Program PWSCF v.5.4.0 starts on 12Feb2017 at 2:52:13 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./CuxHOx2.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 39 23 7 1511 663 110 Max 40 24 8 1516 676 113 Sum 1431 835 255 54491 24113 4033 bravais-lattice index = 14 lattice parameter (alat) = 10.3891 a.u. unit-cell volume = 553.6927 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 50.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.389070 celldm(2)= 1.000000 celldm(3)= 0.956116 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.856317 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.856317 0.516450 0.000000 ) a(3) = ( 0.000000 0.000000 0.956116 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.658084 -0.000000 ) b(2) = ( 0.000000 1.936296 -0.000000 ) b(3) = ( 0.000000 0.000000 1.045898 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) H 1.00 1.00790 H( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.4780580 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 440 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 2) = ( 0.0046440 0.0166922 -0.0000000), wk = 0.0022727 k( 3) = ( 0.0092879 0.0333844 -0.0000000), wk = 0.0022727 k( 4) = ( 0.0139319 0.0500766 -0.0000000), wk = 0.0022727 k( 5) = ( 0.0185759 0.0667689 -0.0000000), wk = 0.0022727 k( 6) = ( 0.0232199 0.0834611 -0.0000000), wk = 0.0022727 k( 7) = ( 0.0278638 0.1001533 -0.0000000), wk = 0.0022727 k( 8) = ( 0.0325078 0.1168455 -0.0000000), wk = 0.0022727 k( 9) = ( 0.0371518 0.1335377 -0.0000000), wk = 0.0022727 k( 10) = ( 0.0417958 0.1502299 -0.0000000), wk = 0.0022727 k( 11) = ( 0.0464397 0.1669221 -0.0000000), wk = 0.0022727 k( 12) = ( 0.0510837 0.1836143 -0.0000000), wk = 0.0022727 k( 13) = ( 0.0557277 0.2003065 -0.0000000), wk = 0.0022727 k( 14) = ( 0.0603717 0.2169987 -0.0000000), wk = 0.0022727 k( 15) = ( 0.0650156 0.2336909 -0.0000000), wk = 0.0022727 k( 16) = ( 0.0696596 0.2503832 -0.0000000), wk = 0.0022727 k( 17) = ( 0.0743036 0.2670754 -0.0000000), wk = 0.0022727 k( 18) = ( 0.0789476 0.2837676 -0.0000000), wk = 0.0022727 k( 19) = ( 0.0835915 0.3004598 -0.0000000), wk = 0.0022727 k( 20) = ( 0.0882355 0.3171520 -0.0000000), wk = 0.0022727 k( 21) = ( 0.0928795 0.3338442 -0.0000000), wk = 0.0022727 k( 22) = ( 0.0975234 0.3505364 -0.0000000), wk = 0.0022727 k( 23) = ( 0.1021674 0.3672286 -0.0000000), wk = 0.0022727 k( 24) = ( 0.1068114 0.3839209 -0.0000000), wk = 0.0022727 k( 25) = ( 0.1114554 0.4006131 -0.0000000), wk = 0.0022727 k( 26) = ( 0.1160994 0.4173053 -0.0000000), wk = 0.0022727 k( 27) = ( 0.1207433 0.4339975 -0.0000000), wk = 0.0022727 k( 28) = ( 0.1253873 0.4506897 -0.0000000), wk = 0.0022727 k( 29) = ( 0.1300313 0.4673819 -0.0000000), wk = 0.0022727 k( 30) = ( 0.1346752 0.4840741 -0.0000000), wk = 0.0022727 k( 31) = ( 0.1393192 0.5007663 -0.0000000), wk = 0.0022727 k( 32) = ( 0.1439632 0.5174585 -0.0000000), wk = 0.0022727 k( 33) = ( 0.1486072 0.5341507 -0.0000000), wk = 0.0022727 k( 34) = ( 0.1532511 0.5508430 -0.0000000), wk = 0.0022727 k( 35) = ( 0.1578951 0.5675352 -0.0000000), wk = 0.0022727 k( 36) = ( 0.1625391 0.5842274 -0.0000000), wk = 0.0022727 k( 37) = ( 0.1671831 0.6009196 -0.0000000), wk = 0.0022727 k( 38) = ( 0.1718270 0.6176118 -0.0000000), wk = 0.0022727 k( 39) = ( 0.1764710 0.6343040 -0.0000000), wk = 0.0022727 k( 40) = ( 0.1811150 0.6509962 -0.0000000), wk = 