9.1791 9.1791 9.6551 9.6551 9.9476 9.9476 k = 0.6803-0.5074-0.2694 ( 4389 PWs) bands (ev): -4.6843 -4.6843 -4.6409 -4.6409 -4.1060 -4.1060 -4.0619 -4.0619 2.9230 2.9230 3.6812 3.6812 3.6994 3.6994 4.0998 4.0998 4.2878 4.2878 4.9885 4.9885 5.2343 5.2343 5.5425 5.5425 5.8359 5.8359 5.8703 5.8703 6.1903 6.1903 6.3848 6.3848 7.5717 7.5717 7.9339 7.9339 8.1605 8.1605 8.1988 8.1988 8.3029 8.3029 8.4986 8.4986 8.6582 8.6582 8.8774 8.8774 8.9919 8.9919 9.0698 9.0698 9.1726 9.1726 9.7061 9.7061 9.9510 9.9510 k = 0.6859-0.5276-0.2694 ( 4389 PWs) bands (ev): -4.6451 -4.6451 -4.6165 -4.6165 -4.1215 -4.1215 -4.0470 -4.0470 2.9080 2.9080 3.6414 3.6414 3.6783 3.6783 4.0780 4.0780 4.2970 4.2970 4.9599 4.9599 5.2365 5.2365 5.5465 5.5465 5.7964 5.7964 5.8252 5.8252 6.2055 6.2055 6.3692 6.3692 7.5614 7.5614 7.9242 7.9242 8.1686 8.1686 8.2062 8.2062 8.3047 8.3047 8.4993 8.4993 8.6572 8.6572 8.8591 8.8591 8.9705 8.9705 9.0654 9.0654 9.1686 9.1686 9.7591 9.7591 9.9545 9.9545 k = 0.6915-0.5478-0.2694 ( 4393 PWs) bands (ev): -4.6062 -4.6062 -4.5936 -4.5936 -4.1381 -4.1381 -4.0327 -4.0327 2.8953 2.8953 3.5988 3.5988 3.6592 3.6592 4.0599 4.0599 4.3129 4.3129 4.9289 4.9289 5.2354 5.2354 5.5496 5.5496 5.7595 5.7595 5.7787 5.7787 6.2223 6.2223 6.3510 6.3510 7.5515 7.5515 7.9144 7.9144 8.1768 8.1768 8.2142 8.2142 8.3078 8.3078 8.4998 8.4998 8.6542 8.6542 8.8430 8.8430 8.9519 8.9519 9.0610 9.0610 9.1673 9.1673 9.8134 9.8134 9.9579 9.9579 k = 0.6972-0.5680-0.2694 ( 4387 PWs) bands (ev): -4.5729 -4.5729 -4.5673 -4.5673 -4.1557 -4.1557 -4.0191 -4.0191 2.8859 2.8859 3.5561 3.5561 3.6405 3.6405 4.0452 4.0452 4.3346 4.3346 4.8954 4.8954 5.2301 5.2301 5.5503 5.5503 5.7248 5.7248 5.7343 5.7343 6.2400 6.2400 6.3308 6.3308 7.5420 7.5420 7.9047 7.9047 8.1848 8.1848 8.2231 8.2231 8.3124 8.3124 8.5005 8.5005 8.6490 8.6490 8.8288 8.8288 8.9369 8.9369 9.0567 9.0567 9.1688 9.1688 9.8683 9.8683 9.9610 9.9610 k = 0.7028-0.5882-0.2694 ( 4389 PWs) bands (ev): -4.5545 -4.5545 -4.5292 -4.5292 -4.1735 -4.1735 -4.0063 -4.0063 2.8800 2.8800 3.5142 3.5142 3.6226 3.6226 4.0337 4.0337 4.3606 4.3606 4.8597 4.8597 5.2190 5.2190 5.5465 5.5465 5.6796 5.6796 5.7090 5.7090 6.2568 6.2568 6.3101 6.3101 7.5330 7.5330 7.8951 7.8951 8.1920 8.1920 8.2331 8.2331 8.3185 8.3185 8.5014 8.5014 8.6418 8.6418 8.8162 8.8162 8.9257 8.9257 9.0524 9.0524 9.1730 9.1730 9.9228 9.9228 9.9643 9.9643 k = 0.7084-0.6084-0.2694 ( 4391 PWs) bands (ev): -4.5395 -4.5395 -4.4915 -4.4915 -4.1910 -4.1910 -3.9944 -3.9944 2.8782 2.8782 3.4740 3.4740 3.6058 3.6058 4.0253 4.0253 4.3898 4.3898 4.8219 4.8219 5.2006 5.2006 5.5377 5.5377 5.6312 5.6312 5.6980 5.6980 6.2637 6.2637 6.2980 6.2980 7.5243 7.5243 7.8857 7.8857 8.1984 8.1984 8.2445 8.2445 8.3256 8.3256 8.5027 8.5027 8.6326 8.6326 8.8052 8.8052 8.9181 8.9181 9.0483 9.0483 9.1798 9.1798 9.9599 9.9599 9.9843 9.9843 k = 0.7141-0.6287-0.2694 ( 4401 PWs) bands (ev): -4.5290 -4.5290 -4.4547 -4.4547 -4.2071 -4.2071 -3.9833 -3.9833 2.8806 2.8806 3.4360 3.4360 3.5910 3.5910 4.0198 4.0198 4.4206 4.4206 4.7823 4.7823 5.1737 5.1737 5.5252 5.5252 5.5839 5.5839 5.6979 5.6979 6.2464 6.2464 6.3089 6.3089 7.5159 7.5159 7.8766 7.8766 8.2040 8.2040 8.2569 8.2569 8.3335 8.3335 8.5046 8.5046 8.6220 8.6220 8.7954 8.7954 8.9138 8.9138 9.0446 9.0446 9.1890 9.1890 9.9638 9.9638 10.0367 10.0367 k = 0.7197-0.6489-0.2694 ( 4397 PWs) bands (ev): -4.5241 -4.5241 -4.4186 -4.4186 -4.2207 -4.2207 -3.9732 -3.9732 2.8874 2.8874 3.4008 3.4008 3.5786 3.5786 4.0172 4.0172 4.4514 4.4514 4.7418 4.7418 5.1377 5.1377 5.5070 5.5070 5.5439 5.5439 5.7057 5.7057 6.2204 6.2204 6.3275 6.3275 7.5080 7.5080 7.8678 7.8678 8.2091 8.2091 8.2700 8.2700 8.3418 8.3418 8.5074 8.5074 8.6107 8.6107 8.7865 8.7865 8.9126 8.9126 9.0417 9.0417 9.2007 9.2007 9.9651 9.9651 10.0906 10.0906 k = 0.7253-0.6691-0.2694 ( 4403 PWs) bands (ev): -4.5259 -4.5259 -4.3836 -4.3836 -4.2307 -4.2307 -3.9642 -3.9642 2.8986 2.8986 3.3687 3.3687 3.5690 3.5690 4.0174 4.0174 4.4792 4.4792 4.7021 4.7021 5.0934 5.0934 5.4724 5.4724 5.5247 5.5247 5.7188 5.7188 6.1924 6.1924 6.3475 6.3475 7.5003 7.5003 7.8593 7.8593 8.2140 8.2140 8.2833 8.2833 8.3501 8.3501 8.5113 8.5113 8.5994 8.5994 8.7780 8.7780 8.9141 8.9141 9.0394 9.0394 9.2145 9.2145 9.9660 9.9660 10.1437 10.1437 k = 0.2747-0.9854 0.0000 ( 4403 PWs) bands (ev): -4.5259 -4.5259 -4.3836 -4.3836 -4.2307 -4.2307 -3.9642 -3.9642 2.8986 2.8986 3.3687 3.3687 3.5690 3.5690 4.0174 4.0174 4.4792 4.4792 4.7021 4.7021 5.0934 5.0934 5.4724 5.4724 5.5247 5.5247 5.7188 5.7188 6.1924 6.1924 6.3475 6.3475 7.5003 7.5003 7.8593 7.8593 8.2140 8.2140 8.2833 8.2833 8.3501 8.3501 8.5113 8.5113 8.5994 8.5994 8.7780 8.7780 8.9141 8.9141 9.0394 9.0394 9.2145 9.2145 9.9660 9.9660 10.1437 10.1437 k = 0.2691-0.9652 0.0000 ( 4403 PWs) bands (ev): -4.5352 -4.5352 -4.3499 -4.3499 -4.2362 -4.2362 -3.9562 -3.9562 2.9140 2.9140 3.3404 3.3404 3.5629 3.5629 4.0202 4.0202 4.4987 4.4987 4.6677 4.6677 5.0421 5.0421 5.4297 5.4297 5.5199 5.5199 5.7356 5.7356 6.1640 6.1640 6.3677 6.3677 7.4931 7.4931 7.8513 7.8513 8.2186 8.2186 8.2960 8.2960 8.3579 8.3579 8.5165 8.5165 8.5891 8.5891 8.7699 8.7699 8.9177 8.9177 9.0380 9.0380 9.2303 9.2303 9.9670 9.9670 10.1952 10.1952 k = 0.2634-0.9451 0.0000 ( 4401 PWs) bands (ev): -4.5518 -4.5518 -4.3174 -4.3174 -4.2374 -4.2374 -3.9492 -3.9492 2.9336 2.9336 3.3159 3.3159 3.5605 3.5605 4.0257 4.0257 4.5002 4.5002 4.6471 4.6471 4.9853 4.9853 5.3876 5.3876 5.5210 5.5210 5.7550 5.7550 6.1355 6.1355 6.3878 6.3878 7.4862 7.4862 7.8437 7.8437 8.2231 8.2231 8.3074 8.3074 8.3651 8.3651 8.5231 8.5231 8.5804 8.5804 8.7618 8.7618 8.9231 8.9231 9.0375 9.0375 9.2479 9.2479 9.9684 9.9684 10.2447 10.2447 k = 0.2578-0.9250 0.0000 ( 4401 PWs) bands (ev): -4.5752 -4.5752 -4.2863 -4.2863 -4.2349 -4.2349 -3.9434 -3.9434 2.9571 2.9571 3.2956 3.2956 3.5622 3.5622 4.0337 4.0337 4.4769 4.4769 4.6459 4.6459 4.9247 4.9247 5.3487 5.3487 5.5261 5.5261 5.7765 5.7765 6.1076 6.1076 6.4078 6.4078 7.4797 7.4797 7.8367 7.8367 8.2275 8.2275 8.3169 8.3169 8.3716 8.3716 8.5309 8.5309 8.5744 8.5744 8.7533 8.7533 8.9300 8.9300 9.0379 9.0379 9.2673 9.2673 9.9703 9.9703 10.2920 10.2920 k = 0.2522-0.9049 0.0000 ( 4401 PWs) bands (ev): -4.6042 -4.6042 -4.2567 -4.2567 -4.2297 -4.2297 -3.9387 -3.9387 2.9843 2.9843 3.2796 3.2796 3.5681 3.5681 4.0439 4.0439 4.4360 4.4360 4.6553 4.6553 4.8618 4.8618 5.3148 5.3148 5.5342 5.5342 5.7997 5.7997 6.0806 6.0806 6.4274 6.4274 7.4735 7.4735 7.8302 7.8302 8.2317 8.2317 8.3236 8.3236 8.3772 8.3772 8.5397 8.5397 8.5718 8.5718 8.7445 8.7445 8.9383 8.9383 9.0393 9.0393 9.2882 9.2882 9.9730 9.9730 10.3367 10.3367 k = 0.2466-0.8848 0.0000 ( 4405 PWs) bands (ev): -4.6378 -4.6378 -4.2288 -4.2288 -4.2225 -4.2225 -3.9351 -3.9351 3.0149 3.0149 3.2682 3.2682 3.5785 3.5785 4.0559 4.0559 4.3868 4.3868 4.6636 4.6636 4.7993 4.7993 5.2874 5.2874 5.5446 5.5446 5.8244 5.8244 6.0550 6.0550 6.4466 6.4466 7.4677 7.4677 7.8243 7.8243 8.2355 8.2355 8.3270 8.3270 8.3822 8.3822 8.5488 8.5488 8.5736 8.5736 8.7353 8.7353 8.9476 8.9476 9.0414 9.0414 9.3106 9.3106 9.9768 9.9768 10.3784 10.3784 k = 0.2410-0.8647 0.0000 ( 4409 PWs) bands (ev): -4.6751 -4.6751 -4.2152 -4.2152 -4.2020 -4.2020 -3.9327 -3.9327 3.0484 3.0484 3.2616 3.2616 3.5935 3.5935 4.0687 4.0687 4.3344 4.3344 4.6593 4.6593 4.7442 4.7442 5.2680 5.2680 5.5570 5.5570 5.8504 5.8504 6.0310 6.0310 6.4654 6.4654 7.4622 7.4622 7.8190 7.8190 8.2391 8.2391 8.3269 8.3269 8.3866 8.3866 8.5578 8.5578 8.5800 8.5800 8.7257 8.7257 8.9578 8.9578 9.0442 9.0442 9.3342 9.3342 9.9819 9.9819 10.4169 10.4169 k = 0.2354-0.8446 0.0000 ( 4415 PWs) bands (ev): -4.7152 -4.7152 -4.2071 -4.2071 -4.1774 -4.1774 -3.9313 -3.9313 3.0844 3.0844 3.2599 3.2599 3.6130 3.6130 4.0802 4.0802 4.2824 4.2824 4.6252 4.6252 4.7124 4.7124 5.2575 5.2575 5.5712 5.5712 5.8774 5.8774 6.0090 6.0090 6.4838 6.4838 7.4572 7.4572 7.8144 7.8144 8.2421 8.2421 8.3236 8.3236 8.3905 8.3905 8.5668 8.5668 8.5901 8.5901 8.7159 8.7159 8.9687 8.9687 9.0475 9.0475 9.3590 9.3590 9.9884 9.9884 10.4519 10.4519 k = 0.2298-0.8245 0.0000 ( 4409 PWs) bands (ev): -4.7577 -4.7577 -4.1993 -4.1993 -4.1547 -4.1547 -3.9310 -3.9310 3.1224 3.1224 3.2632 3.2632 3.6370 3.6370 4.0847 4.0847 4.2368 4.2368 4.5680 4.5680 4.6979 4.6979 5.2559 5.2559 5.5868 5.5868 5.9049 5.9049 5.9899 5.9899 6.5018 6.5018 7.4526 7.4526 7.8105 7.8105 8.2446 8.2446 8.3178 8.3178 8.3938 8.3938 8.5766 8.5766 8.6023 8.6023 8.7060 8.7060 8.9803 8.9803 9.0512 9.0512 9.3848 9.3848 9.9966 9.9966 10.4833 10.4833 k = 0.2242-0.8044 0.0000 ( 4407 PWs) bands (ev): -4.8021 -4.8021 -4.1920 -4.1920 -4.1338 -4.1338 -3.9317 -3.9317 3.1617 3.1617 3.2715 3.2715 3.6650 3.6650 4.0709 4.0709 4.2086 4.2086 4.5061 4.5061 4.6850 4.6850 5.2623 5.2623 5.6038 5.6038 5.9304 5.9304 5.9760 5.9760 6.5194 6.5194 7.4485 7.4485 7.8075 7.8075 8.2464 8.2464 8.3102 8.3102 8.3964 8.3964 8.5872 8.5872 8.6150 8.6150 8.6965 8.6965 8.9925 8.9925 9.0550 9.0550 9.4114 9.4114 10.0067 10.0067 10.5110 10.5110 k = 0.2186-0.7843 0.0000 ( 4407 PWs) bands (ev): -4.8478 -4.8478 -4.1855 -4.1855 -4.1150 -4.1150 -3.9334 -3.9334 3.2018 3.2018 3.2851 3.2851 3.6964 3.6964 4.0330 4.0330 4.2012 4.2012 4.4477 4.4477 4.6708 4.6708 5.2753 5.2753 5.6219 5.6219 5.9411 5.9411 5.9805 5.9805 6.5368 6.5368 7.4448 7.4448 7.8052 7.8052 8.2471 8.2471 8.3019 8.3019 8.3985 8.3985 8.5982 8.5982 8.6268 8.6268 8.6883 8.6883 9.0051 9.0051 9.0589 9.0589 9.4388 9.4388 10.0188 10.0188 10.5350 10.5350 k = 0.2130-0.7642 0.0000 ( 4403 PWs) bands (ev): -4.8948 -4.8948 -4.1799 -4.1799 -4.0982 -4.0982 -3.9359 -3.9359 3.2414 3.2414 3.3042 3.3042 3.7300 3.7300 3.9813 3.9813 4.1983 4.1983 4.4010 4.4010 4.6567 4.6567 5.2929 5.2929 5.6410 5.6410 5.9339 5.9339 6.0064 6.0064 6.5539 6.5539 7.4416 7.4416 7.8038 7.8038 8.2461 8.2461 8.2938 8.2938 8.4000 8.4000 8.6087 8.6087 8.6361 8.6361 8.6836 8.6836 9.0181 9.0181 9.0626 9.0626 9.4667 9.4667 10.0331 10.0331 10.5550 10.5550 k = 0.2074-0.7440 0.0000 ( 4405 PWs) bands (ev): -4.9426 -4.9426 -4.1754 -4.1754 -4.0836 -4.0836 -3.9393 -3.9393 3.2793 3.2793 3.3291 3.3291 3.7637 3.7637 3.9259 3.9259 4.1804 4.1804 4.3782 4.3782 4.6452 4.6452 5.3135 5.3135 5.6611 5.6611 5.9249 5.9249 6.0378 6.0378 6.5710 6.5710 7.4388 7.4388 7.8032 7.8032 8.2429 8.2429 8.2869 8.2869 8.4009 8.4009 8.6164 8.6164 8.6416 8.6416 8.6846 8.6846 9.0314 9.0314 9.0661 9.0661 9.4950 9.4950 10.0496 10.0496 10.5712 10.5712 k = 0.2018-0.7239 0.0000 ( 4407 PWs) bands (ev): -4.9910 -4.9910 -4.1720 -4.1720 -4.0713 -4.0713 -3.9433 -3.9433 3.3139 3.3139 3.3600 3.3600 3.7900 3.7900 3.8768 3.8768 4.1404 4.1404 4.3837 4.3837 4.6390 4.6390 5.3356 5.3356 5.6820 5.6820 5.9179 5.9179 6.0710 6.0710 6.5882 6.5882 7.4366 7.4366 7.8035 7.8035 8.2366 8.2366 8.2823 8.2823 8.4015 8.4015 8.6178 8.6178 8.6470 8.6470 8.6914 8.6914 9.0450 9.0450 9.0693 9.0693 9.5235 9.5235 10.0683 10.0683 10.5835 10.5835 k = 0.1962-0.7038 0.0000 ( 4407 PWs) bands (ev): -5.0399 -5.0399 -4.1698 -4.1698 -4.0613 -4.0613 -3.9477 -3.9477 3.3443 3.3443 3.3957 3.3957 3.7785 3.7785 3.8657 3.8657 4.0872 4.0872 4.4081 4.4081 4.6407 4.6407 5.3579 5.3579 5.7035 5.7035 5.9135 5.9135 6.1055 6.1055 6.6057 6.6057 7.4348 7.4348 7.8046 7.8046 8.2276 8.2276 8.2800 8.2800 8.4015 8.4015 8.6126 8.6126 8.6549 8.6549 8.7008 8.7008 9.0585 9.0585 9.0724 9.0724 9.5522 9.5522 10.0894 10.0894 10.5919 10.5919 k = 0.1906-0.6837 0.0000 ( 4407 PWs) bands (ev): -5.0890 -5.0890 -4.1686 -4.1686 -4.0538 -4.0538 -3.9524 -3.9524 3.3690 3.3690 3.4342 3.4342 3.7333 3.7333 3.8890 3.8890 4.0300 4.0300 4.4430 4.4430 4.6527 4.6527 5.3795 5.3795 5.7256 5.7256 5.9121 5.9121 6.1409 6.1409 6.6237 6.6237 7.4334 7.4334 7.8066 7.8066 8.2165 8.2165 8.2794 8.2794 8.4011 8.4011 8.6040 8.6040 8.6639 8.6639 8.7109 8.7109 9.0705 9.0705 9.0769 9.0769 9.5808 9.5808 10.1126 10.1126 10.5963 10.5963 k = 0.1850-0.6636 0.0000 ( 4403 PWs) bands (ev): -5.1381 -5.1381 -4.1687 -4.1687 -4.0489 -4.0489 -3.9571 -3.9571 3.3847 3.3847 3.4738 3.4738 3.6873 3.6873 3.9111 3.9111 3.9794 3.9794 4.4843 4.4843 4.6769 4.6769 5.3997 5.3997 5.7480 5.7480 5.9139 5.9139 6.1772 6.1772 6.6425 6.6425 7.4326 7.4326 7.8095 7.8095 8.2043 8.2043 8.2798 8.2798 8.4003 8.4003 8.5945 8.5945 8.6727 8.6727 8.7205 8.7205 9.0752 9.0752 9.0886 9.0886 9.6093 9.6093 10.1379 10.1379 10.5967 10.5967 k = 0.1794-0.6435 0.0000 ( 4403 PWs) bands (ev): -5.1871 -5.1871 -4.1698 -4.1698 -4.0467 -4.0467 -3.9616 -3.9616 3.3858 3.3858 3.5119 3.5119 3.6509 3.6509 3.8942 3.8942 3.9720 3.9720 4.5300 4.5300 4.7141 4.7141 5.4180 5.4180 5.7708 5.7708 5.9188 5.9188 6.2144 6.2144 6.6623 6.6623 7.4322 7.4322 7.8131 7.8131 8.1912 8.1912 8.2808 8.2808 8.3991 8.3991 8.5848 8.5848 8.6807 8.6807 8.7292 8.7292 9.0772 9.0772 9.1026 9.1026 9.6375 9.6375 10.1651 10.1651 10.5931 10.5931 k = 0.1738-0.6234 0.0000 ( 4395 PWs) bands (ev): -5.2359 -5.2359 -4.1720 -4.1720 -4.0472 -4.0472 -3.9657 -3.9657 3.3684 3.3684 3.5423 3.5423 3.6301 3.6301 3.8515 3.8515 4.0001 4.0001 4.5791 4.5791 4.7643 4.7643 5.4341 5.4341 5.7937 5.7937 5.9268 5.9268 6.2523 6.2523 6.6835 6.6835 7.4323 7.4323 7.8174 7.8174 8.1776 8.1776 8.2824 8.2824 8.3974 8.3974 8.5754 8.5754 8.6877 8.6877 8.7369 8.7369 9.0787 9.0787 9.1169 9.1169 9.6654 9.6654 10.1938 10.1938 10.5855 10.5855 k = 0.1682-0.6033 0.0000 ( 4397 PWs) bands (ev): -5.2842 -5.2842 -4.1752 -4.1752 -4.0503 -4.0503 -3.9695 -3.9695 3.3339 3.3339 3.5529 3.5529 3.6251 3.6251 3.8214 3.8214 4.0368 4.0368 4.6305 4.6305 4.8267 4.8267 5.4479 5.4479 5.8165 5.8165 5.9377 5.9377 6.2909 6.2909 6.7063 6.7063 7.4328 7.4328 7.8225 7.8225 8.1637 8.1637 8.2841 8.2841 8.3953 8.3953 8.5666 8.5666 8.6934 8.6934 8.7432 8.7432 9.0801 9.0801 9.1313 9.1313 9.6928 9.6928 10.2237 10.2237 10.5739 10.5739 k = 0.1626-0.5832 0.0000 ( 4403 PWs) bands (ev): -5.3320 -5.3320 -4.1793 -4.1793 -4.0558 -4.0558 -3.9729 -3.9729 3.2880 3.2880 3.5423 3.5423 3.6170 3.6170 3.8228 3.8228 4.0797 4.0797 4.6835 4.6835 4.9000 4.9000 5.4594 5.4594 5.8390 5.8390 5.9513 5.9513 6.3303 6.3303 6.7311 6.7311 7.4336 7.4336 7.8281 7.8281 8.1496 8.1496 8.2860 8.2860 8.3928 8.3928 8.5588 8.5588 8.6979 8.6979 8.7482 8.7482 9.0813 9.0813 9.1456 9.1456 9.7198 9.7198 10.2542 10.2542 10.5583 10.5583 k = 0.1569-0.5631 0.0000 ( 4405 PWs) bands (ev): -5.3791 -5.3791 -4.1843 -4.1843 -4.0631 -4.0631 -3.9764 -3.9764 3.2359 3.2359 3.5173 3.5173 3.5933 3.5933 3.8576 3.8576 4.1289 4.1289 4.7377 4.7377 4.9827 4.9827 5.4688 5.4688 5.8612 5.8612 5.9674 5.9674 6.3704 6.3704 6.7581 6.7581 7.4349 7.4349 7.8344 7.8344 8.1353 8.1353 8.2879 8.2879 8.3901 8.3901 8.5521 8.5521 8.7011 8.7011 8.7520 8.7520 9.0826 9.0826 9.1598 9.1598 9.7463 9.7463 10.2848 10.2848 10.5390 10.5390 k = 0.1513-0.5430 0.0000 ( 4405 PWs) bands (ev): -5.4255 -5.4255 -4.1901 -4.1901 -4.0720 -4.0720 -3.9799 -3.9799 3.1807 3.1807 3.4803 3.4803 3.5630 3.5630 3.9128 3.9128 4.1837 4.1837 4.7927 4.7927 5.0730 5.0730 5.4762 5.4762 5.8829 5.8829 5.9857 5.9857 6.4115 6.4115 6.7875 6.7875 7.4366 7.4366 7.8411 7.8411 8.1208 8.1208 8.2896 8.2896 8.3873 8.3873 8.5467 8.5467 8.7029 8.7029 8.7546 8.7546 9.0841 9.0841 9.1737 9.1737 9.7723 9.7723 10.3146 10.3146 10.5160 10.5160 k = 0.1457-0.5228 0.0000 ( 4413 PWs) bands (ev): -5.4709 -5.4709 -4.1966 -4.1966 -4.0821 -4.0821 -3.9838 -3.9838 3.1244 3.1244 3.4350 3.4350 3.5319 3.5319 3.9788 3.9788 4.2434 4.2434 4.8483 4.8483 5.1694 5.1694 5.4820 5.4820 5.9037 5.9037 6.0059 6.0059 6.4534 6.4534 6.8196 6.8196 7.4386 7.4386 7.8481 7.8481 8.1063 8.1063 8.2910 8.2910 8.3844 8.3844 8.5428 8.5428 8.7033 8.7033 8.7561 8.7561 9.0858 9.0858 9.1872 9.1872 9.7979 9.7979 10.3427 10.3427 10.4897 10.4897 k = 0.1401-0.5027 0.0000 ( 4417 PWs) bands (ev): -5.5154 -5.5154 -4.2037 -4.2037 -4.0931 -4.0931 -3.9882 -3.9882 3.0680 3.0680 3.3852 3.3852 3.5003 3.5003 4.0516 4.0516 4.3073 4.3073 4.9041 4.9041 5.2705 5.2705 5.4866 5.4866 5.9237 5.9237 6.0279 6.0279 6.4964 6.4964 6.8545 6.8545 7.4409 7.4409 7.8554 7.8554 8.0916 8.0916 8.2916 8.2916 8.3821 8.3821 8.5404 8.5404 8.7023 8.7023 8.7567 8.7567 9.0879 9.0879 9.2002 9.2002 9.8231 9.8231 10.3673 10.3673 10.4612 10.4612 k = 0.1345-0.4826 0.0000 ( 4417 PWs) bands (ev): -5.5587 -5.5587 -4.2114 -4.2114 -4.1047 -4.1047 -3.9930 -3.9930 3.0122 3.0122 3.3339 3.3339 3.4681 3.4681 4.1290 4.1290 4.3743 4.3743 4.9601 4.9601 5.3746 5.3746 5.4906 5.4906 5.9426 5.9426 6.0518 6.0518 6.5408 6.5408 6.8921 6.8921 7.4436 7.4436 7.8628 7.8628 8.0770 8.0770 8.2912 8.2912 8.3805 8.3805 8.5397 8.5397 8.7001 8.7001 8.7565 8.7565 9.0904 9.0904 9.2127 9.2127 9.8480 9.8480 10.3835 10.3835 10.4346 10.4346 k = 0.1289-0.4625 0.0000 ( 4419 PWs) bands (ev): -5.6009 -5.6009 -4.2196 -4.2196 -4.1169 -4.1169 -3.9983 -3.9983 2.9574 2.9574 3.2825 3.2825 3.4352 3.4352 4.2100 4.2100 4.4437 4.4437 5.0158 5.0158 5.4740 5.4740 5.5005 5.5005 5.9603 5.9603 6.0779 6.0779 6.5864 6.5864 6.9325 6.9325 7.4467 7.4467 7.8703 7.8703 8.0623 8.0623 8.2896 8.2896 8.3800 8.3800 8.5407 8.5407 8.6967 8.6967 8.7558 8.7558 9.0934 9.0934 9.2244 9.2244 9.8727 9.8727 10.3732 10.3732 10.4272 10.4272 k = 0.1233-0.4424 0.0000 ( 4417 PWs) bands (ev): -5.6418 -5.6418 -4.2281 -4.2281 -4.1293 -4.1293 -4.0040 -4.0040 2.9039 2.9039 3.2318 3.2318 3.4019 3.4019 4.2936 4.2936 4.5147 4.5147 5.0710 5.0710 5.4921 5.4921 5.5917 5.5917 5.9768 5.9768 6.1068 6.1068 6.6336 6.6336 6.9756 6.9756 7.4501 7.4501 7.8777 7.8777 8.0477 8.0477 8.2865 8.2865 8.3806 8.3806 8.5436 8.5436 8.6924 8.6924 8.7547 8.7547 9.0970 9.0970 9.2352 9.2352 9.8973 9.8973 10.3399 10.3399 10.4352 10.4352 k = 0.1177-0.4223 0.0000 ( 4421 PWs) bands (ev): -5.6814 -5.6814 -4.2369 -4.2369 -4.1419 -4.1419 -4.0102 -4.0102 2.8520 2.8520 3.1823 3.1823 3.3686 3.3686 4.3792 4.3792 4.5866 4.5866 5.1256 5.1256 5.4946 5.4946 5.6965 5.6965 5.9922 5.9922 6.1397 6.1397 6.6822 6.6822 7.0212 7.0212 7.4539 7.4539 7.8848 7.8848 8.0332 8.0332 8.2820 8.2820 8.3822 8.3822 8.5482 8.5482 8.6875 8.6875 8.7533 8.7533 9.1012 9.1012 9.2448 9.2448 9.9215 9.9215 10.3003 10.3003 10.4416 10.4416 k = 0.1121-0.4022 0.0000 ( 4409 PWs) bands (ev): -5.7196 -5.7196 -4.2459 -4.2459 -4.1545 -4.1545 -4.0167 -4.0167 2.8019 2.8019 3.1344 3.1344 3.3355 3.3355 4.4660 4.4660 4.6587 4.6587 5.1792 5.1792 5.4966 5.4966 5.7971 5.7971 6.0066 6.0066 6.1788 6.1788 6.7325 6.7325 7.0690 7.0690 7.4581 7.4581 7.8916 7.8916 8.0189 8.0189 8.2764 8.2764 8.3847 8.3847 8.5547 8.5547 8.6824 8.6824 8.7518 8.7518 9.1061 9.1061 9.2533 9.2533 9.9452 9.9452 10.2585 10.2585 10.4431 10.4431 k = 0.1065-0.3821 0.0000 ( 4405 PWs) bands (ev): -5.7563 -5.7563 -4.2550 -4.2550 -4.1671 -4.1671 -4.0235 -4.0235 2.7536 2.7536 3.0882 3.0882 3.3030 3.3030 4.5535 4.5535 4.7303 4.7303 5.2317 5.2317 5.4987 5.4987 5.8889 5.8889 6.0202 6.0202 6.2274 6.2274 6.7843 6.7843 7.1187 7.1187 7.4629 7.4629 7.8977 7.8977 8.0050 8.0050 8.2698 8.2698 8.3874 8.3874 8.5629 8.5629 8.6775 8.6775 8.7503 8.7503 9.1118 9.1118 9.2605 9.2605 9.9672 9.9672 10.2166 10.2166 10.4394 10.4394 k = 0.1009-0.3620 0.0000 ( 4403 PWs) bands (ev): -5.7914 -5.7914 -4.2641 -4.2641 -4.1795 -4.1795 -4.0305 -4.0305 2.7073 2.7073 3.0439 3.0439 3.2712 3.2712 4.6408 4.6408 4.8006 4.8006 5.2828 5.2828 5.5015 5.5015 5.9668 5.9668 6.0337 6.0337 6.2894 6.2894 6.8374 6.8374 7.1701 7.1701 7.4681 7.4681 7.9030 7.9030 7.9916 7.9916 8.2625 8.2625 8.3901 