0.0022727 k( 41) = ( 0.1857590 0.6676884 -0.0000000), wk = 0.0022727 k( 42) = ( 0.1904029 0.6843807 -0.0000000), wk = 0.0022727 k( 43) = ( 0.1950469 0.7010729 -0.0000000), wk = 0.0022727 k( 44) = ( 0.1996909 0.7177651 -0.0000000), wk = 0.0022727 k( 45) = ( 0.2043349 0.7344573 -0.0000000), wk = 0.0022727 k( 46) = ( 0.2089788 0.7511495 -0.0000000), wk = 0.0022727 k( 47) = ( 0.2136228 0.7678417 -0.0000000), wk = 0.0022727 k( 48) = ( 0.2182668 0.7845339 -0.0000000), wk = 0.0022727 k( 49) = ( 0.2229107 0.8012261 -0.0000000), wk = 0.0022727 k( 50) = ( 0.2275547 0.8179183 -0.0000000), wk = 0.0022727 k( 51) = ( 0.2321987 0.8346105 -0.0000000), wk = 0.0022727 k( 52) = ( 0.2368427 0.8513028 -0.0000000), wk = 0.0022727 k( 53) = ( 0.2414866 0.8679950 -0.0000000), wk = 0.0022727 k( 54) = ( 0.2461306 0.8846872 -0.0000000), wk = 0.0022727 k( 55) = ( 0.2507746 0.9013794 -0.0000000), wk = 0.0022727 k( 56) = ( 0.2554186 0.9180716 -0.0000000), wk = 0.0022727 k( 57) = ( 0.2600625 0.9347638 -0.0000000), wk = 0.0022727 k( 58) = ( 0.2647065 0.9514560 -0.0000000), wk = 0.0022727 k( 59) = ( 0.2693505 0.9681482 -0.0000000), wk = 0.0022727 k( 60) = ( 0.2693505 0.9681482 -0.0000000), wk = 0.0022727 k( 61) = ( 0.2525161 0.9681482 -0.0000000), wk = 0.0022727 k( 62) = ( 0.2356817 0.9681482 -0.0000000), wk = 0.0022727 k( 63) = ( 0.2188473 0.9681482 -0.0000000), wk = 0.0022727 k( 64) = ( 0.2020129 0.9681482 -0.0000000), wk = 0.0022727 k( 65) = ( 0.1851785 0.9681482 -0.0000000), wk = 0.0022727 k( 66) = ( 0.1683440 0.9681482 -0.0000000), wk = 0.0022727 k( 67) = ( 0.1515096 0.9681482 -0.0000000), wk = 0.0022727 k( 68) = ( 0.1346752 0.9681482 -0.0000000), wk = 0.0022727 k( 69) = ( 0.1178408 0.9681482 -0.0000000), wk = 0.0022727 k( 70) = ( 0.1010064 0.9681482 -0.0000000), wk = 0.0022727 k( 71) = ( 0.0841720 0.9681483 -0.0000000), wk = 0.0022727 k( 72) = ( 0.0673376 0.9681482 -0.0000000), wk = 0.0022727 k( 73) = ( 0.0505032 0.9681483 -0.0000000), wk = 0.0022727 k( 74) = ( 0.0336688 0.9681482 -0.0000000), wk = 0.0022727 k( 75) = ( 0.0168344 0.9681483 -0.0000000), wk = 0.0022727 k( 76) = ( 0.0000000 0.9681482 -0.0000000), wk = 0.0022727 k( 77) = ( 0.0000000 0.9681482 -0.0000000), wk = 0.0022727 k( 78) = ( 0.0000000 0.9681482 0.0174316), wk = 0.0022727 k( 79) = ( 0.0000000 0.9681482 0.0348633), wk = 0.0022727 k( 80) = ( 0.0000000 0.9681482 0.0522949), wk = 0.0022727 k( 81) = ( 0.0000000 0.9681482 0.0697266), wk = 0.0022727 k( 82) = ( 0.0000000 0.9681482 0.0871582), wk = 0.0022727 k( 83) = ( 0.0000000 0.9681482 0.1045898), wk = 0.0022727 k( 84) = ( 0.0000000 0.9681482 0.1220215), wk = 0.0022727 k( 85) = ( 0.0000000 0.9681482 0.1394531), wk = 0.0022727 k( 86) = ( 0.0000000 0.9681482 0.1568847), wk = 0.0022727 k( 87) = ( 0.0000000 0.9681482 0.1743164), wk = 0.0022727 k( 88) = ( 0.0000000 0.9681482 0.1917480), wk = 0.0022727 k( 89) = ( 0.0000000 0.9681482 0.2091797), wk = 0.0022727 k( 90) = ( 0.0000000 0.9681482 0.2266113), wk = 0.0022727 k( 91) = ( 0.0000000 0.9681482 0.2440429), wk = 0.0022727 k( 92) = ( 0.0000000 0.9681482 0.2614746), wk = 0.0022727 k( 93) = ( 0.0000000 0.9681482 0.2789062), wk = 0.0022727 k( 94) = ( 0.0000000 0.9681482 0.2963378), wk = 0.0022727 k( 95) = ( 0.0000000 0.9681482 0.3137695), wk = 0.0022727 k( 96) = ( 0.0000000 0.9681482 0.3312011), wk = 0.0022727 k( 97) = ( 0.0000000 0.9681482 0.3486328), wk = 0.0022727 k( 98) = ( 