8.3901 8.5726 8.5726 8.6735 8.6735 8.7489 8.7489 9.1183 9.1183 9.2663 9.2663 9.9848 9.9848 10.1780 10.1780 10.4309 10.4309 k = 0.0953-0.3419 0.0000 ( 4403 PWs) bands (ev): -5.8250 -5.8250 -4.2733 -4.2733 -4.1917 -4.1917 -4.0376 -4.0376 2.6631 2.6631 3.0016 3.0016 3.2404 3.2404 4.7274 4.7274 4.8690 4.8690 5.3320 5.3320 5.5054 5.5054 6.0258 6.0258 6.0497 6.0497 6.3665 6.3665 6.8917 6.8917 7.2226 7.2226 7.4741 7.4741 7.9070 7.9070 7.9793 7.9793 8.2548 8.2548 8.3921 8.3921 8.5835 8.5835 8.6712 8.6712 8.7479 8.7479 9.1258 9.1258 9.2706 9.2706 9.9911 9.9911 10.1500 10.1500 10.4183 10.4183 k = 0.0897-0.3217 0.0000 ( 4403 PWs) bands (ev): -5.8569 -5.8569 -4.2823 -4.2823 -4.2037 -4.2037 -4.0448 -4.0448 2.6211 2.6211 2.9615 2.9615 3.2108 3.2108 4.8123 4.8123 4.9347 4.9347 5.3789 5.3789 5.5111 5.5111 6.0535 6.0535 6.0829 6.0829 6.4562 6.4562 6.9468 6.9468 7.2759 7.2759 7.4810 7.4810 7.9092 7.9092 7.9685 7.9685 8.2469 8.2469 8.3930 8.3930 8.5951 8.5951 8.6715 8.6715 8.7475 8.7475 9.1345 9.1345 9.2734 9.2734 9.9768 9.9768 10.1424 10.1424 10.4023 10.4023 k = 0.0841-0.3016 0.0000 ( 4409 PWs) bands (ev): -5.8871 -5.8871 -4.2911 -4.2911 -4.2152 -4.2152 -4.0519 -4.0519 2.5814 2.5814 2.9235 2.9235 3.1824 3.1824 4.8949 4.8949 4.9968 4.9968 5.4223 5.4223 5.5200 5.5200 6.0682 6.0682 6.1191 6.1191 6.5536 6.5536 7.0025 7.0025 7.3291 7.3291 7.4892 7.4892 7.9090 7.9090 7.9602 7.9602 8.2389 8.2389 8.3923 8.3923 8.6065 8.6065 8.6751 8.6751 8.7480 8.7480 9.1444 9.1444 9.2749 9.2749 9.9421 9.9421 10.1549 10.1549 10.3837 10.3837 k = 0.0785-0.2815 0.0000 ( 4409 PWs) bands (ev): -5.9156 -5.9156 -4.2996 -4.2996 -4.2263 -4.2263 -4.0590 -4.0590 2.5440 2.5440 2.8877 2.8877 3.1554 3.1554 4.9742 4.9742 5.0547 5.0547 5.4599 5.4599 5.5347 5.5347 6.0825 6.0825 6.1495 6.1495 6.6540 6.6540 7.0583 7.0583 7.3813 7.3813 7.4991 7.4991 7.9060 7.9060 7.9551 7.9551 8.2311 8.2311 8.3897 8.3897 8.6172 8.6172 8.6829 8.6829 8.7497 8.7497 9.1558 9.1558 9.2752 9.2752 9.8961 9.8961 10.1787 10.1787 10.3629 10.3629 k = 0.0729-0.2614 0.0000 ( 4411 PWs) bands (ev): -5.9422 -5.9422 -4.3079 -4.3079 -4.2369 -4.2369 -4.0658 -4.0658 2.5089 2.5089 2.8542 2.8542 3.1300 3.1300 5.0491 5.0491 5.1076 5.1076 5.4890 5.4890 5.5579 5.5579 6.0979 6.0979 6.1758 6.1758 6.7541 6.7541 7.1137 7.1137 7.4311 7.4311 7.5118 7.5118 7.9009 7.9009 7.9531 7.9531 8.2236 8.2236 8.3849 8.3849 8.6271 8.6271 8.6944 8.6944 8.7532 8.7532 9.1688 9.1688 9.2745 9.2745 9.8446 9.8446 10.2077 10.2077 10.3407 10.3407 k = 0.0673-0.2413 0.0000 ( 4415 PWs) bands (ev): -5.9670 -5.9670 -4.3158 -4.3158 -4.2469 -4.2469 -4.0724 -4.0724 2.4762 2.4762 2.8231 2.8231 3.1061 3.1061 5.1181 5.1181 5.1559 5.1559 5.5106 5.5106 5.5888 5.5888 6.1148 6.1148 6.1990 6.1990 6.8511 6.8511 7.1682 7.1682 7.4760 7.4760 7.5292 7.5292 7.8952 7.8952 7.9535 7.9535 8.2165 8.2165 8.3780 8.3780 8.6366 8.6366 8.7087 8.7087 8.7589 8.7589 9.1833 9.1833 9.2733 9.2733 9.7902 9.7902 10.2384 10.2384 10.3178 10.3178 k = 0.0617-0.2212 0.0000 ( 4417 PWs) bands (ev): -5.9900 -5.9900 -4.3232 -4.3232 -4.2563 -4.2563 -4.0788 -4.0788 2.4461 2.4461 2.7943 2.7943 3.0840 3.0840 5.1762 5.1762 5.2033 5.2033 5.5292 5.5292 5.6227 5.6227 6.1337 6.1337 6.2200 6.2200 6.9427 6.9427 7.2208 7.2208 7.5127 7.5127 7.5539 7.5539 7.8902 7.8902 7.9559 7.9559 8.2099 8.2099 8.3689 8.3689 8.6461 8.6461 8.7246 8.7246 8.7673 8.7673 9.1990 9.1990 9.2724 9.2724 9.7342 9.7342 10.2647 10.2647 10.2990 10.2990 k = 0.0561-0.2011 0.0000 ( 4415 PWs) bands (ev): -6.0111 -6.0111 -4.3302 -4.3302 -4.2651 -4.2651 -4.0847 -4.0847 2.4184 2.4184 2.7679 2.7679 3.0635 3.0635 5.2165 5.2165 5.2559 5.2559 5.5476 5.5476 5.6560 5.6560 6.1544 6.1544 6.2396 6.2396 7.0269 7.0269 7.2708 7.2708 7.5426 7.5426 7.5837 7.5837 7.8870 7.8870 7.9611 7.9611 8.2040 8.2040 8.3579 8.3579 8.6556 8.6556 8.7416 8.7416 8.7785 8.7785 9.2146 9.2146 9.2736 9.2736 9.6774 9.6774 10.2584 10.2584 10.3117 10.3117 k = 0.0504-0.1810 0.0000 ( 4415 PWs) bands (ev): -6.0302 -6.0302 -4.3367 -4.3367 -4.2732 -4.2732 -4.0903 -4.0903 2.3933 2.3933 2.7439 2.7439 3.0449 3.0449 5.2448 5.2448 5.3081 5.3081 5.5667 5.5667 5.6872 5.6872 6.1765 6.1765 6.2584 6.2584 7.1017 7.1017 7.3174 7.3174 7.5715 7.5715 7.6119 7.6119 7.8854 7.8854 7.9702 7.9702 8.1989 8.1989 8.3451 8.3451 8.6649 8.6649 8.7597 8.7597 8.7917 8.7917 9.2268 9.2268 9.2801 9.2801 9.6202 9.6202 10.2342 10.2342 10.3401 10.3401 k = 0.0448-0.1609 0.0000 ( 4413 PWs) bands (ev): -6.0474 -6.0474 -4.3426 -4.3426 -4.2805 -4.2805 -4.0954 -4.0954 2.3707 2.3707 2.7225 2.7225 3.0281 3.0281 5.2658 5.2658 5.3554 5.3554 5.5863 5.5863 5.7153 5.7153 6.1991 6.1991 6.2771 6.2771 7.1656 7.1656 7.3602 7.3602 7.6007 7.6007 7.6369 7.6369 7.8844 7.8844 7.9847 7.9847 8.1948 8.1948 8.3309 8.3309 8.6741 8.6741 8.7792 8.7792 8.8063 8.8063 9.2328 9.2328 9.2951 9.2951 9.5632 9.5632 10.2080 10.2080 10.3678 10.3678 k = 0.0392-0.1408 0.0000 ( 4407 PWs) bands (ev): -6.0627 -6.0627 -4.3479 -4.3479 -4.2870 -4.2870 -4.1000 -4.1000 2.3508 2.3508 2.7034 2.7034 3.0132 3.0132 5.2816 5.2816 5.3970 5.3970 5.6056 5.6056 5.7399 5.7399 6.2206 6.2206 6.2965 6.2965 7.2174 7.2174 7.3995 7.3995 7.6227 7.6227 7.6657 7.6657 7.8825 7.8825 8.0048 8.0048 8.1918 8.1918 8.3154 8.3154 8.6831 8.6831 8.7991 8.7991 8.8225 8.8225 9.2336 9.2336 9.3170 9.3170 9.5066 9.5066 10.1813 10.1813 10.3926 10.3926 k = 0.0336-0.1207 0.0000 ( 4411 PWs) bands (ev): -6.0759 -6.0759 -4.3525 -4.3525 -4.2927 -4.2927 -4.1040 -4.1040 2.3334 2.3334 2.6869 2.6869 3.0002 3.0002 5.2932 5.2932 5.4325 5.4325 5.6236 5.6236 5.7610 5.7610 6.2395 6.2395 6.3170 6.3170 7.2574 7.2574 7.4361 7.4361 7.6323 7.6323 7.7031 7.7031 7.8792 7.8792 8.0289 8.0289 8.1901 8.1901 8.2990 8.2990 8.6919 8.6919 8.8163 8.8163 8.8426 8.8426 9.2322 9.2322 9.3423 9.3423 9.4513 9.4513 10.1550 10.1550 10.4135 10.4135 k = 0.0280-0.1005 0.0000 ( 4419 PWs) bands (ev): -6.0872 -6.0872 -4.3565 -4.3565 -4.2976 -4.2976 -4.1075 -4.1075 2.3187 2.3187 2.6729 2.6729 2.9892 2.9892 5.3018 5.3018 5.4622 5.4622 5.6397 5.6397 5.7786 5.7786 6.2549 6.2549 6.3383 6.3383 7.2866 7.2866 7.4698 7.4698 7.6344 7.6344 7.7436 7.7436 7.8744 7.8744 8.0542 8.0542 8.1901 8.1901 8.2821 8.2821 8.7006 8.7006 8.8287 8.8287 8.8679 8.8679 9.2299 9.2299 9.3681 9.3681 9.3984 9.3984 10.1299 10.1299 10.4302 10.4302 k = 0.0224-0.0804 0.0000 ( 4419 PWs) bands (ev): -6.0964 -6.0964 -4.3598 -4.3598 -4.3016 -4.3016 -4.1104 -4.1104 2.3066 2.3066 2.6615 2.6615 2.9801 2.9801 5.3079 5.3079 5.4861 5.4861 5.6534 5.6534 5.7928 5.7928 6.2666 6.2666 6.3590 6.3590 7.3072 7.3072 7.5000 7.5000 7.6331 7.6331 7.7823 7.7823 7.8688 7.8688 8.0778 8.0778 8.1919 8.1919 8.2651 8.2651 8.7091 8.7091 8.8373 8.8373 8.8963 8.8963 9.2268 9.2268 9.3470 9.3470 9.3948 9.3948 10.1067 10.1067 10.4429 10.4429 k = 0.0168-0.0603 0.0000 ( 4415 PWs) bands (ev): -6.1035 -6.1035 -4.3623 -4.3623 -4.3048 -4.3048 -4.1127 -4.1127 2.2973 2.2973 2.6525 2.6525 2.9731 2.9731 5.3122 5.3122 5.5045 5.5045 5.6643 5.6643 5.8039 5.8039 6.2751 6.2751 6.3774 6.3774 7.3213 7.3213 7.5254 7.5254 7.6304 7.6304 7.8156 7.8156 7.8635 7.8635 8.0977 8.0977 8.1956 8.1956 8.2487 8.2487 8.7170 8.7170 8.8432 8.8432 8.9256 8.9256 9.2222 9.2222 9.3033 9.3033 9.4169 9.4169 10.0867 10.0867 10.4518 10.4518 k = 0.0112-0.0402 0.0000 ( 4417 PWs) bands (ev): -6.1087 -6.1087 -4.3642 -4.3642 -4.3070 -4.3070 -4.1143 -4.1143 2.2905 2.2905 2.6461 2.6461 2.9680 2.9680 5.3150 5.3150 5.5174 5.5174 5.6722 5.6722 5.8117 5.8117 6.2809 6.2809 6.3918 6.3918 7.3302 7.3302 7.5446 7.5446 7.6280 7.6280 7.8391 7.8391 7.8612 7.8612 8.1126 8.1126 8.2005 8.2005 8.2339 8.2339 8.7236 8.7236 8.8470 8.8470 8.9530 8.9530 9.2132 9.2132 9.2708 9.2708 9.4346 9.4346 10.0711 10.0711 10.4577 10.4577 k = 0.0056-0.0201 0.0000 ( 4421 PWs) bands (ev): -6.1117 -6.1117 -4.3653 -4.3653 -4.3084 -4.3084 -4.1153 -4.1153 2.2865 2.2865 2.6423 2.6423 2.9650 2.9650 5.3166 5.3166 5.5251 5.5251 5.6769 5.6769 5.8164 5.8164 6.2842 6.2842 6.4009 6.4009 7.3351 7.3351 7.5564 7.5564 7.6265 7.6265 7.8465 7.8465 7.8668 7.8668 8.1219 8.1219 8.2059 8.2059 8.2219 8.2219 8.7279 8.7279 8.8490 8.8490 8.9742 8.9742 9.1994 9.1994 9.2548 9.2548 9.4460 9.4460 10.0611 10.0611 10.4609 10.4609 k = 0.0000 0.0000 0.0000 ( 4425 PWs) bands (ev): -6.1128 -6.1128 -4.3657 -4.3657 -4.3089 -4.3089 -4.1157 -4.1157 2.2852 2.2852 2.6410 2.6410 2.9640 2.9640 5.3171 5.3171 5.5277 5.5277 5.6785 5.6785 5.8180 5.8180 6.2853 6.2853 6.4040 6.4040 7.3367 7.3367 7.5604 7.5604 7.6260 7.6260 7.8467 7.8467 7.8710 7.8710 8.1252 8.1252 8.2108 8.2108 8.2147 8.2147 8.7295 8.7295 8.8497 8.8497 8.9826 8.9826 9.1922 9.1922 9.2508 9.2508 9.4500 9.4500 10.0576 10.0576 10.4620 10.4620 k = 0.0000 0.0000 0.0000 ( 4425 PWs) bands (ev): -6.1128 -6.1128 -4.3657 -4.3657 -4.3089 -4.3089 -4.1157 -4.1157 2.2852 2.2852 2.6410 2.6410 2.9640 2.9640 5.3171 5.3171 5.5277 5.5277 5.6785 5.6785 5.8180 5.8180 6.2853 6.2853 6.4040 6.4040 7.3367 7.3367 7.5604 7.5604 7.6260 7.6260 7.8467 7.8467 7.8710 7.8710 8.1252 8.1252 8.2108 8.2108 8.2147 8.2147 8.7295 8.7295 8.8497 8.8497 8.9826 8.9826 9.1922 9.1922 9.2508 9.2508 9.4500 9.4500 10.0576 10.0576 10.4620 10.4620 k = 0.0106-0.0176-0.0029 ( 4421 PWs) bands (ev): -6.1118 -6.1118 -4.3654 -4.3654 -4.3086 -4.3086 -4.1154 -4.1154 2.2867 2.2867 2.6421 2.6421 2.9653 2.9653 5.3166 5.3166 5.5254 5.5254 5.6771 5.6771 5.8165 5.8165 6.2842 6.2842 6.4012 6.4012 7.3350 7.3350 7.5567 7.5567 7.6264 7.6264 7.8466 7.8466 7.8672 7.8672 8.1212 8.1212 8.2037 8.2037 8.2246 8.2246 8.7276 8.7276 8.8489 8.8489 8.9745 8.9745 9.1991 9.1991 9.2543 9.2543 9.4472 9.4472 10.0611 10.0611 10.4608 10.4608 k = 0.0213-0.0352-0.0057 ( 4418 PWs) bands (ev): -6.1087 -6.1087 -4.3646 -4.3646 -4.3076 -4.3076 -4.1146 -4.1146 2.2913 2.2913 2.6452 2.6452 2.9693 2.9693 5.3150 5.3150 5.5185 5.5185 5.6730 5.6730 5.8122 5.8122 6.2810 6.2810 6.3928 6.3928 7.3296 7.3296 7.5458 7.5458 7.6276 7.6276 7.8406 7.8406 7.8613 7.8613 8.1098 8.1098 8.1977 8.1977 8.2389 8.2389 8.7221 8.7221 8.8461 8.8461 8.9546 8.9546 9.2122 9.2122 9.2679 9.2679 9.4393 9.4393 10.0711 10.0711 10.4572 10.4572 k = 0.0319-0.0528-0.0086 ( 4418 PWs) bands (ev): -6.1036 -6.1036 -4.3633 -4.3633 -4.3061 -4.3061 -4.1133 -4.1133 2.2991 2.2991 2.6503 2.6503 2.9758 2.9758 5.3122 5.3122 5.5070 5.5070 5.6661 5.6661 5.8050 5.8050 6.2754 6.2754 6.3795 6.3795 7.3202 7.3202 7.5280 7.5280 7.6293 7.6293 7.8194 7.8194 7.8629 7.8629 8.0923 8.0923 8.1937 8.1937 8.2550 8.2550 8.7135 8.7135 8.8404 8.8404 8.9307 8.9307 9.2206 9.2206 9.2953 9.2953 9.4272 9.4272 10.0867 10.0867 10.4509 10.4509 k = 0.0426-0.0704-0.0115 ( 4422 PWs) bands (ev): -6.0965 -6.0965 -4.3614 -4.3614 -4.3040 -4.3040 -4.1115 -4.1115 2.3098 2.3098 2.6575 2.6575 2.9850 2.9850 5.3080 5.3080 5.4908 5.4908 5.6564 5.6564 5.7949 5.7949 6.2672 6.2672 6.3623 6.3623 7.3061 7.3061 7.5041 7.5041 7.6308 7.6308 7.7879 7.7879 7.8678 7.8678 8.0703 8.0703 8.1915 8.1915 8.2722 8.2722 8.7028 8.7028 8.8308 8.8308 8.9083 8.9083 9.2240 9.2240 9.3313 9.3313 9.4128 9.4128 10.1068 10.1068 10.4416 10.4416 k = 0.0532-0.0880-0.0143 ( 4420 PWs) bands (ev): -6.0874 -6.0874 -4.3590 -4.3590 -4.3013 -4.3013 -4.1091 -4.1091 2.3236 2.3236 2.6668 2.6668 2.9967 2.9967 5.3021 5.3021 5.4697 5.4697 5.6441 5.6441 5.7819 5.7819 6.2559 6.2559 6.3427 6.3427 7.2863 7.2863 7.4753 7.4753 7.6300 7.6300 7.7507 7.7507 7.8734 7.8734 8.0458 8.0458 8.1909 8.1909 8.2899 8.2899 8.6908 8.6908 8.8165 8.8165 8.8903 8.8903 9.2249 9.2249 9.3649 9.3649 9.4032 9.4032 10.1300 10.1300 10.4288 10.4288 k = 0.0638-0.1056-0.0172 ( 4415 PWs) bands (ev): -6.0763 -6.0763 -4.3561 -4.3561 -4.2980 -4.2980 -4.1063 -4.1063 2.3404 2.3404 2.6782 2.6782 3.0110 3.0110 5.2940 5.2940 5.4437 5.4437 5.6295 5.6295 5.7661 5.7661 6.2409 6.2409 6.3223 6.3223 7.2594 7.2594 7.4423 7.4423 7.6224 7.6224 7.7135 7.7135 7.8786 7.8786 8.0208 8.0208 8.1917 8.1917 8.3075 8.3075 8.6784 8.6784 8.7987 8.7987 8.8764 8.8764 9.2243 9.2243 9.3665 9.3665 9.4269 9.4269 10.1551 10.1551 10.4124 10.4124 k = 0.0745-0.1232-0.0201 ( 4416 PWs) bands (ev): -6.0632 -6.0632 -4.3527 -4.3527 -4.2941 -4.2941 -4.1030 -4.1030 2.3601 2.3601 2.6917 2.6917 3.0277 3.0277 5.2831 5.2831 5.4126 5.4126 5.6130 5.6130 5.7474 5.7474 6.2222 6.2222 6.3023 6.3023 7.2237 7.2237 7.4057 7.4057 7.6000 7.6000 7.6857 7.6857 7.8826 7.8826 7.9977 7.9977 8.1937 8.1937 8.3246 8.3246 8.6660 8.6660 8.7792 8.7792 8.8649 8.8649 9.2221 9.2221 9.3523 9.3523 9.4681 9.4681 10.1809 10.1809 10.3922 10.3922 k = 0.0851-0.1408-0.0229 ( 4411 PWs) bands (ev): -6.0481 -6.0481 -4.3489 -4.3489 -4.2897 -4.2897 -4.0992 -4.0992 2.3826 2.3826 2.7072 2.7072 3.0468 3.0468 5.2684 5.2684 5.3766 5.3766 5.5951 5.5951 5.7258 5.7258 6.2003 6.2003 6.2834 6.2834 7.1775 7.1775 7.3660 7.3660 7.5614 7.5614 7.6703 7.6703 7.8854 7.8854 7.9787 7.9787 8.1967 8.1967 8.3410 8.3410 8.6542 8.6542 8.7596 8.7596 8.8544 8.8544 9.2181 9.2181 9.3381 9.3381 9.5113 9.5113 10.2065 10.2065 10.3687 10.3687 k = 0.0957-0.1584-0.0258 ( 4410 PWs) bands (ev): -6.0311 -6.0311 -4.3446 -4.3446 -4.2847 -4.2847 -4.0950 -4.0950 2.4080 2.4080 2.7248 2.7248 3.0682 3.0682 5.2482 5.2482 5.3362 5.3362 5.5766 5.5766 5.7014 5.7014 6.1764 6.1764 6.2653 6.2653 7.1197 7.1197 7.3231 7.3231 7.5159 7.5159 7.6597 7.6597 7.8869 7.8869 7.9648 7.9648 8.2004 8.2004 8.3564 8.3564 8.6432 8.6432 8.7408 8.7408 8.8443 8.8443 9.2119 9.2119 9.3264 9.3264 9.5549 9.5549 10.2308 10.2308 10.3427 10.3427 k = 0.1064-0.1760-0.0287 ( 4409 PWs) bands (ev): -6.0122 -6.0122 -4.3400 -4.3400 -4.2791 -4.2791 -4.0904 -4.0904 2.4361 2.4361 2.7445 2.7445 3.0918 3.0918 5.2201 5.2201 5.2933 5.2933 5.5583 5.5583 5.6745 5.6745 6.1521 6.1521 6.2473 6.2473 7.0504 7.0504 7.2771 7.2771 7.4700 7.4700 7.6490 7.6490 7.8880 7.8880 7.9561 7.9561 8.2048 8.2048 8.3706 8.3706 8.6329 8.6329 8.7232 8.7232 8.8345 8.8345 9.2036 9.2036 9.3177 9.3177 9.5981 9.5981 10.2515 10.2515 10.3169 10.3169 k = 0.1170-0.1936-0.0315 ( 4411 PWs) bands (ev): -5.9913 -5.9913 -4.3350 -4.3350 -4.2731 -4.2731 -4.0854 -4.0854 2.4668 2.4668 2.7663 2.7663 3.1175 3.1175 5.1800 5.1800 5.2513 5.2513 5.5408 5.5408 5.6455 5.6455 6.1282 6.1282 6.2287 6.2287 6.9705 6.9705 7.2282 7.2282 7.4254 7.4254 7.6370 7.6370 7.8898 7.8898 7.9515 7.9515 8.2098 8.2098 8.3833 8.3833 8.6236 8.6236 8.7071 8.7071 8.8249 8.8249 9.1935 9.1935 9.3118 9.3118 9.6407 9.6407 10.2568 10.2568 10.3037 10.3037 k = 0.1277-0.2112-0.0344 ( 4408 PWs) bands (ev): -5.9686 -5.9686 -4.3297 -4.3297 -4.2665 -4.2665 -4.0801 -4.0801 2.5000 2.5000 2.7901 2.7901 3.1453 3.1453 5.1263 5.1263 5.2119 5.2119 5.5241 5.5241 5.6150 5.6150 6.1055 6.1055 6.2088 6.2088 6.8819 6.8819 7.1773 7.1773 7.3821 7.3821 7.6240 7.6240 7.8927 7.8927 7.9496 7.9496 8.2152 8.2152 8.3941 8.3941 8.6149 8.6149 8.6929 8.6929 8.8159 8.8159 9.1824 9.1824 9.3079 9.3079 9.6825 9.6825 10.2350 10.2350 10.3154 10.3154 k = 0.1383-0.2288-0.0373 ( 4409 PWs) bands (ev): -5.9440 -5.9440 -4.3240 -4.3240 -4.2594 -4.2594 -4.0745 -4.0745 2.5357 2.5357 2.8161 2.8161 3.1749 3.1749 5.0613 5.0613 5.1733 5.1733 5.5074 5.5074 5.5845 5.5845 6.0842 6.0842 6.1871 6.1871 6.7870 6.7870 7.1249 7.1249 7.3394 7.3394 7.6108 7.6108 7.8966 7.8966 7.9497 7.9497 8.2210 8.2210 8.4029 8.4029 8.6069 8.6069 8.6809 8.6809 8.8075 8.8075 9.1709 9.1709 9.3051 9.3051 9.7230 9.7230 10.2045 10.2045 10.3344 10.3344 k = 0.1489-0.2464-0.0401 ( 4409 PWs) bands (ev): -5.9176 -5.9176 -4.3182 -4.3182 -4.2518 -4.2518 -4.0687 -4.0687 2.5736 2.5736 2.8441 2.8441 3.2063 3.2063 4.9881 4.9881 5.1334 5.1334 5.4882 5.4882 5.5567 5.5567 6.0642 6.0642 6.1625 6.1625 6.6884 6.6884 7.0718 7.0718 7.2966 7.2966 7.5980 7.5980 7.9008 7.9008 7.9516 7.9516 8.2271 8.2271 8.4094 8.4094 8.5993 8.5993 8.6716 8.6716 8.8000 8.8000 9.1594 9.1594 9.3029 9.3029 9.7617 9.7617 10.1728 10.1728 10.3540 10.3540 k = 0.1596-0.2640-0.0430 ( 4411 PWs) bands (ev): -5.8894 -5.8894 -4.3121 -4.3121 -4.2437 -4.2437 -4.0628 -4.0628 2.6135 2.6135 2.8741 2.8741 3.2392 3.2392 4.9088 4.9088 5.0915 5.0915 5.4629 5.4629 5.5351 5.5351 6.0453 6.0453 6.1340 6.1340 6.5888 6.5888 7.0185 7.0185 7.2535 7.2535 7.5861 7.5861 7.9042 7.9042 7.9555 7.9555 8.2336 8.2336 8.4134 8.4134 8.5921 8.5921 8.6652 8.6652 8.7934 8.7934 9.1482 9.1482 9.3006 9.3006 9.7980 9.7980 10.1420 10.1421 10.3731 10.3731 k = 0.1702-0.2816-0.0459 ( 4410 PWs) bands (ev): -5.8596 -5.8596 -4.3058 -4.3058 -4.2352 -4.2352 -4.0567 -4.0567 2.6555 2.6555 2.9061 2.9061 3.2734 3.2734 4.8248 4.8248 5.0477 5.0477 5.4302 5.4302 5.5209 5.5209 6.0270 6.0270 6.0995 6.0995 6.4917 6.4917 6.9652 6.9652 7.2099 7.2099 7.5753 7.5753 7.9061 7.9061 7.9617 7.9617 8.2402 8.2402 8.4151 8.4151 8.5851 8.5851 8.6617 8.6617 8.7877 8.7877 9.1374 9.1374 9.2980 9.2980 9.8307 9.8307 10.1136 10.1136 10.3916 10.3916 k = 0.1809-0.2992-0.0487 ( 4411 PWs) bands (ev): -5.8280 -5.8280 -4.2995 -4.2995 -4.2262 -4.2262 -4.0506 -4.0506 2.6992 2.6992 2.9401 2.9401 3.3089 3.3089 4.7372 4.7372 5.0024 5.0024 5.3921 5.3921 5.5122 5.5122 6.0081 6.0081 6.0569 6.0569 6.4015 6.4015 6.9124 6.9124 7.1661 7.1661 7.5655 7.5655 7.9060 7.9060 7.9701 7.9701 8.2470 8.2470 8.4146 8.4146 8.5783 8.5783 8.6610 8.6610 8.7829 8.7829 9.1270 9.1270 9.2948 9.2948 9.8579 9.8579 10.0893 10.0893 10.4091 10.4091 k = 0.1915-0.3168-0.0516 ( 4410 PWs) bands (ev): -5.7948 -5.7948 -4.2930 -4.2930 -4.2169 -4.2169 -4.0446 -4.0446 2.7444 2.7444 2.9760 2.9760 3.3452 3.3452 4.6471 4.6471 4.9560 4.9560 5.3506 5.3506 5.5066 5.5066 5.9803 5.9803 6.0102 6.0102 6.3228 6.3228 6.8604 6.8604 7.1224 7.1224 7.5567 7.5567 7.9042 7.9042 7.9803 7.9803 8.2538 8.2538 8.4123 8.4123 8.5720 8.5720 8.6625 8.6625 8.7788 8.7788 9.1171 9.1171 9.2909 9.2909 9.8768 9.8768 10.0717 10.0717 10.4260 10.4260 k = 0.2021-0.3344-0.0545 ( 4407 PWs) bands (ev): -5.7600 -5.7600 -4.2865 -4.2865 -4.2072 -4.2072 -4.0387 -4.0387 2.7909 2.7909 3.0137 3.0137 3.3821 3.3821 4.5553 4.5553 4.9093 4.9093 5.3069 5.3069 5.5029 5.5029 5.9175 5.9175 5.9835 5.9835 6.2587 6.2587 6.8094 6.8094 7.0789 7.0789 7.5489 7.5489 7.9011 7.9011 7.9916 7.9916 8.2606 8.2606 8.4087 8.4087 8.5664 8.5664 8.6656 8.6656 8.7754 8.7754 9.1076 9.1076 9.2862 9.2862 9.8844 9.8844 10.0634 10.0634 10.4421 10.4421 k = 0.2128-0.3520-0.0573 ( 4412 PWs) bands (ev): -5.7236 -5.7236 -4.2799 -4.2799 -4.1971 -4.1971 -4.0331 -4.0331 2.8385 2.8385 3.0533 3.0533 3.4193 3.4193 4.4628 4.4628 4.8627 4.8627 5.2615 5.2615 5.5005 5.5005 5.8330 5.8330 5.9649 5.9649 6.2082 6.2082 6.7595 6.7595 7.0359 7.0359 7.5419 7.5419 7.8969 7.8969 8.0038 8.0038 8.2671 8.2671 8.4042 8.4042 8.5614 8.5614 8.6695 8.6695 8.7727 8.7727 9.0986 9.0986 9.2806 9.2806 9.8796 9.8796 10.0649 10.0649 10.4576 10.4576 k = 0.2234-0.3696-0.0602 ( 4411 PWs) bands (ev): -5.6858 -5.6858 -4.2734 -4.2734 -4.1868 -4.1868 -4.0278 -4.0278 2.8868 2.8868 3.0945 3.0945 3.4563 3.4563 4.3702 4.3702 4.8169 4.8169 5.2149 5.2149 5.4987 5.4987 5.7384 5.7384 5.9474 5.9474 6.1677 6.1677 6.7109 6.7109 6.9936 6.9936 7.5357 7.5357 7.8921 7.8921 8.0164 8.0164 8.2734 8.2734 8.3993 8.3993 8.5574 8.5574 8.6737 8.6737 8.7705 8.7705 9.0899 9.0899 9.2744 9.2744 9.8649 9.8649 10.0729 10.0729 10.4727 10.4727 k = 0.2340-0.3872-0.0631 ( 4412 PWs) bands (ev): -5.6466 -5.6466 -4.2670 -4.2670 -4.1762 -4.1762 -4.0230 -4.0230 2.9356 2.9356 3.1372 3.1372 3.4928 3.4928 4.2785 4.2785 4.7723 4.7723 5.1671 5.1671 5.4967 5.4967 5.6397 