0.0000000 0.9681482 0.3660644), wk = 0.0022727 k( 99) = ( 0.0000000 0.9681482 0.3834960), wk = 0.0022727 k( 100) = ( 0.0000000 0.9681482 0.4009277), wk = 0.0022727 k( 101) = ( 0.0000000 0.9681482 0.4183593), wk = 0.0022727 k( 102) = ( 0.0000000 0.9681482 0.4357909), wk = 0.0022727 k( 103) = ( 0.0000000 0.9681482 0.4532226), wk = 0.0022727 k( 104) = ( 0.0000000 0.9681482 0.4706542), wk = 0.0022727 k( 105) = ( 0.0000000 0.9681482 0.4880859), wk = 0.0022727 k( 106) = ( 0.0000000 0.9681482 0.5055175), wk = 0.0022727 k( 107) = ( 0.0000000 0.9681482 0.5229491), wk = 0.0022727 k( 108) = ( 0.0000000 0.9681482 0.5229491), wk = 0.0022727 k( 109) = ( 0.0168344 0.9681483 0.5229491), wk = 0.0022727 k( 110) = ( 0.0336688 0.9681482 0.5229491), wk = 0.0022727 k( 111) = ( 0.0505032 0.9681483 0.5229491), wk = 0.0022727 k( 112) = ( 0.0673376 0.9681482 0.5229491), wk = 0.0022727 k( 113) = ( 0.0841720 0.9681483 0.5229491), wk = 0.0022727 k( 114) = ( 0.1010064 0.9681482 0.5229491), wk = 0.0022727 k( 115) = ( 0.1178408 0.9681482 0.5229491), wk = 0.0022727 k( 116) = ( 0.1346752 0.9681482 0.5229491), wk = 0.0022727 k( 117) = ( 0.1515096 0.9681482 0.5229491), wk = 0.0022727 k( 118) = ( 0.1683440 0.9681482 0.5229491), wk = 0.0022727 k( 119) = ( 0.1851785 0.9681482 0.5229491), wk = 0.0022727 k( 120) = ( 0.2020129 0.9681482 0.5229491), wk = 0.0022727 k( 121) = ( 0.2188473 0.9681482 0.5229491), wk = 0.0022727 k( 122) = ( 0.2356817 0.9681482 0.5229491), wk = 0.0022727 k( 123) = ( 0.2525161 0.9681482 0.5229491), wk = 0.0022727 k( 124) = ( 0.2693505 0.9681482 0.5229491), wk = 0.0022727 k( 125) = ( 0.2693505 0.9681482 0.5229491), wk = 0.0022727 k( 126) = ( 0.2647065 0.9514560 0.5229491), wk = 0.0022727 k( 127) = ( 0.2600625 0.9347638 0.5229491), wk = 0.0022727 k( 128) = ( 0.2554186 0.9180716 0.5229491), wk = 0.0022727 k( 129) = ( 0.2507746 0.9013794 0.5229491), wk = 0.0022727 k( 130) = ( 0.2461306 0.8846872 0.5229491), wk = 0.0022727 k( 131) = ( 0.2414866 0.8679950 0.5229491), wk = 0.0022727 k( 132) = ( 0.2368427 0.8513028 0.5229491), wk = 0.0022727 k( 133) = ( 0.2321987 0.8346105 0.5229491), wk = 0.0022727 k( 134) = ( 0.2275547 0.8179183 0.5229491), wk = 0.0022727 k( 135) = ( 0.2229107 0.8012261 0.5229491), wk = 0.0022727 k( 136) = ( 0.2182668 0.7845339 0.5229491), wk = 0.0022727 k( 137) = ( 0.2136228 0.7678417 0.5229491), wk = 0.0022727 k( 138) = ( 0.2089788 0.7511495 0.5229491), wk = 0.0022727 k( 139) = ( 0.2043349 0.7344573 0.5229491), wk = 0.0022727 k( 140) = ( 0.1996909 0.7177651 0.5229491), wk = 0.0022727 k( 141) = ( 0.1950469 0.7010729 0.5229491), wk = 0.0022727 k( 142) = ( 0.1904029 0.6843807 0.5229491), wk = 0.0022727 k( 143) = ( 0.1857590 0.6676884 0.5229491), wk = 0.0022727 k( 144) = ( 0.1811150 0.6509962 0.5229491), wk = 0.0022727 k( 145) = ( 0.1764710 0.6343040 0.5229491), wk = 0.0022727 k( 146) = ( 0.1718270 0.6176118 0.5229491), wk = 0.0022727 k( 147) = ( 0.1671831 0.6009196 0.5229491), wk = 0.0022727 k( 148) = ( 0.1625391 0.5842274 0.5229491), wk = 0.0022727 k( 149) = ( 0.1578951 0.5675352 0.5229491), wk = 0.0022727 k( 150) = ( 0.1532511 0.5508430 0.5229491), wk = 0.0022727 k( 151) = ( 0.1486072 0.5341507 0.5229491), wk = 0.0022727 k( 152) = ( 0.1439632 0.5174585 0.5229491), wk = 0.0022727 k( 153) = ( 0.1393192 0.5007663 0.5229491), wk = 0.0022727 k( 154) = ( 0.1346752 0.4840741 0.5229491), wk = 0.0022727 k( 155) = ( 0.1300313 0.4673819 0.5229491), wk = 0.0022727 k( 156) = ( 0.1253873 0.4506897 0.5229491), wk = 0.0022727 k( 157) = ( 0.1207433 0.4339975 0.5229491), wk = 0.0022727 k( 158) = ( 0.1160994 0.4173053 0.5229491), wk = 0.0022727 k( 159) = ( 0.1114554 0.4006131 0.5229491), wk = 0.0022727 k( 160) = ( 0.1068114 0.3839209 0.5229491), wk = 0.0022727 k( 161) = ( 0.1021674 0.3672286 0.5229491), wk = 0.0022727 k( 162) = ( 0.0975234 0.3505364 0.5229491), wk = 0.0022727 k( 163) = ( 0.0928795 0.3338442 0.5229491), wk = 0.0022727 k( 164) = ( 0.0882355 0.3171520 0.5229491), wk = 0.0022727 k( 165) = ( 0.0835915 0.3004598 0.5229491), wk = 0.0022727 k( 166) = ( 0.0789476 0.2837676 0.5229491), wk = 0.0022727 k( 167) = ( 0.0743036 0.2670754 0.5229491), wk = 0.0022727 k( 168) = ( 0.0696596 0.2503832 0.5229491), wk = 0.0022727 k( 169) = ( 0.0650156 0.2336909 0.5229491), wk = 0.0022727 k( 170) = ( 0.0603717 0.2169987 0.5229491), wk = 0.0022727 k( 171) = ( 0.0557277 0.2003065 0.5229491), wk = 0.0022727 k( 172) = ( 0.0510837 0.1836143 0.5229491), wk = 0.0022727 k( 173) = ( 0.0464397 0.1669221 0.5229491), wk = 0.0022727 k( 174) = ( 0.0417958 0.1502299 0.5229491), wk = 0.0022727 k( 175) = ( 0.0371518 0.1335377 0.5229491), wk = 0.0022727 k( 176) = ( 0.0325078 0.1168455 0.5229491), wk = 0.0022727 k( 177) = ( 0.0278638 0.1001533 0.5229491), wk = 0.0022727 k( 178) = ( 0.0232199 0.0834611 0.5229491), wk = 0.0022727 k( 179) = ( 0.0185759 0.0667689 0.5229491), wk = 0.0022727 k( 180) = ( 0.0139319 0.0500766 0.5229491), wk = 0.0022727 k( 181) = ( 0.0092879 0.0333844 0.5229491), wk = 0.0022727 k( 182) = ( 0.0046440 0.0166922 0.5229491), wk = 0.0022727 k( 183) = ( 0.0000000 0.0000000 0.5229491), wk = 0.0022727 k( 184) = ( 0.0000000 0.0000000 0.5229491), wk = 0.0022727 k( 185) = ( 0.0000000 0.0000000 0.5055175), wk = 0.0022727 k( 186) = ( 0.0000000 0.0000000 0.4880859), wk = 0.0022727 k( 187) = ( 0.0000000 0.0000000 0.4706542), wk = 0.0022727 k( 188) = ( 0.0000000 0.0000000 0.4532226), wk = 0.0022727 k( 189) = ( 0.0000000 0.0000000 0.4357909), wk = 0.0022727 k( 190) = ( 0.0000000 0.0000000 0.4183593), wk = 0.0022727 k( 191) = ( 0.0000000 0.0000000 0.4009277), wk = 0.0022727 k( 192) = ( 0.0000000 0.0000000 0.3834960), wk = 0.0022727 k( 193) = ( 0.0000000 0.0000000 0.3660644), wk = 0.0022727 k( 194) = ( 0.0000000 0.0000000 0.3486328), wk = 0.0022727 k( 195) = ( 0.0000000 0.0000000 0.3312011), wk = 0.0022727 k( 196) = ( 0.0000000 0.0000000 0.3137695), wk = 0.0022727 k( 197) = ( 0.0000000 0.0000000 0.2963378), wk = 0.0022727 k( 198) = ( 0.0000000 0.0000000 0.2789062), wk = 0.0022727 k( 199) = ( 0.0000000 0.0000000 0.2614746), wk = 0.0022727 k( 200) = ( 0.0000000 0.0000000 0.2440429), wk = 0.0022727 k( 201) = ( 0.0000000 0.0000000 0.2266113), wk = 0.0022727 k( 202) = ( 0.0000000 0.0000000 0.2091797), wk = 0.0022727 k( 203) = ( 0.0000000 0.0000000 0.1917480), wk = 0.0022727 k( 204) = ( 0.0000000 0.0000000 0.1743164), wk = 0.0022727 k( 205) = ( 0.0000000 0.0000000 0.1568847), wk = 0.0022727 k( 206) = ( 0.0000000 0.0000000 0.1394531), wk = 0.0022727 k( 207) = ( 0.0000000 0.0000000 0.1220215), wk = 0.0022727 k( 208) = ( 0.0000000 0.0000000 0.1045898), wk = 0.0022727 k( 209) = ( 0.0000000 0.0000000 0.0871582), wk = 0.0022727 k( 210) = ( 0.0000000 0.0000000 0.0697266), wk = 0.0022727 k( 211) = ( 0.0000000 0.0000000 0.0522949), wk = 0.0022727 