5.6397 5.9299 5.9299 6.1336 6.1336 6.6636 6.6636 6.9523 6.9523 7.5300 7.5300 7.8866 7.8866 8.0293 8.0293 8.2792 8.2792 8.3946 8.3946 8.5543 8.5543 8.6776 8.6776 8.7688 8.7688 9.0817 9.0817 9.2674 9.2674 9.8442 9.8442 10.0829 10.0829 10.4875 10.4875 k = 0.2447-0.4048-0.0659 ( 4413 PWs) bands (ev): -5.6061 -5.6061 -4.2606 -4.2606 -4.1654 -4.1654 -4.0187 -4.0187 2.9843 2.9843 3.1814 3.1814 3.5282 3.5282 4.1882 4.1882 4.7294 4.7294 5.1182 5.1182 5.4897 5.4897 5.5453 5.5453 5.9121 5.9121 6.1035 6.1035 6.6179 6.6179 6.9120 6.9120 7.5249 7.5249 7.8808 7.8808 8.0422 8.0422 8.2845 8.2845 8.3902 8.3902 8.5522 8.5522 8.6807 8.6807 8.7675 8.7675 9.0739 9.0739 9.2598 9.2598 9.8199 9.8199 10.0918 10.0918 10.5022 10.5022 k = 0.2553-0.4224-0.0688 ( 4416 PWs) bands (ev): -5.5643 -5.5643 -4.2543 -4.2543 -4.1544 -4.1544 -4.0150 -4.0150 3.0327 3.0327 3.2267 3.2267 3.5618 3.5618 4.1003 4.1003 4.6886 4.6886 5.0680 5.0680 5.4294 5.4294 5.5063 5.5063 5.8940 5.8940 6.0758 6.0758 6.5736 6.5736 6.8729 6.8729 7.5203 7.5203 7.8749 7.8749 8.0549 8.0549 8.2890 8.2890 8.3866 8.3866 8.5510 8.5510 8.6826 8.6826 8.7664 8.7664 9.0664 9.0664 9.2516 9.2516 9.7937 9.7937 10.0975 10.0975 10.5169 10.5169 k = 0.2660-0.4400-0.0717 ( 4414 PWs) bands (ev): -5.5213 -5.5213 -4.2483 -4.2483 -4.1434 -4.1434 -4.0121 -4.0121 3.0800 3.0800 3.2729 3.2729 3.5930 3.5930 4.0157 4.0157 4.6502 4.6502 5.0161 5.0161 5.3385 5.3385 5.5028 5.5028 5.8756 5.8756 6.0496 6.0496 6.5308 6.5308 6.8351 6.8351 7.5161 7.5161 7.8688 7.8688 8.0675 8.0675 8.2927 8.2927 8.3840 8.3840 8.5510 8.5510 8.6831 8.6831 8.7655 8.7655 9.0595 9.0595 9.2429 9.2429 9.7661 9.7661 10.0992 10.0992 10.5316 10.5316 k = 0.2766-0.4576-0.0745 ( 4414 PWs) bands (ev): -5.4773 -5.4773 -4.2424 -4.2424 -4.1323 -4.1323 -4.0099 -4.0099 3.1258 3.1258 3.3197 3.3197 3.6205 3.6205 3.9358 3.9358 4.6142 4.6142 4.9617 4.9617 5.2524 5.2524 5.5017 5.5017 5.8568 5.8568 6.0245 6.0245 6.4896 6.4896 6.7985 6.7985 7.5123 7.5123 7.8628 7.8628 8.0796 8.0796 8.2956 8.2956 8.3824 8.3824 8.5519 8.5519 8.6821 8.6821 8.7644 8.7644 9.0530 9.0530 9.2339 9.2339 9.7376 9.7376 10.0966 10.0966 10.5462 10.5462 k = 0.2872-0.4752-0.0774 ( 4414 PWs) bands (ev): -5.4322 -5.4322 -4.2369 -4.2369 -4.1212 -4.1212 -4.0088 -4.0088 3.1691 3.1691 3.3665 3.3665 3.6427 3.6427 3.8628 3.8628 4.5799 4.5799 4.9043 4.9043 5.1763 5.1763 5.5010 5.5010 5.8380 5.8380 6.0001 6.0001 6.4498 6.4498 6.7631 6.7631 7.5089 7.5089 7.8571 7.8571 8.0911 8.0911 8.2978 8.2978 8.3818 8.3818 8.5538 8.5538 8.6796 8.6796 8.7629 8.7629 9.0469 9.0469 9.2244 9.2244 9.7085 9.7085 10.0899 10.0899 10.5606 10.5606 k = 0.2979-0.4928-0.0802 ( 4421 PWs) bands (ev): -5.3863 -5.3863 -4.2317 -4.2317 -4.1103 -4.1103 -4.0085 -4.0085 3.2089 3.2089 3.4122 3.4122 3.6554 3.6554 3.8023 3.8023 4.5463 4.5463 4.8445 4.8445 5.1127 5.1127 5.4998 5.4998 5.8190 5.8190 5.9764 5.9764 6.4115 6.4115 6.7288 6.7288 7.5057 7.5057 7.8516 7.8516 8.1018 8.1018 8.2994 8.2994 8.3821 8.3821 8.5566 8.5566 8.6759 8.6759 8.7607 8.7607 9.0412 9.0412 9.2147 9.2147 9.6787 9.6787 10.0796 10.0796 10.5743 10.5743 k = 0.3085-0.5104-0.0831 ( 4417 PWs) bands (ev): -5.3395 -5.3395 -4.2270 -4.2270 -4.0994 -4.0994 -4.0094 -4.0094 3.2437 3.2437 3.4542 3.4542 3.6505 3.6505 3.7657 3.7657 4.5106 4.5106 4.7856 4.7856 5.0625 5.0625 5.4980 5.4980 5.8002 5.8002 5.9534 5.9534 6.3747 6.3747 6.6956 6.6956 7.5029 7.5029 7.8467 7.8467 8.1116 8.1116 8.3008 8.3008 8.3831 8.3831 8.5603 8.5603 8.6712 8.6712 8.7578 8.7578 9.0358 9.0358 9.2047 9.2047 9.6484 9.6484 10.0666 10.0666 10.5873 10.5873 k = 0.3191-0.5280-0.0860 ( 4419 PWs) bands (ev): -5.2921 -5.2921 -4.2227 -4.2227 -4.0888 -4.0888 -4.0112 -4.0112 3.2715 3.2715 3.4853 3.4853 3.6321 3.6321 3.7573 3.7573 4.4695 4.4695 4.7326 4.7326 5.0252 5.0252 5.4952 5.4952 5.7818 5.7818 5.9313 5.9313 6.3395 6.3395 6.6634 6.6634 7.5002 7.5002 7.8423 7.8423 8.1202 8.1202 8.3022 8.3022 8.3847 8.3847 8.5645 8.5645 8.6656 8.6656 8.7538 8.7538 9.0307 9.0307 9.1944 9.1944 9.6178 9.6178 10.0515 10.0515 10.5992 10.5992 k = 0.3298-0.5456-0.0888 ( 4419 PWs) bands (ev): -5.2441 -5.2441 -4.2192 -4.2192 -4.0786 -4.0786 -4.0141 -4.0141 3.2895 3.2895 3.4914 3.4914 3.6310 3.6310 3.7632 3.7632 4.4197 4.4197 4.6907 4.6907 4.9995 4.9995 5.4909 5.4909 5.7640 5.7640 5.9104 5.9104 6.3057 6.3057 6.6319 6.6319 7.4978 7.4978 7.8385 7.8385 8.1276 8.1276 8.3038 8.3038 8.3867 8.3867 8.5692 8.5692 8.6597 8.6597 8.7489 8.7489 9.0258 9.0258 9.1839 9.1839 9.5869 9.5869 10.0351 10.0351 10.6098 10.6098 k = 0.3404-0.5632-0.0917 ( 4417 PWs) bands (ev): -5.1956 -5.1956 -4.2164 -4.2164 -4.0688 -4.0688 -4.0179 -4.0179 3.2937 3.2937 3.4760 3.4760 3.6555 3.6555 3.7749 3.7749 4.3609 4.3609 4.6619 4.6619 4.9841 4.9841 5.4849 5.4849 5.7470 5.7470 5.8910 5.8910 6.2736 6.2736 6.6010 6.6010 7.4956 7.4956 7.8355 7.8355 8.1334 8.1334 8.3057 8.3057 8.3890 8.3890 8.5737 8.5737 8.6539 8.6539 8.7428 8.7428 9.0208 9.0208 9.1732 9.1732 9.5560 9.5560 10.0179 10.0179 10.6188 10.6188 k = 0.3511-0.5808-0.0946 ( 4416 PWs) bands (ev): -5.1469 -5.1469 -4.2147 -4.2147 -4.0597 -4.0597 -4.0223 -4.0223 3.2816 3.2816 3.4600 3.4600 3.6870 3.6870 3.7928 3.7928 4.2956 4.2956 4.6448 4.6448 4.9775 4.9775 5.4769 5.4769 5.7311 5.7311 5.8735 5.8735 6.2431 6.2431 6.5707 6.5707 7.4935 7.4935 7.8332 7.8332 8.1376 8.1376 8.3082 8.3082 8.3916 8.3916 8.5775 8.5775 8.6489 8.6489 8.7358 8.7358 9.0158 9.0158 9.1623 9.1623 9.5253 9.5253 10.0006 10.0006 10.6254 10.6254 k = 0.3617-0.5984-0.0974 ( 4410 PWs) bands (ev): -5.0980 -5.0980 -4.2142 -4.2142 -4.0521 -4.0521 -4.0265 -4.0265 3.2560 3.2560 3.4504 3.4504 3.7119 3.7119 3.8210 3.8210 4.2278 4.2278 4.6364 4.6364 4.9784 4.9784 5.4668 5.4668 5.7163 5.7163 5.8584 5.8584 6.2142 6.2142 6.5407 6.5407 7.4916 7.4916 7.8318 7.8318 8.1401 8.1401 8.3111 8.3111 8.3945 8.3945 8.5798 8.5798 8.6456 8.6456 8.7280 8.7280 9.0106 9.0106 9.1510 9.1510 9.4950 9.4950 9.9836 9.9836 10.6276 10.6276 k = 0.3723-0.6160-0.1003 ( 4408 PWs) bands (ev): -5.0492 -5.0492 -4.2153 -4.2153 -4.0481 -4.0481 -4.0281 -4.0281 3.2234 3.2234 3.4441 3.4441 3.7259 3.7259 3.8600 3.8600 4.1605 4.1605 4.6346 4.6346 4.9849 4.9849 5.4549 5.4549 5.7029 5.7029 5.8460 5.8460 6.1870 6.1870 6.5110 6.5110 7.4899 7.4899 7.8312 7.8312 8.1409 8.1409 8.3143 8.3143 8.3978 8.3978 8.5797 8.5797 8.6447 8.6447 8.7198 8.7198 9.0052 9.0052 9.1395 9.1395 9.4654 9.4654 9.9670 9.9670 10.6203 10.6203 k = 0.3830-0.6336-0.1032 ( 4407 PWs) bands (ev): -5.0005 -5.0005 -4.2182 -4.2182 -4.0498 -4.0498 -4.0248 -4.0248 3.1890 3.1890 3.4379 3.4379 3.7316 3.7316 3.9050 3.9050 4.0971 4.0971 4.6378 4.6378 4.9949 4.9949 5.4418 5.4418 5.6906 5.6906 5.8368 5.8368 6.1615 6.1615 6.4815 6.4815 7.4883 7.4883 7.8315 7.8315 8.1401 8.1401 8.3176 8.3176 8.4017 8.4017 8.5771 8.5771 8.6459 8.6459 8.7114 8.7114 8.9996 8.9996 9.1276 9.1276 9.4368 9.4368 9.9511 9.9511 10.5987 10.5987 k = 0.3936-0.6512-0.1060 ( 4408 PWs) bands (ev): -4.9522 -4.9522 -4.2234 -4.2234 -4.0549 -4.0549 -4.0188 -4.0188 3.1558 3.1558 3.4300 3.4300 3.7324 3.7324 3.9462 3.9462 4.0448 4.0448 4.6449 4.6449 5.0057 5.0057 5.4289 5.4289 5.6795 5.6795 5.8307 5.8307 6.1376 6.1376 6.4524 6.4524 7.4868 7.4868 7.8325 7.8325 8.1377 8.1377 8.3208 8.3208 8.4064 8.4064 8.5727 8.5727 8.6480 8.6480 8.7040 8.7040 8.9939 8.9939 9.1154 9.1154 9.4095 9.4095 9.9361 9.9361 10.5679 10.5679 k = 0.4043-0.6688-0.1089 ( 4410 PWs) bands (ev): -4.9045 -4.9045 -4.2312 -4.2312 -4.0606 -4.0606 -4.0123 -4.0123 3.1253 3.1253 3.4200 3.4200 3.7298 3.7298 3.9467 3.9467 4.0395 4.0395 4.6551 4.6551 5.0145 5.0145 5.4178 5.4178 5.6696 5.6696 5.8278 5.8278 6.1153 6.1153 6.4236 6.4236 7.4854 7.4854 7.8343 7.8343 8.1340 8.1340 8.3235 8.3235 8.4118 8.4118 8.5673 8.5673 8.6488 8.6488 8.6989 8.6989 8.9882 8.9882 9.1029 9.1029 9.3839 9.3839 9.9221 9.9221 10.5350 10.5350 k = 0.4149-0.6864-0.1118 ( 4410 PWs) bands (ev): -4.8577 -4.8577 -4.2419 -4.2419 -4.0659 -4.0659 -4.0060 -4.0060 3.0983 3.0983 3.4080 3.4080 3.7251 3.7251 3.9058 3.9058 4.0812 4.0812 4.6676 4.6676 5.0186 5.0186 5.4104 5.4104 5.6608 5.6608 5.8278 5.8278 6.0946 6.0946 6.3954 6.3954 7.4842 7.4842 7.8368 7.8368 8.1292 8.1292 8.3256 8.3256 8.4182 8.4182 8.5617 8.5617 8.6459 8.6459 8.6979 8.6979 8.9826 8.9826 9.0902 9.0902 9.3602 9.3602 9.9093 9.9093 10.5032 10.5032 k = 0.4255-0.7040-0.1146 ( 4408 PWs) bands (ev): -4.8120 -4.8120 -4.2554 -4.2554 -4.0706 -4.0706 -4.0003 -4.0003 3.0750 3.0750 3.3944 3.3944 3.7190 3.7190 3.8624 3.8624 4.1307 4.1307 4.6817 4.6817 5.0158 5.0158 5.4081 5.4081 5.6534 5.6534 5.8302 5.8302 6.0753 6.0753 6.3682 6.3682 7.4831 7.4831 7.8398 7.8398 8.1235 8.1235 8.3271 8.3271 8.4253 8.4253 8.5565 8.5565 8.6389 8.6389 8.7010 8.7010 8.9774 8.9774 9.0775 9.0775 9.3387 9.3387 9.8975 9.8975 10.4739 10.4739 k = 0.4362-0.7216-0.1175 ( 4407 PWs) bands (ev): -4.7679 -4.7679 -4.2717 -4.2717 -4.0744 -4.0744 -3.9952 -3.9952 3.0556 3.0556 3.3800 3.3800 3.7123 3.7123 3.8235 3.8235 4.1800 4.1800 4.6970 4.6970 5.0051 5.0051 5.4111 5.4111 5.6475 5.6475 5.8346 5.8346 6.0575 6.0575 6.3424 6.3424 7.4822 7.4822 7.8432 7.8432 8.1173 8.1173 8.3280 8.3280 8.4331 8.4331 8.5521 8.5521 8.6289 8.6289 8.7068 8.7068 8.9727 8.9727 9.0649 9.0649 9.3196 9.3196 9.8872 9.8872 10.4479 10.4479 k = 0.4468-0.7392-0.1204 ( 4410 PWs) bands (ev): -4.7259 -4.7259 -4.2902 -4.2902 -4.0773 -4.0773 -3.9908 -3.9908 3.0399 3.0399 3.3655 3.3655 3.7056 3.7056 3.7904 3.7904 4.2268 4.2268 4.7131 4.7131 4.9873 4.9873 5.4183 5.4183 5.6432 5.6432 5.8404 5.8404 6.0411 6.0411 6.3186 6.3186 7.4813 7.4813 7.8468 7.8468 8.1110 8.1110 8.3284 8.3284 8.4412 8.4412 8.5488 8.5488 8.6174 8.6174 8.7135 8.7135 8.9687 