k( 212) = ( 0.0000000 0.0000000 0.0348633), wk = 0.0022727 k( 213) = ( 0.0000000 0.0000000 0.0174316), wk = 0.0022727 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 216) = ( -0.0166667 0.0046369 0.0000000), wk = 0.0022727 k( 217) = ( -0.0333333 0.0092737 0.0000000), wk = 0.0022727 k( 218) = ( -0.0500000 0.0139106 0.0000000), wk = 0.0022727 k( 219) = ( -0.0666667 0.0185475 0.0000000), wk = 0.0022727 k( 220) = ( -0.0833333 0.0231843 0.0000000), wk = 0.0022727 k( 221) = ( -0.1000000 0.0278212 0.0000000), wk = 0.0022727 k( 222) = ( -0.1166667 0.0324581 0.0000000), wk = 0.0022727 k( 223) = ( -0.1333333 0.0370949 0.0000000), wk = 0.0022727 k( 224) = ( -0.1500000 0.0417318 0.0000000), wk = 0.0022727 k( 225) = ( -0.1666667 0.0463687 0.0000000), wk = 0.0022727 k( 226) = ( -0.1833333 0.0510055 0.0000000), wk = 0.0022727 k( 227) = ( -0.2000000 0.0556424 0.0000000), wk = 0.0022727 k( 228) = ( -0.2166667 0.0602793 0.0000000), wk = 0.0022727 k( 229) = ( -0.2333333 0.0649161 0.0000000), wk = 0.0022727 k( 230) = ( -0.2500000 0.0695530 0.0000000), wk = 0.0022727 k( 231) = ( -0.2666667 0.0741899 0.0000000), wk = 0.0022727 k( 232) = ( -0.2833333 0.0788267 0.0000000), wk = 0.0022727 k( 233) = ( -0.3000000 0.0834636 0.0000000), wk = 0.0022727 k( 234) = ( -0.3166667 0.0881005 0.0000000), wk = 0.0022727 k( 235) = ( -0.3333333 0.0927373 0.0000000), wk = 0.0022727 k( 236) = ( -0.3500000 0.0973742 0.0000000), wk = 0.0022727 k( 237) = ( -0.3666667 0.1020111 0.0000000), wk = 0.0022727 k( 238) = ( -0.3833333 0.1066479 0.0000000), wk = 0.0022727 k( 239) = ( -0.4000000 0.1112848 0.0000000), wk = 0.0022727 k( 240) = ( -0.4166667 0.1159217 0.0000000), wk = 0.0022727 k( 241) = ( -0.4333333 0.1205585 0.0000000), wk = 0.0022727 k( 242) = ( -0.4500000 0.1251954 0.0000000), wk = 0.0022727 k( 243) = ( -0.4666667 0.1298323 0.0000000), wk = 0.0022727 k( 244) = ( -0.4833333 0.1344691 0.0000000), wk = 0.0022727 k( 245) = ( -0.5000000 0.1391060 0.0000000), wk = 0.0022727 k( 246) = ( -0.5000000 0.1391060 0.0000000), wk = 0.0022727 k( 247) = ( -0.4953870 0.1556869 -0.0000000), wk = 0.0022727 k( 248) = ( -0.4907740 0.1722677 -0.0000000), wk = 0.0022727 k( 249) = ( -0.4861610 0.1888485 -0.0000000), wk = 0.0022727 k( 250) = ( -0.4815480 0.2054294 -0.0000000), wk = 0.0022727 k( 251) = ( -0.4769351 0.2220102 -0.0000000), wk = 0.0022727 k( 252) = ( -0.4723221 0.2385911 -0.0000000), wk = 0.0022727 k( 253) = ( -0.4677091 0.2551719 -0.0000000), wk = 0.0022727 k( 254) = ( -0.4630961 0.2717528 -0.0000000), wk = 0.0022727 k( 255) = ( -0.4584831 0.2883336 -0.0000000), wk = 0.0022727 k( 256) = ( -0.4538701 0.3049144 -0.0000000), wk = 0.0022727 k( 257) = ( -0.4492571 0.3214953 -0.0000000), wk = 0.0022727 k( 258) = ( -0.4446441 0.3380761 -0.0000000), wk = 0.0022727 k( 259) = ( -0.4400311 0.3546570 -0.0000000), wk = 0.0022727 k( 260) = ( -0.4354181 0.3712378 -0.0000000), wk = 0.0022727 k( 261) = ( -0.4308051 0.3878187 -0.0000000), wk = 0.0022727 k( 262) = ( -0.4261921 0.4043995 -0.0000000), wk = 0.0022727 k( 263) = ( -0.4215792 0.4209804 -0.0000000), wk = 0.0022727 k( 264) = ( -0.4169662 0.4375612 -0.0000000), wk = 0.0022727 k( 265) = ( -0.4123532 0.4541421 -0.0000000), wk = 0.0022727 k( 266) = ( -0.4077402 0.4707229 -0.0000000), wk = 0.0022727 k( 267) = ( -0.4031272 0.4873038 -0.0000000), wk = 0.0022727 k( 268) = ( -0.3985142 0.5038846 -0.0000000), wk = 0.0022727 k( 269) = ( -0.3939012 0.5204654 -0.0000000), wk = 0.0022727 k( 270) = ( -0.3892882 0.5370463 -0.0000000), wk = 0.0022727 k( 271) = ( -0.3846752 0.5536271 -0.0000000), wk = 0.0022727 k( 272) = ( -0.3800622 0.5702080 -0.0000000), wk = 0.0022727 k( 273) = ( -0.3754493 0.5867888 -0.0000000), wk = 0.0022727 k( 274) = ( -0.3708363 0.6033697 -0.0000000), wk = 0.0022727 k( 275) = ( -0.3662233 0.6199505 -0.0000000), wk = 0.0022727 k( 276) = ( -0.3616103 0.6365313 -0.0000000), wk = 0.0022727 k( 277) = ( -0.3569973 0.6531122 -0.0000000), wk = 0.0022727 k( 278) = ( -0.3523843 0.6696930 -0.0000000), wk = 0.0022727 k( 279) = ( -0.3477713 0.6862739 -0.0000000), wk = 0.0022727 k( 280) = ( -0.3431583 0.7028547 -0.0000000), wk = 0.0022727 k( 281) = ( -0.3385453 0.7194356 -0.0000000), wk = 0.0022727 k( 282) = ( -0.3339323 0.7360164 -0.0000000), wk = 0.0022727 k( 283) = ( -0.3293194 0.7525972 -0.0000000), wk = 0.0022727 k( 284) = ( -0.3247064 0.7691781 -0.0000000), wk = 0.0022727 k( 285) = ( -0.3200934 0.7857589 -0.0000000), wk = 0.0022727 k( 286) = ( -0.3154804 0.8023398 -0.0000000), wk = 0.0022727 k( 287) = ( -0.3108674 0.8189206 -0.0000000), wk = 0.0022727 k( 288) = ( -0.3062544 0.8355015 -0.0000000), wk = 0.0022727 k( 289) = ( -0.3016414 0.8520823 -0.0000000), wk = 0.0022727 k( 290) = ( -0.2970284 0.8686632 -0.0000000), wk = 0.0022727 k( 291) = ( -0.2924154 0.8852440 -0.0000000), wk = 0.0022727 k( 292) = ( -0.2878024 0.9018249 -0.0000000), wk = 0.0022727 k( 293) = ( -0.2831895 0.9184057 -0.0000000), wk = 0.0022727 k( 294) = ( -0.2785765 0.9349866 -0.0000000), wk = 0.0022727 k( 295) = ( -0.2739635 0.9515674 -0.0000000), wk = 0.0022727 k( 296) = ( -0.2693505 0.9681482 -0.0000000), wk = 0.0022727 k( 297) = ( -0.2693505 0.9681482 -0.0000000), wk = 0.0022727 k( 298) = ( -0.2693505 0.9681482 0.0174316), wk = 0.0022727 k( 299) = ( -0.2693505 0.9681482 0.0348633), wk = 0.0022727 k( 300) = ( -0.2693505 0.9681482 0.0522949), wk = 0.0022727 k( 301) = ( -0.2693505 0.9681482 0.0697266), wk = 0.0022727 k( 302) = ( -0.2693505 0.9681482 0.0871582), wk = 0.0022727 k( 303) = ( -0.2693505 0.9681482 0.1045898), wk = 0.0022727 k( 304) = ( -0.2693505 0.9681482 0.1220215), wk = 0.0022727 k( 305) = ( -0.2693505 0.9681482 0.1394531), wk = 0.0022727 k( 306) = ( -0.2693505 0.9681482 0.1568847), wk = 0.0022727 k( 307) = ( -0.2693505 0.9681482 0.1743164), wk = 0.0022727 k( 308) = ( -0.2693505 0.9681482 0.1917480), wk = 0.0022727 k( 309) = ( -0.2693505 0.9681482 0.2091797), wk = 0.0022727 k( 310) = ( -0.2693505 0.9681482 0.2266113), wk = 0.0022727 k( 311) = ( -0.2693505 0.9681482 0.2440429), wk = 0.0022727 k( 312) = ( -0.2693505 0.9681482 0.2614746), wk = 0.0022727 k( 313) = ( -0.2693505 0.9681482 0.2789062), wk = 0.0022727 k( 314) = ( -0.2693505 0.9681482 0.2963378), wk = 0.0022727 k( 315) = ( -0.2693505 0.9681482 0.3137695), wk = 0.0022727 k( 316) = ( -0.2693505 0.9681482 0.3312011), wk = 0.0022727 k( 317) = ( -0.2693505 0.9681482 0.3486328), wk = 0.0022727 k( 318) = ( -0.2693505 0.9681482 0.3660644), wk = 0.0022727 k( 319) = ( -0.2693505 0.9681482 0.3834960), wk = 0.0022727 k( 320) = ( -0.2693505 0.9681482 0.4009277), wk = 0.0022727 k( 321) = ( -0.2693505 0.9681482 0.4183593), wk = 0.0022727 k( 322) = ( -0.2693505 0.9681482 0.4357909), wk = 0.0022727 k( 323) = ( -0.2693505 0.9681482 0.4532226), wk = 0.0022727 k( 324) = ( -0.2693505 