8.9687 9.0528 9.0528 9.3031 9.3031 9.8781 9.8781 10.4256 10.4256 k = 0.4574-0.7568-0.1232 ( 4409 PWs) bands (ev): -4.6868 -4.6868 -4.3103 -4.3103 -4.0794 -4.0794 -3.9871 -3.9871 3.0277 3.0277 3.3518 3.3518 3.6995 3.6995 3.7636 3.7636 4.2694 4.2694 4.7297 4.7297 4.9640 4.9640 5.4278 5.4278 5.6406 5.6406 5.8471 5.8471 6.0261 6.0261 6.2976 6.2976 7.4807 7.4807 7.8503 7.8503 8.1050 8.1050 8.3284 8.3284 8.4492 8.4492 8.5470 8.5470 8.6052 8.6052 8.7201 8.7201 8.9657 8.9657 9.0416 9.0416 9.2894 9.2894 9.8705 9.8705 10.4073 10.4073 k = 0.4681-0.7744-0.1261 ( 4407 PWs) bands (ev): -4.6518 -4.6518 -4.3305 -4.3305 -4.0809 -4.0809 -3.9842 -3.9842 3.0187 3.0187 3.3397 3.3397 3.6943 3.6943 3.7428 3.7428 4.3057 4.3057 4.7466 4.7466 4.9378 4.9378 5.4375 5.4375 5.6394 5.6394 5.8539 5.8539 6.0130 6.0130 6.2802 6.2802 7.4801 7.4801 7.8534 7.8534 8.0997 8.0997 8.3282 8.3282 8.4564 8.4564 8.5471 8.5471 8.5931 8.5931 8.7260 8.7260 8.9635 8.9635 9.0319 9.0319 9.2787 9.2787 9.8645 9.8645 10.3930 10.3930 k = 0.4787-0.7920-0.1290 ( 4414 PWs) bands (ev): -4.6229 -4.6229 -4.3490 -4.3490 -4.0818 -4.0818 -3.9821 -3.9821 3.0126 3.0126 3.3304 3.3304 3.6906 3.6906 3.7280 3.7280 4.3339 4.3339 4.7632 4.7632 4.9119 4.9119 5.4455 5.4455 5.6393 5.6393 5.8601 5.8601 6.0024 6.0024 6.2670 6.2670 7.4797 7.4797 7.8559 7.8559 8.0955 8.0955 8.3280 8.3280 8.4623 8.4623 8.5492 8.5492 8.5815 8.5815 8.7305 8.7305 8.9623 8.9623 9.0241 9.0241 9.2709 9.2709 9.8602 9.8602 10.3827 10.3827 k = 0.4894-0.8096-0.1318 ( 4417 PWs) bands (ev): -4.6030 -4.6030 -4.3625 -4.3625 -4.0823 -4.0823 -3.9809 -3.9809 3.0091 3.0091 3.3244 3.3244 3.6884 3.6884 3.7191 3.7191 4.3518 4.3518 4.7773 4.7773 4.8910 4.8910 5.4507 5.4507 5.6396 5.6396 5.8646 5.8646 5.9953 5.9953 6.2588 6.2588 7.4795 7.4795 7.8575 7.8575 8.0928 8.0928 8.3278 8.3278 8.4662 8.4662 8.5536 8.5536 8.5710 8.5710 8.7334 8.7334 8.9618 8.9618 9.0191 9.0191 9.2663 9.2663 9.8575 9.8575 10.3766 10.3766 k = 0.5000-0.8272-0.1347 ( 4418 PWs) bands (ev): -4.5959 -4.5959 -4.3676 -4.3676 -4.0825 -4.0825 -3.9805 -3.9805 3.0079 3.0079 3.3224 3.3224 3.6877 3.6877 3.7161 3.7161 4.3580 4.3580 4.7835 4.7835 4.8824 4.8824 5.4525 5.4525 5.6398 5.6398 5.8662 5.8662 5.9927 5.9927 6.2561 6.2561 7.4795 7.4795 7.8580 7.8580 8.0919 8.0919 8.3277 8.3277 8.4675 8.4675 8.5580 8.5580 8.5645 8.5645 8.7344 8.7344 8.9616 8.9616 9.0173 9.0173 9.2647 9.2647 9.8566 9.8566 10.3745 10.3745 k = 0.5000-0.8272 0.4637 ( 4404 PWs) bands (ev): -4.4815 -4.4815 -4.2465 -4.2465 -4.1944 -4.1944 -4.0834 -4.0834 2.4694 2.4694 2.6239 2.6239 3.0860 3.0860 4.3250 4.3250 4.9187 4.9187 4.9780 4.9780 5.5715 5.5715 5.6395 5.6395 5.7865 5.7865 6.0907 6.0907 6.2352 6.2352 6.3695 6.3695 7.2794 7.2794 7.6564 7.6564 8.1301 8.1301 8.2572 8.2572 8.5431 8.5431 8.5507 8.5507 8.7079 8.7079 8.7581 8.7581 8.8467 8.8467 9.4530 9.4530 9.7223 9.7223 9.7640 9.7640 10.3263 10.3263 k = 0.4904-0.8113 0.4547 ( 4400 PWs) bands (ev): -4.4843 -4.4843 -4.2490 -4.2490 -4.1944 -4.1944 -4.0805 -4.0805 2.4723 2.4723 2.6258 2.6258 3.0875 3.0875 4.3261 4.3261 4.8859 4.8859 5.0076 5.0076 5.5715 5.5715 5.6395 5.6395 5.7852 5.7852 6.0909 6.0909 6.2349 6.2349 6.3684 6.3684 7.2798 7.2798 7.6568 7.6568 8.1305 8.1305 8.2574 8.2574 8.5428 8.5428 8.5512 8.5512 8.7076 8.7076 8.7584 8.7584 8.8471 8.8471 9.4473 9.4473 9.6977 9.6977 9.7927 9.7927 10.3232 10.3232 k = 0.4808-0.7954 0.4458 ( 4399 PWs) bands (ev): -4.4926 -4.4926 -4.2557 -4.2557 -4.1942 -4.1942 -4.0724 -4.0724 2.4808 2.4808 2.6314 2.6314 3.0923 3.0923 4.3295 4.3295 4.8324 4.8324 5.0518 5.0518 5.5713 5.5713 5.6395 5.6395 5.7815 5.7815 6.0915 6.0915 6.2337 6.2337 6.3651 6.3651 7.2809 7.2809 7.6581 7.6581 8.1317 8.1317 8.2582 8.2582 8.5420 8.5420 8.5524 8.5524 8.7066 8.7066 8.7593 8.7593 8.8483 8.8483 9.4310 9.4310 9.6637 9.6637 9.8383 9.8383 10.3203 10.3203 k = 0.4712-0.7795 0.4369 ( 4405 PWs) bands (ev): -4.5064 -4.5064 -4.2648 -4.2648 -4.1941 -4.1941 -4.0607 -4.0607 2.4948 2.4948 2.6408 2.6408 3.1001 3.1001 4.3348 4.3348 4.7747 4.7747 5.0938 5.0938 5.5707 5.5707 5.6395 5.6395 5.7760 5.7760 6.0924 6.0924 6.2317 6.2317 6.3599 6.3599 7.2827 7.2827 7.6601 7.6601 8.1337 8.1337 8.2594 8.2594 8.5408 8.5408 8.5544 8.5544 8.7047 8.7047 8.7611 8.7611 8.8502 8.8502 9.4062 9.4062 9.6319 9.6319 9.8875 9.8875 10.3192 10.3192 k = 0.4615-0.7636 0.4280 ( 4411 PWs) bands (ev): -4.5257 -4.5257 -4.2746 -4.2746 -4.1941 -4.1941 -4.0470 -4.0470 2.5142 2.5142 2.6540 2.6540 3.1112 3.1112 4.3419 4.3419 4.7151 4.7151 5.1312 5.1312 5.5689 5.5689 5.6397 5.6397 5.7696 5.7696 6.0934 6.0934 6.2290 6.2290 6.3535 6.3535 7.2853 7.2853 7.6628 7.6628 8.1364 8.1364 8.2608 8.2608 8.5395 8.5395 8.5570 8.5570 8.7016 8.7016 8.7638 8.7638 8.8531 8.8531 9.3754 9.3754 9.6026 9.6026 9.9383 9.9383 10.3196 10.3196 k = 0.4519-0.7477 0.4191 ( 4411 PWs) bands (ev): -4.5501 -4.5501 -4.2842 -4.2842 -4.1942 -4.1942 -4.0327 -4.0327 2.5385 2.5385 2.6712 2.6712 3.1254 3.1254 4.3499 4.3499 4.6552 4.6552 5.1629 5.1629 5.5652 5.5652 5.6392 5.6392 5.7643 5.7643 6.0942 6.0942 6.2259 6.2259 6.3465 6.3465 7.2885 7.2885 7.6664 7.6664 8.1398 8.1398 8.2623 8.2623 8.5380 8.5380 8.5603 8.5603 8.6972 8.6972 8.7675 8.7675 8.8570 8.8570 9.3414 9.3414 9.5750 9.5750 9.9895 9.9895 10.3212 10.3212 k = 0.4423-0.7318 0.4102 ( 4409 PWs) bands (ev): -4.5791 -4.5791 -4.2930 -4.2930 -4.1943 -4.1943 -4.0185 -4.0185 2.5672 2.5672 2.6925 2.6925 3.1428 3.1428 4.3573 4.3573 4.5970 4.5970 5.1879 5.1879 5.5591 5.5591 5.6367 5.6367 5.7627 5.7627 6.0943 6.0943 6.2227 6.2227 6.3397 6.3397 7.2925 7.2925 7.6707 7.6707 8.1437 8.1437 8.2636 8.2636 8.5365 8.5365 8.5642 8.5642 8.6915 8.6915 8.7719 8.7719 8.8621 8.8621 9.3063 9.3063 9.5485 9.5485 10.0403 10.0403 10.3238 10.3238 k = 0.4327-0.7159 0.4012 ( 4411 PWs) bands (ev): -4.6122 -4.6122 -4.3008 -4.3008 -4.1946 -4.1946 -4.0050 -4.0050 2.5996 2.5996 2.7182 2.7182 3.1634 3.1634 4.3602 4.3602 4.5446 4.5446 5.2057 5.2057 5.5498 5.5498 5.6303 5.6303 5.7678 5.7678 6.0932 6.0932 6.2202 6.2202 6.3336 6.3336 7.2971 7.2971 7.6756 7.6756 8.1480 8.1480 8.2645 8.2645 8.5347 8.5347 8.5686 8.5686 8.6849 8.6849 8.7767 8.7767 8.8686 8.8686 9.2716 9.2716 9.5230 9.5230 10.0900 10.0900 10.3271 10.3271 k = 0.4231-0.7000 0.3923 ( 4413 PWs) bands (ev): -4.6487 -4.6487 -4.3079 -4.3079 -4.1950 -4.1950 -3.9926 -3.9926 2.6349 2.6349 2.7485 2.7485 3.1873 3.1873 4.3499 4.3499 4.5069 4.5069 5.2158 5.2158 5.5369 5.5369 5.6194 5.6194 5.7807 5.7807 6.0905 6.0905 6.2190 6.2190 6.3291 6.3291 7.3023 7.3023 7.6811 7.6811 8.1528 8.1528 8.2649 8.2649 8.5329 8.5329 8.5732 8.5732 8.6777 8.6777 8.7813 8.7813 8.8766 8.8766 9.2384 9.2384 9.4985 9.4985 10.1378 10.1378 10.3315 10.3315 k = 0.4135-0.6840 0.3834 ( 4410 PWs) bands (ev): -4.6880 -4.6880 -4.3142 -4.3142 -4.1955 -4.1955 -3.9815 -3.9815 2.6723 2.6723 2.7837 2.7837 3.2145 3.2145 4.3175 4.3175 4.4933 4.4933 5.2182 5.2182 5.5199 5.5199 5.6056 5.6056 5.8009 5.8009 6.0863 6.0863 6.2194 6.2194 6.3266 6.3266 7.3081 7.3081 7.6872 7.6872 8.1578 8.1578 8.2645 8.2645 8.5308 8.5308 8.5776 8.5776 8.6708 8.6708 8.7854 8.7854 8.8865 8.8865 9.2075 9.2075 9.4751 9.4751 10.1826 10.1826 10.3372 10.3372 k = 0.4038-0.6681 0.3745 ( 4407 PWs) bands (ev): -4.7298 -4.7298 -4.3199 -4.3199 -4.1961 -4.1961 -3.9718 -3.9718 2.7108 2.7108 2.8236 2.8236 3.2452 3.2452 4.2674 4.2674 4.4995 4.4995 5.2131 5.2131 5.4980 5.4980 5.5910 5.5910 5.8263 5.8263 6.0812 6.0812 6.2211 6.2211 6.3267 6.3267 7.3144 7.3144 7.6938 7.6938 8.1629 8.1629 8.2633 8.2633 8.5285 8.5285 8.5809 8.5809 8.6651 8.6651 8.7887 8.7887 8.8981 8.8981 9.1793 9.1793 9.4529 9.4529 10.2229 10.2229 10.3456 10.3456 k = 0.3942-0.6522 0.3656 ( 4411 PWs) bands (ev): -4.7734 -4.7734 -4.3252 -4.3252 -4.1967 -4.1967 -3.9637 -3.9637 2.7500 2.7500 2.8679 2.8679 3.2795 3.2795 4.2093 4.2093 4.5163 4.5163 5.2011 5.2011 5.4709 5.4709 5.5775 5.5775 5.8549 5.8549 6.0769 6.0769 6.2234 6.2234 6.3302 6.3302 7.3212 7.3212 7.7009 7.7009 8.1681 8.1681 8.2613 8.2613 8.5257 8.5257 8.5819 8.5819 8.6618 8.6618 8.7907 8.7907 8.9114 8.9114 9.1543 9.1543 9.4323 9.4323 10.2557 10.2557 10.3593 10.3593 k = 0.3846-0.6363 0.3567 ( 4407 PWs) bands (ev): -4.8186 -4.8186 -4.3301 -4.3301 -4.1975 -4.1975 -3.9571 -3.9571 2.7895 2.7895 2.9154 2.9154 3.3175 3.3175 4.1486 4.1486 4.5384 4.5384 5.1830 5.1830 5.4392 5.4392 5.5659 5.5659 5.8845 5.8845 6.0750 6.0750 6.2254 6.2254 6.3377 6.3377 7.3285 7.3285 7.7083 7.7083 8.1731 8.1731 8.2587 8.2587 8.5224 8.5224 8.5798 8.5798 8.6619 8.6619 8.7916 8.7916 8.9264 8.9264 9.1329 9.1329 9.4134 9.4134 10.2779 10.2779 10.3810 10.3810 k = 0.3750-0.6204 0.3477 ( 4409 PWs) bands (ev): -4.8650 -4.8650 -4.3347 -4.3347 -4.1984 -4.1984 -3.9521 -3.9521 2.8294 2.8294 2.9648 2.9648 3.3593 3.3593 4.0882 4.0882 4.5637 4.5637 5.1599 5.1599 5.4037 5.4037 5.5563 5.5563 5.9123 5.9123 6.0782 6.0782 6.2264 6.2264 6.3494 6.3494 7.3360 7.3360 7.7162 7.7162 8.1777 8.1777 8.2556 8.2556 8.5184 8.5184 8.5747 8.5747 8.6653 8.6653 8.7912 8.7912 8.9428 8.9428 9.1150 9.1150 9.3963 9.3963 10.2898 10.2898 10.4105 10.4105 k = 0.3654-0.6045 0.3388 ( 4411 PWs) bands (ev): -4.9124 -4.9124 -4.3391 -4.3391 -4.1994 -4.1994 -3.9486 -3.9486 2.8696 2.8696 3.0141 3.0141 3.4045 3.4045 4.0303 4.0303 4.5908 4.5908 5.1331 5.1331 5.3656 5.3656 5.5485 5.5485 5.9356 5.9356 6.0889 6.0889 6.2265 6.2265 6.3651 6.3651 7.3438 7.3438 7.7244 7.7244 8.1817 8.1817 8.2523 8.2523 8.5135 8.5135 8.5674 8.5674 8.6710 8.6710 8.7898 8.7898 8.9604 8.9604 9.1008 9.1008 9.3811 9.3811 10.2947 10.2947 10.4442 10.4442 k = 0.3558-0.5886 0.3299 ( 4419 PWs) bands (ev): -4.9605 -4.9605 -4.3432 -4.3432 -4.2005 -4.2005 -3.9465 -3.9465 2.9100 2.9100 