0.9681482 0.4706542), wk = 0.0022727 k( 325) = ( -0.2693505 0.9681482 0.4880859), wk = 0.0022727 k( 326) = ( -0.2693505 0.9681482 0.5055175), wk = 0.0022727 k( 327) = ( -0.2693505 0.9681482 0.5229491), wk = 0.0022727 k( 328) = ( -0.2693505 0.9681482 0.5229491), wk = 0.0022727 k( 329) = ( -0.2739635 0.9515674 0.5229491), wk = 0.0022727 k( 330) = ( -0.2785765 0.9349866 0.5229491), wk = 0.0022727 k( 331) = ( -0.2831895 0.9184057 0.5229491), wk = 0.0022727 k( 332) = ( -0.2878024 0.9018249 0.5229491), wk = 0.0022727 k( 333) = ( -0.2924154 0.8852440 0.5229491), wk = 0.0022727 k( 334) = ( -0.2970284 0.8686632 0.5229491), wk = 0.0022727 k( 335) = ( -0.3016414 0.8520823 0.5229491), wk = 0.0022727 k( 336) = ( -0.3062544 0.8355015 0.5229491), wk = 0.0022727 k( 337) = ( -0.3108674 0.8189206 0.5229491), wk = 0.0022727 k( 338) = ( -0.3154804 0.8023398 0.5229491), wk = 0.0022727 k( 339) = ( -0.3200934 0.7857589 0.5229491), wk = 0.0022727 k( 340) = ( -0.3247064 0.7691781 0.5229491), wk = 0.0022727 k( 341) = ( -0.3293194 0.7525972 0.5229491), wk = 0.0022727 k( 342) = ( -0.3339323 0.7360164 0.5229491), wk = 0.0022727 k( 343) = ( -0.3385453 0.7194356 0.5229491), wk = 0.0022727 k( 344) = ( -0.3431583 0.7028547 0.5229491), wk = 0.0022727 k( 345) = ( -0.3477713 0.6862739 0.5229491), wk = 0.0022727 k( 346) = ( -0.3523843 0.6696930 0.5229491), wk = 0.0022727 k( 347) = ( -0.3569973 0.6531122 0.5229491), wk = 0.0022727 k( 348) = ( -0.3616103 0.6365313 0.5229491), wk = 0.0022727 k( 349) = ( -0.3662233 0.6199505 0.5229491), wk = 0.0022727 k( 350) = ( -0.3708363 0.6033697 0.5229491), wk = 0.0022727 k( 351) = ( -0.3754493 0.5867888 0.5229491), wk = 0.0022727 k( 352) = ( -0.3800622 0.5702080 0.5229491), wk = 0.0022727 k( 353) = ( -0.3846752 0.5536271 0.5229491), wk = 0.0022727 k( 354) = ( -0.3892882 0.5370463 0.5229491), wk = 0.0022727 k( 355) = ( -0.3939012 0.5204654 0.5229491), wk = 0.0022727 k( 356) = ( -0.3985142 0.5038846 0.5229491), wk = 0.0022727 k( 357) = ( -0.4031272 0.4873038 0.5229491), wk = 0.0022727 k( 358) = ( -0.4077402 0.4707229 0.5229491), wk = 0.0022727 k( 359) = ( -0.4123532 0.4541421 0.5229491), wk = 0.0022727 k( 360) = ( -0.4169662 0.4375612 0.5229491), wk = 0.0022727 k( 361) = ( -0.4215792 0.4209804 0.5229491), wk = 0.0022727 k( 362) = ( -0.4261921 0.4043995 0.5229491), wk = 0.0022727 k( 363) = ( -0.4308051 0.3878187 0.5229491), wk = 0.0022727 k( 364) = ( -0.4354181 0.3712378 0.5229491), wk = 0.0022727 k( 365) = ( -0.4400311 0.3546570 0.5229491), wk = 0.0022727 k( 366) = ( -0.4446441 0.3380761 0.5229491), wk = 0.0022727 k( 367) = ( -0.4492571 0.3214953 0.5229491), wk = 0.0022727 k( 368) = ( -0.4538701 0.3049144 0.5229491), wk = 0.0022727 k( 369) = ( -0.4584831 0.2883336 0.5229491), wk = 0.0022727 k( 370) = ( -0.4630961 0.2717528 0.5229491), wk = 0.0022727 k( 371) = ( -0.4677091 0.2551719 0.5229491), wk = 0.0022727 k( 372) = ( -0.4723221 0.2385911 0.5229491), wk = 0.0022727 k( 373) = ( -0.4769351 0.2220102 0.5229491), wk = 0.0022727 k( 374) = ( -0.4815480 0.2054294 0.5229491), wk = 0.0022727 k( 375) = ( -0.4861610 0.1888485 0.5229491), wk = 0.0022727 k( 376) = ( -0.4907740 0.1722677 0.5229491), wk = 0.0022727 k( 377) = ( -0.4953870 0.1556869 0.5229491), wk = 0.0022727 k( 378) = ( -0.5000000 0.1391060 0.5229491), wk = 0.0022727 k( 379) = ( -0.5000000 0.1391060 0.5229491), wk = 0.0022727 k( 380) = ( -0.5000000 