3.0617 3.0617 3.4520 3.4520 3.9774 3.9774 4.6186 4.6186 5.1043 5.1043 5.3259 5.3259 5.5422 5.5422 5.9523 5.9523 6.1084 6.1084 6.2262 6.2262 6.3845 6.3845 7.3518 7.3518 7.7328 7.7328 8.1845 8.1845 8.2492 8.2492 8.5076 8.5076 8.5591 8.5591 8.6777 8.6777 8.7879 8.7879 8.9790 8.9790 9.0902 9.0902 9.3680 9.3680 10.2954 10.2954 10.4794 10.4794 k = 0.3462-0.5727 0.3210 ( 4414 PWs) bands (ev): -5.0091 -5.0091 -4.3472 -4.3472 -4.2017 -4.2017 -3.9458 -3.9458 2.9505 2.9505 3.1056 3.1056 3.4991 3.4991 3.9334 3.9334 4.6459 4.6459 5.0753 5.0753 5.2859 5.2859 5.5371 5.5371 5.9632 5.9632 6.1348 6.1348 6.2272 6.2272 6.4072 6.4072 7.3600 7.3600 7.7415 7.7415 8.1856 8.1856 8.2470 8.2470 8.5006 8.5006 8.5508 8.5508 8.6841 8.6841 8.7860 8.7860 8.9984 8.9984 9.0832 9.0832 9.3572 9.3572 10.2935 10.2935 10.5146 10.5146 k = 0.3365-0.5568 0.3121 ( 4417 PWs) bands (ev): -5.0580 -5.0580 -4.3509 -4.3509 -4.2030 -4.2030 -3.9464 -3.9464 2.9904 2.9904 3.1442 3.1442 3.5400 3.5400 3.9053 3.9053 4.6713 4.6713 5.0486 5.0486 5.2469 5.2469 5.5330 5.5330 5.9702 5.9702 6.1615 6.1615 6.2338 6.2338 6.4328 6.4328 7.3682 7.3682 7.7504 7.7504 8.1845 8.1845 8.2461 8.2461 8.4926 8.4926 8.5427 8.5427 8.6890 8.6890 8.7847 8.7847 9.0180 9.0180 9.0797 9.0797 9.3485 9.3485 10.2895 10.2895 10.5490 10.5490 k = 0.3269-0.5409 0.3032 ( 4421 PWs) bands (ev): -5.1070 -5.1070 -4.3545 -4.3545 -4.2044 -4.2044 -3.9483 -3.9483 3.0294 3.0294 3.1758 3.1758 3.5660 3.5660 3.9024 3.9024 4.6928 4.6928 5.0267 5.0267 5.2104 5.2104 5.5297 5.5297 5.9755 5.9755 6.1784 6.1784 6.2541 6.2541 6.4608 6.4608 7.3765 7.3765 7.7595 7.7595 8.1810 8.1810 8.2468 8.2468 8.4837 8.4837 8.5352 8.5352 8.6917 8.6917 8.7847 8.7847 9.0367 9.0367 9.0806 9.0806 9.3423 9.3423 10.2838 10.2838 10.5823 10.5823 k = 0.3173-0.5250 0.2942 ( 4418 PWs) bands (ev): -5.1559 -5.1559 -4.3579 -4.3579 -4.2060 -4.2060 -3.9512 -3.9512 3.0663 3.0663 3.1987 3.1987 3.5721 3.5721 3.9308 3.9308 4.7082 4.7082 5.0120 5.0120 5.1786 5.1786 5.5272 5.5272 5.9803 5.9803 6.1831 6.1831 6.2893 6.2893 6.4912 6.4912 7.3847 7.3847 7.7687 7.7687 8.1753 8.1753 8.2489 8.2489 8.4744 8.4744 8.5283 8.5283 8.6917 8.6917 8.7863 8.7863 9.0519 9.0519 9.0880 9.0880 9.3386 9.3386 10.2767 10.2767 10.6141 10.6141 k = 0.3077-0.5091 0.2853 ( 4416 PWs) bands (ev): -5.2046 -5.2046 -4.3610 -4.3610 -4.2077 -4.2077 -3.9552 -3.9552 3.0997 3.0997 3.2117 3.2117 3.5637 3.5637 3.9856 3.9856 4.7164 4.7164 5.0053 5.0053 5.1543 5.1543 5.5252 5.5252 5.9854 5.9854 6.1818 6.1818 6.3321 6.3321 6.5238 6.5238 7.3928 7.3928 7.7781 7.7781 8.1676 8.1676 8.2520 8.2520 8.4651 8.4651 8.5219 8.5219 8.6892 8.6892 8.7893 8.7893 9.0614 9.0614 9.1033 9.1033 9.3377 9.3377 10.2682 10.2682 10.6441 10.6441 k = 0.2981-0.4931 0.2764 ( 4417 PWs) bands (ev): -5.2529 -5.2529 -4.3639 -4.3639 -4.2095 -4.2095 -3.9601 -3.9601 3.1264 3.1264 3.2160 3.2160 3.5504 3.5504 4.0570 4.0570 4.7185 4.7185 5.0037 5.0037 5.1421 5.1421 5.5238 5.5238 5.9911 5.9911 6.1783 6.1783 6.3784 6.3784 6.5584 6.5584 7.4007 7.4007 7.7875 7.7875 8.1584 8.1584 8.2557 8.2557 8.4560 8.4560 8.5159 8.5159 8.6848 8.6848 8.7931 8.7931 9.0675 9.0675 9.1238 9.1238 9.3399 9.3399 10.2586 10.2586 10.6716 10.6716 k = 0.2885-0.4772 0.2675 ( 4415 PWs) bands (ev): -5.3008 -5.3008 -4.3667 -4.3667 -4.2114 -4.2114 -3.9657 -3.9657 3.1387 3.1387 3.2181 3.2181 3.5382 3.5382 4.1372 4.1372 4.7177 4.7177 5.0019 5.0019 5.1471 5.1471 5.5228 5.5228 5.9976 5.9976 6.1739 6.1739 6.4266 6.4266 6.5952 6.5952 7.4084 7.4084 7.7969 7.7969 8.1481 8.1481 8.2595 8.2595 8.4474 8.4474 8.5103 8.5103 8.6791 8.6791 8.7973 8.7973 9.0727 9.0727 9.1459 9.1459 9.3457 9.3457 10.2478 10.2478 10.6948 10.6948 k = 0.2788-0.4613 0.2586 ( 4418 PWs) bands (ev): -5.3480 -5.3480 -4.3692 -4.3692 -4.2135 -4.2135 -3.9721 -3.9721 3.1282 3.1282 3.2274 3.2274 3.5284 3.5284 4.2207 4.2207 4.7189 4.7189 4.9976 4.9976 5.1699 5.1699 5.5224 5.5224 6.0049 6.0049 6.1692 6.1692 6.4757 6.4757 6.6340 6.6340 7.4159 7.4159 7.8063 7.8063 8.1369 8.1369 8.2631 8.2631 8.4394 8.4394 8.5052 8.5052 8.6728 8.6728 8.8011 8.8011 9.0778 9.0778 9.1678 9.1678 9.3557 9.3557 10.2359 10.2359 10.7088 10.7088 k = 0.2692-0.4454 0.2497 ( 4413 PWs) bands (ev): -5.3946 -5.3946 -4.3714 -4.3714 -4.2157 -4.2157 -3.9790 -3.9790 3.0995 3.0995 3.2413 3.2413 3.5197 3.5197 4.3033 4.3033 4.7265 4.7265 4.9936 4.9936 5.2069 5.2069 5.5226 5.5226 6.0130 6.0130 6.1646 6.1646 6.5253 6.5253 6.6750 6.6750 7.4231 7.4231 7.8158 7.8158 8.1249 8.1249 8.2663 8.2663 8.4323 8.4323 8.5009 8.5009 8.6663 8.6663 8.8046 8.8046 9.0831 9.0831 9.1883 9.1883 9.3707 9.3707 10.2230 10.2230 10.7101 10.7101 k = 0.2596-0.4295 0.2407 ( 4408 PWs) bands (ev): -5.4402 -5.4402 -4.3735 -4.3735 -4.2180 -4.2180 -3.9864 -3.9864 3.0610 3.0610 3.2535 3.2535 3.5099 3.5099 4.3809 4.3809 4.7444 4.7444 4.9932 4.9932 5.2546 5.2546 5.5233 5.5233 6.0221 6.0221 6.1603 6.1603 6.5750 6.5750 6.7182 6.7182 7.4300 7.4300 7.8251 7.8251 8.1124 8.1124 8.2688 8.2688 8.4260 8.4260 8.4976 8.4976 8.6598 8.6598 8.8073 8.8073 9.0887 9.0887 9.2064 9.2064 9.3911 9.3911 10.2089 10.2089 10.7030 10.7030 k = 0.2500-0.4136 0.2318 ( 4404 PWs) bands (ev): -5.4850 -5.4850 -4.3752 -4.3752 -4.2205 -4.2205 -3.9941 -3.9941 3.0174 3.0174 3.2610 3.2610 3.4976 3.4976 4.4505 4.4505 4.7749 4.7749 4.9989 4.9989 5.3108 5.3108 5.5247 5.5247 6.0318 6.0318 6.1568 6.1568 6.6244 6.6244 6.7637 6.7637 7.4365 7.4365 7.8344 7.8344 8.0994 8.0994 8.2703 8.2703 8.4204 8.4204 8.4955 8.4955 8.6537 8.6537 8.8093 8.8093 9.0943 9.0943 9.2215 9.2215 9.4172 9.4172 10.1936 10.1936 10.6912 10.6912 k = 0.2404-0.3977 0.2229 ( 4405 PWs) bands (ev): -5.5287 -5.5287 -4.3768 -4.3768 -4.2232 -4.2232 -4.0021 -4.0021 2.9712 2.9712 3.2624 3.2624 3.4820 3.4820 4.5110 4.5110 4.8167 4.8167 5.0127 5.0127 5.3744 5.3744 5.5271 5.5271 6.0422 6.0422 6.1542 6.1542 6.6733 6.6733 6.8113 6.8113 7.4428 7.4428 7.8434 7.8434 8.0860 8.0860 8.2708 8.2708 8.4156 8.4156 8.4950 8.4950 8.6480 8.6480 8.8105 8.8105 9.0999 9.0999 9.2336 9.2336 9.4485 9.4485 10.1771 10.1771 10.6760 10.6760 k = 0.2308-0.3818 0.2140 ( 4401 PWs) bands (ev): -5.5713 -5.5713 -4.3781 -4.3781 -4.2261 -4.2261 -4.0102 -4.0102 2.9239 2.9239 3.2573 3.2573 3.4628 3.4628 4.5645 4.5645 4.8649 4.8649 5.0362 5.0362 5.4446 5.4446 5.5312 5.5312 6.0531 6.0531 6.1531 6.1531 6.7216 6.7216 6.8611 6.8611 7.4486 7.4486 7.8522 7.8522 8.0725 8.0725 8.2702 8.2702 8.4113 8.4113 8.4965 8.4965 8.6430 8.6430 8.8112 8.8112 9.1057 9.1057 9.2432 9.2432 9.4842 9.4842 10.1593 10.1593 10.6583 10.6583 k = 0.2212-0.3659 0.2051 ( 4398 PWs) bands (ev): -5.6127 -5.6127 -4.3791 -4.3791 -4.2291 -4.2291 -4.0184 -4.0184 2.8764 2.8764 3.2456 3.2456 3.4405 3.4405 4.6143 4.6143 4.9130 4.9130 5.0707 5.0707 5.5114 5.5114 5.5470 5.5470 6.0642 6.0642 6.1541 6.1541 6.7693 6.7693 6.9128 6.9128 7.4542 7.4542 7.8608 7.8608 8.0588 8.0588 8.2683 8.2683 8.4075 8.4075 8.5000 8.5000 8.6387 8.6387 8.8113 8.8113 9.1115 9.1115 9.2508 9.2508 9.5235 9.5235 10.1401 10.1401 10.6384 10.6384 k = 0.2115-0.3500 0.1962 ( 4395 PWs) bands (ev): -5.6529 -5.6529 -4.3799 -4.3799 -4.2323 -4.2323 -4.0266 -4.0266 2.8295 2.8295 3.2275 3.2275 3.4155 3.4155 4.6633 4.6633 4.9568 4.9568 5.1151 5.1151 5.5313 5.5313 5.6174 5.6174 6.0751 6.0751 6.1582 6.1582 6.8165 6.8165 6.9660 6.9660 7.4595 7.4595 7.8689 7.8689 8.0450 8.0450 8.2653 8.2653 8.4040 8.4040 8.5056 8.5056 8.6353 8.6353 8.8110 8.8110 9.1173 9.1173 9.2566 9.2566 9.5656 9.5656 10.1193 10.1193 10.6170 10.6170 k = 0.2019-0.3341 0.1872 ( 4392 PWs) bands (ev): -5.6917 -5.6917 -4.3805 -4.3805 -4.2357 -4.2357 -4.0346 -4.0346 2.7835 2.7835 3.2038 3.2038 3.3886 3.3886 4.7131 4.7131 4.9965 4.9965 5.1654 5.1654 5.5388 5.5388 5.7067 5.7067 6.0854 6.0854 6.1669 6.1669 6.8632 6.8632 7.0206 7.0206 7.4646 7.4646 7.8766 7.8766 8.0314 8.0314 8.2612 8.2612 8.4008 8.4008 8.5133 8.5133 8.6329 8.6329 8.8103 8.8103 9.1232 9.1232 9.2609 9.2609 9.6098 9.6098 10.0969 10.0969 10.5944 10.5944 k = 0.1923-0.3182 0.1783 ( 4392 PWs) bands (ev): -5.7291 -5.7291 -4.3809 -4.3809 -4.2393 -4.2393 -4.0424 -4.0424 2.7388 2.7388 3.1752 3.1752 3.3603 3.3603 4.7644 4.7644 5.0336 5.0336 5.2174 5.2174 5.5465 5.5465 5.7997 5.7997 6.0949 6.0949 6.1824 6.1824 6.9095 6.9095 7.0760 7.0760 7.4697 7.4697 7.8837 7.8837 8.0180 8.0180 8.2561 8.2561 8.3978 8.3978 8.5230 8.5230 8.6317 8.6317 8.8095 8.8095 9.1292 9.1292 9.2641 9.2641 9.6551 9.6551 10.0730 10.0730 10.5710 10.5710 k = 0.1827-0.3023 0.1694 ( 4392 PWs) bands (ev): -5.7650 -5.7650 -4.3810 -4.3810 -4.2431 -4.2431 -4.0500 -4.0500 2.6957 2.6957 3.1426 3.1426 3.3311 3.3311 4.8170 4.8170 5.0697 5.0697 5.2682 5.2682 5.5555 5.5555 5.8905 5.8905 6.1040 6.1040 6.2081 6.2081 6.9554 6.9554 7.1318 7.1318 7.4747 7.4747 7.8901 7.8901 8.0051 8.0051 8.2504 8.2504 8.3947 8.3947 8.5343 8.5343 8.6319 8.6319 8.8087 8.8087 9.1355 9.1355 9.2661 9.2661 9.7006 9.7006 10.0478 10.0478 10.5472 10.5472 k = 0.1731-0.2863 0.1605 ( 4396 PWs) bands (ev): -5.7994 -5.7994 -4.3810 -4.3810 -4.2471 -4.2471 -4.0572 -4.0572 2.6543 2.6543 3.1071 3.1071 3.3014 3.3014 4.8704 4.8704 5.1051 5.1051 5.3162 5.3162 5.5664 5.5664 5.9709 5.9709 6.1139 6.1139 6.2496 6.2496 7.0010 7.0010 7.1876 7.1876 7.4801 7.4801 7.8956 7.8956 7.9929 7.9929 8.2440 8.2440 8.3915 8.3915 8.5469 8.5469 8.6338 8.6338 8.8080 8.8080 9.1419 9.1419 9.2672 9.2672 9.7449 9.7449 10.0221 10.0221 10.5234 10.5234 k = 0.1635-0.2704 0.1516 ( 4395 PWs) bands (ev): -5.8322 -5.8322 -4.3807 -4.3807 -4.2513 -4.2513 -4.0640 -4.0640 2.6148 2.6148 3.0696 3.0696 3.2716 3.2716 4.9240 4.9240 5.1400 5.1400 5.3604 5.3604 5.5797 5.5797 6.0318 6.0318 6.1262 6.1262 6.3128 6.3128 7.0462 7.0462 7.2427 7.2427 7.4860 7.4860 7.9001 7.9001 7.9818 7.9818 8.2374 8.2374 8.3881 8.3881 8.5605 8.5605 8.6377 8.6377 8.8077 8.8077 9.1487 9.1487 9.2676 9.2676 9.7852 9.7852 9.9981 9.9981 10.4998 10.4998 k = 0.1538-0.2545 0.1427 ( 4402 PWs) bands (ev): -5.8633 -5.8633 -4.3802 -4.3802 -4.2556 -4.2556 -4.0705 -4.0705 2.5773 2.5773 3.0310 3.0310 3.2420 3.2420 4.9768 4.9768 5.1741 5.1741 5.4006 5.4006 5.5954 5.5954 6.0710 6.0710 6.1421 6.1421 6.3974 6.3974 7.0909 7.0909 7.2965 7.2965 7.4929 7.4929 7.9033 7.9033 7.9723 7.9723 8.2306 8.2306 8.3840 8.3840 8.5745 8.5745 8.6438 8.6438 8.8079 8.8079 9.1559 9.1559 9.2674 9.2674 9.8152 9.8152 9.9814 9.9814 10.4769 10.4769 k = 0.1442-0.2386 0.1337 ( 4404 PWs) bands (ev): -5.8928 -5.8928 -4.3796 -4.3796 -4.2600 -4.2600 -4.0764 -4.0764 2.5418 2.5418 2.9920 2.9920 3.2128 3.2128 5.0280 5.0280 5.2070 5.2070 5.4368 5.4368 5.6136 5.6136 6.0956 6.0956 6.1608 6.1608 6.4960 6.4960 7.1350 7.1350 7.3480 7.3480 7.5016 7.5016 7.9049 7.9049 7.9649 7.9649 8.2238 8.2238 8.3792 8.3792 8.5886 8.5886 8.6524 8.6524 8.8090 8.8090 9.1635 9.1635 9.2669 9.2669 9.8245 9.8245 9.9819 9.9819 10.4549 10.4549 k = 0.1346-0.2227 0.1248 ( 4405 PWs) bands (ev): -5.9206 -5.9206 -4.3789 -4.3789 -4.2646 -4.2646 -4.0819 -4.0819 2.5086 2.5086 2.9533 2.9533 3.1844 3.1844 5.0767 5.0767 5.2388 5.2388 5.4691 5.4691 5.6338 5.6338 6.1136 6.1136 6.1802 6.1802 6.6010 6.6010 7.1782 7.1782 7.3956 7.3956 7.5132 7.5132 7.9050 7.9050 7.9601 7.9601 8.2172 8.2172 8.3735 8.3735 8.6022 8.6022 8.6635 8.6635 8.8113 8.8113 9.1715 9.1715 9.2665 9.2665 9.8091 9.8091 10.0027 10.0027 10.4342 10.4342 k = 0.1250-0.2068 0.1159 ( 4399 PWs) bands (ev): -5.9466 -5.9466 -4.3780 -4.3780 -4.2691 -4.2691 -4.0870 -4.0870 2.4776 2.4776 2.9155 2.9155 3.1569 3.1569 5.1216 5.1216 5.2694 5.2694 5.4982 5.4982 5.6555 5.6555 6.1300 6.1300 6.1994 6.1994 6.7073 6.7073 7.2199 7.2199 7.4376 7.4376 7.5292 7.5292 7.9041 7.9041 7.9582 7.9582 8.2110 8.2110 8.3668 8.3668 8.6152 8.6152 8.6768 8.6768 8.8150 8.8150 9.1797 9.1797 9.2667 9.2667 9.7780 9.7780 10.0341 10.0341 10.4154 10.4154 k = 0.1154-0.1909 0.1070 ( 4398 PWs) bands (ev): -5.9708 -5.9708 -4.3770 -4.3770 -4.2737 -4.2737 -4.0916 -4.0916 2.4489 2.4489 2.8789 2.8789 3.1305 3.1305 5.1620 5.1620 5.2993 5.2993 5.5245 5.5245 5.6776 5.6776 6.1465 6.1465 6.2183 6.2183 6.8115 6.8115 7.2596 7.2596 7.4728 7.4728 7.5506 7.5506 7.9028 7.9028 7.9592 7.9592 8.2052 8.2052 8.3590 8.3590 8.6276 8.6276 8.6920 8.6920 8.8204 8.8204 9.1879 9.1879 9.2681 9.2681 9.7389 9.7389 10.0672 10.0672 10.3991 10.3991 k = 0.1058-0.1750 0.0981 ( 4403 PWs) bands (ev): -5.9932 -5.9932 -4.3759 -4.3759 -4.2782 -4.2782 -4.0957 -4.0957 2.4224 2.4224 2.8439 2.8439 3.1056 3.1056 5.1967 5.1967 5.3286 5.3286 5.5486 5.5486 5.6992 5.6992 6.1638 6.1638 6.2370 6.2370 6.9110 6.9110 7.2966 7.2966 7.5029 7.5029 7.5754 7.5754 7.9020 7.9020 7.9632 7.9632 8.2000 8.2000 8.3501 8.3501 8.6394 8.6394 8.7085 8.7085 8.8276 8.8276 9.1954 9.1954 9.2715 9.2715 9.6954 9.6954 10.0970 10.0970 10.3867 10.3867 k = 0.0962-0.1591 0.0892 ( 4408 PWs) bands (ev): -6.0137 -6.0137 -4.3747 -4.3747 -4.2827 -4.2827 -4.0994 -4.0994 2.3984 2.3984 2.8110 2.8110 3.0823 3.0823 5.2256 5.2256 5.3577 5.3577 5.5708 5.5708 5.7195 5.7195 6.1817 6.1817 6.2557 6.2557 7.0033 7.0033 7.3300 7.3300 7.5317 7.5317 7.5999 7.5999 7.9016 7.9016 7.9712 7.9712 8.1955 8.1955 8.3399 8.3399 8.6505 8.6505 8.7261 8.7261 8.8368 8.8368 9.2018 9.2018 9.2778 9.2778 9.6494 9.6494 10.1201 10.1201 10.3796 10.3796 k = 0.0865-0.1432 0.0802 ( 4407 PWs) bands (ev): -6.0324 -6.0324 -4.3735 -4.3735 -4.2869 -4.2869 -4.1027 -4.1027 2.3766 2.3766 2.7804 2.7804 3.0607 3.0607 5.2488 5.2488 5.3863 5.3863 5.5911 5.5911 5.7382 5.7382 6.1998 6.1998 6.2748 6.2748 7.0864 7.0864 7.3600 7.3600 7.5620 7.5620 7.6216 7.6216 7.9009 7.9009 7.9839 7.9839 8.1919 8.1919 8.3286 8.3286 8.6610 8.6610 8.7445 8.7445 8.8476 8.8476 9.2067 9.2067 9.2873 9.2873 9.6021 9.6021 10.1341 10.1341 10.3791 10.3791 k = 0.0769-0.1273 0.0713 ( 4410 PWs) bands (ev): -6.0492 -6.0492 -4.3722 -4.3722 -4.2910 -4.2910 -4.1055 -4.1055 2.3572 2.3572 2.7523 2.7523 3.0410 3.0410 5.2670 5.2670 5.4136 5.4136 5.6095 5.6095 5.7549 5.7549 6.2171 6.2171 6.2943 6.2943 7.1579 7.1579 7.3874 7.3874 7.5920 7.5920 7.6419 7.6419 7.8990 7.8990 8.0015 8.0015 8.1892 8.1892 8.3162 8.3162 8.6709 8.6709 8.7634 8.7634 8.8598 8.8598 9.2104 9.2104 9.2992 9.2992 9.5547 9.5547 10.1382 10.1382 10.3853 10.3853 k = 0.0673-0.1114 0.0624 ( 4410 PWs) bands (ev): -6.0640 -6.0640 -4.3710 -4.3710 -4.2948 -4.2948 -4.1080 -4.1080 2.3402 2.3402 2.7271 2.7271 3.0234 3.0234 5.2812 5.2812 5.4390 5.4390 5.6258 5.6258 5.7696 5.7696 6.2331 6.2331 6.3141 6.3141 7.2161 7.2161 7.4142 7.4142 7.6142 7.6142 7.6684 7.6684 7.8954 7.8954 8.0227 8.0227 8.1878 8.1878 8.3029 8.3029 8.6805 8.6805 8.7824 8.7824 8.8733 8.8733 9.2132 9.2132 9.3120 9.3120 9.5090 9.5090 10.1336 10.1336 10.3965 10.3965 k = 0.0577-0.0954 0.0535 ( 4416 PWs) bands (ev): -6.0769 -6.0769 -4.3698 -4.3698 -4.2982 -4.2982 -4.1101 -4.1101 2.3255 2.3255 2.7048 2.7048 3.0079 3.0079 5.2922 5.2922 5.4618 5.4618 5.6400 5.6400 5.7823 5.7823 6.2471 6.2471 6.3338 6.3338 7.2600 7.2600 7.4421 7.4421 7.6245 7.6245 7.7042 7.7042 7.8902 7.8902 8.0454 8.0454 8.1877 8.1877 8.2888 8.2888 8.6898 8.6898 8.8004 8.8004 8.8882 8.8882 9.2155 9.2155 9.3220 9.3220 9.4684 9.4684 10.1230 10.1230 10.4103 10.4103 k = 0.0481-0.0795 0.0446 ( 4414 PWs) bands (ev): -6.0878 -6.0878 -4.3687 -4.3687 -4.3013 -4.3013 -4.1118 -4.1118 2.3131 2.3131 2.6856 2.6856 2.9946 2.9946 5.3006 5.3006 5.4816 5.4816 5.6520 5.6520 5.7931 5.7931 6.2589 6.2589 6.3527 6.3527 7.2906 7.2906 7.4711 7.4711 7.6279 7.6279 7.7435 7.7435 7.8837 7.8837 8.0675 8.0675 8.1891 8.1891 8.2741 8.2741 8.6991 8.6991 8.8164 8.8164 8.9048 8.9048 9.2174 9.2174 9.3224 9.3224 9.4399 9.4399 10.1090 10.1090 10.4244 10.4244 k = 0.0385-0.0636 0.0357 ( 4413 PWs) bands (ev): -6.0968 -6.0968 -4.3677 -4.3677 -4.3039 -4.3039 -4.1132 -4.1132 2.3030 2.3030 2.6697 2.6697 2.9837 2.9837 5.3069 5.3069 5.4981 5.4981 5.6617 5.6617 5.8019 5.8019 6.2685 6.2685 6.3698 6.3698 7.3107 7.3107 7.4994 7.4994 7.6282 7.6282 7.7811 7.7811 7.8766 7.8766 8.0871 8.0871 8.1921 8.1921 8.2593 8.2593 8.7081 8.7081 8.8294 8.8294 8.9233 8.9233 9.2184 9.2184 9.3068 9.3068 9.4301 9.4301 10.0939 10.0939 10.4372 10.4372 k = 0.0288-0.0477 0.0267 ( 4417 PWs) bands (ev): -6.1038 -6.1038 -4.3669 -4.3669 -4.3060 -4.3060 -4.1143 -4.1143 2.2952 2.2952 2.6572 2.6572 2.9751 2.9751 5.3115 5.3115 5.5110 5.5110 5.6691 5.6691 5.8089 5.8089 6.2759 6.2759 6.3841 6.3841 7.3235 7.3235 7.5245 7.5245 7.6274 7.6274 7.8133 7.8133 7.8699 7.8699 8.1031 8.1031 8.1964 8.1964 8.2448 8.2448 8.7164 8.7164 8.8389 8.8389 8.9430 8.9430 9.2167 9.2167 9.2822 9.2822 9.4338 9.4338 10.0796 10.0796 10.4478 10.4478 k = 0.0192-0.0318 0.0178 ( 4418 PWs) bands (ev): -6.1088 -6.1088 -4.3662 -4.3662 -4.3076 -4.3076 -4.1151 -4.1151 2.2896 2.2896 2.6483 2.6483 2.9689 2.9689 5.3147 5.3147 5.5203 5.5203 5.6744 5.6744 5.8139 5.8139 6.2811 6.2811 6.3950 6.3950 7.3313 7.3313 7.5440 7.5440 7.6265 7.6265 7.8362 7.8362 7.8660 7.8660 8.1150 8.1150 8.2013 8.2013 8.2317 8.2317 8.7233 8.7233 8.8451 8.8451 8.9620 8.9620 9.2094 9.2094 9.2622 9.2622 9.4415 9.4415 10.0680 10.0680 10.4556 10.4556 k = 0.0096-0.0159 0.0089 ( 4421 PWs) bands (ev): -6.1118 -6.1118 -4.3658 -4.3658 -4.3085 -4.3085 -4.1155 -4.1155 2.2863 2.2863 2.6428 2.6428 2.9652 2.9652 5.3165 5.3165 5.5258 5.5258 5.6775 5.6775 5.8170 5.8170 6.2843 6.2843 6.4017 6.4017 7.3354 7.3354 7.5563 7.5563 7.6261 7.6261 7.8456 7.8456 7.8683 7.8683 8.1226 8.1226 8.2065 8.2065 8.2210 8.2210 8.7279 8.7279 8.8486 8.8486 8.9768 8.9768 9.1979 9.1979 9.2530 9.2530 9.4477 9.4477 10.0603 10.0603 10.4604 10.4604 k = 0.0000 0.0000 0.0000 ( 4425 PWs) bands (ev): -6.1128 -6.1128 -4.3657 -4.3657 -4.3089 -4.3089 -4.1157 -4.1157 2.2852 2.2852 2.6410 2.6410 2.9640 2.9640 5.3171 5.3171 5.5277 5.5277 5.6785 5.6785 5.8180 5.8180 6.2853 6.2853 6.4040 6.4040 7.3367 7.3367 7.5604 7.5604 7.6260 7.6260 7.8467 7.8467 7.8710 7.8710 8.1252 8.1252 8.2108 8.2108 8.2147 8.2147 8.7295 8.7295 8.8497 8.8497 8.9826 8.9826 9.1922 9.1922 9.2508 9.2508 9.4500 9.4500 10.0576 10.0576 10.4620 10.4620 Writing output data file Fe3Se4.save init_run : 0.28s CPU 0.36s WALL ( 1 calls) electrons : 236.07s CPU 239.00s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 236.06s CPU 238.99s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.07s WALL ( 367 calls) cegterg : 210.88s CPU 213.04s WALL ( 367 calls) Called by sum_band: Called by *egterg: h_psi : 145.02s CPU 146.68s WALL ( 6573 calls) s_psi : 6.08s CPU 6.26s WALL ( 6573 calls) g_psi : 0.29s CPU 0.29s WALL ( 5839 calls) cdiaghg : 60.82s CPU 61.61s WALL ( 6206 calls) cegterg:over : 7.86s CPU 7.83s WALL ( 5839 calls) cegterg:upda : 6.88s CPU 6.80s WALL ( 5839 calls) cegterg:last : 3.49s CPU 3.52s WALL ( 1101 calls) cdiaghg:chol : 3.40s CPU 3.53s WALL ( 6206 calls) cdiaghg:inve : 2.67s CPU 2.52s WALL ( 6206 calls) cdiaghg:para : 4.12s CPU 4.08s WALL ( 12412 calls) Called by h_psi: h_psi:vloc : 130.19s CPU 131.77s WALL ( 6573 calls) h_psi:vnl : 14.52s CPU 14.63s WALL ( 6573 calls) add_vuspsi : 7.50s CPU 7.40s WALL ( 6573 calls) General routines calbec : 7.00s CPU 7.20s WALL ( 6573 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 122.51s CPU 123.88s WALL ( 924296 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.26s WALL ( 734 calls) Parallel routines fft_scatter : 31.33s CPU 31.46s WALL ( 924319 calls) PWSCF : 4m16.03s CPU 4m38.01s WALL This run was terminated on: 18:25:13 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=