0.1391060 0.5055175), wk = 0.0022727 k( 381) = ( -0.5000000 0.1391060 0.4880859), wk = 0.0022727 k( 382) = ( -0.5000000 0.1391060 0.4706542), wk = 0.0022727 k( 383) = ( -0.5000000 0.1391060 0.4532226), wk = 0.0022727 k( 384) = ( -0.5000000 0.1391060 0.4357909), wk = 0.0022727 k( 385) = ( -0.5000000 0.1391060 0.4183593), wk = 0.0022727 k( 386) = ( -0.5000000 0.1391060 0.4009277), wk = 0.0022727 k( 387) = ( -0.5000000 0.1391060 0.3834960), wk = 0.0022727 k( 388) = ( -0.5000000 0.1391060 0.3660644), wk = 0.0022727 k( 389) = ( -0.5000000 0.1391060 0.3486328), wk = 0.0022727 k( 390) = ( -0.5000000 0.1391060 0.3312011), wk = 0.0022727 k( 391) = ( -0.5000000 0.1391060 0.3137695), wk = 0.0022727 k( 392) = ( -0.5000000 0.1391060 0.2963378), wk = 0.0022727 k( 393) = ( -0.5000000 0.1391060 0.2789062), wk = 0.0022727 k( 394) = ( -0.5000000 0.1391060 0.2614746), wk = 0.0022727 k( 395) = ( -0.5000000 0.1391060 0.2440429), wk = 0.0022727 k( 396) = ( -0.5000000 0.1391060 0.2266113), wk = 0.0022727 k( 397) = ( -0.5000000 0.1391060 0.2091797), wk = 0.0022727 k( 398) = ( -0.5000000 0.1391060 0.1917480), wk = 0.0022727 k( 399) = ( -0.5000000 0.1391060 0.1743164), wk = 0.0022727 k( 400) = ( -0.5000000 0.1391060 0.1568847), wk = 0.0022727 k( 401) = ( -0.5000000 0.1391060 0.1394531), wk = 0.0022727 k( 402) = ( -0.5000000 0.1391060 0.1220215), wk = 0.0022727 k( 403) = ( -0.5000000 0.1391060 0.1045898), wk = 0.0022727 k( 404) = ( -0.5000000 0.1391060 0.0871582), wk = 0.0022727 k( 405) = ( -0.5000000 0.1391060 0.0697266), wk = 0.0022727 k( 406) = ( -0.5000000 0.1391060 0.0522949), wk = 0.0022727 k( 407) = ( -0.5000000 0.1391060 0.0348633), wk = 0.0022727 k( 408) = ( -0.5000000 0.1391060 0.0174316), wk = 0.0022727 k( 409) = ( -0.5000000 0.1391060 0.0000000), wk = 0.0022727 k( 410) = ( 0.0000000 0.0000000 0.5229491), wk = 0.0022727 k( 411) = ( -0.0166667 0.0046369 0.5229491), wk = 0.0022727 k( 412) = ( -0.0333333 0.0092737 0.5229491), wk = 0.0022727 k( 413) = ( -0.0500000 0.0139106 0.5229491), wk = 0.0022727 k( 414) = ( -0.0666667 0.0185475 0.5229491), wk = 0.0022727 k( 415) = ( -0.0833333 0.0231843 0.5229491), wk = 0.0022727 k( 416) = ( -0.1000000 0.0278212 0.5229491), wk = 0.0022727 k( 417) = ( -0.1166667 0.0324581 0.5229491), wk = 0.0022727 k( 418) = ( -0.1333333 0.0370949 0.5229491), wk = 0.0022727 k( 419) = ( -0.1500000 0.0417318 0.5229491), wk = 0.0022727 k( 420) = ( -0.1666667 0.0463687 0.5229491), wk = 0.0022727 k( 421) = ( -0.1833333 0.0510055 0.5229491), wk = 0.0022727 k( 422) = ( -0.2000000 0.0556424 0.5229491), wk = 0.0022727 k( 423) = ( -0.2166667 0.0602793 0.5229491), wk = 0.0022727 k( 424) = ( -0.2333333 0.0649161 0.5229491), wk = 0.0022727 k( 425) = ( -0.2500000 0.0695530 0.5229491), wk = 0.0022727 k( 426) = ( -0.2666667 0.0741899 0.5229491), wk = 0.0022727 k( 427) = ( -0.2833333 0.0788267 0.5229491), wk = 0.0022727 k( 428) = ( -0.3000000 0.0834636 0.5229491), wk = 0.0022727 k( 429) = ( -0.3166667 0.0881005 0.5229491), wk = 0.0022727 k( 430) = ( -0.3333333 0.0927373 0.5229491), wk = 0.0022727 k( 431) = ( -0.3500000 0.0973742 0.5229491), wk = 0.0022727 k( 432) = ( -0.3666667 0.1020111 0.5229491), wk = 0.0022727 k( 433) = ( -0.3833333 0.1066479 0.5229491), wk = 0.0022727 k( 434) = ( -0.4000000 0.1112848 0.5229491), wk = 0.0022727 k( 435) = ( -0.4166667 0.1159217 0.5229491), wk = 0.0022727 k( 436) = ( -0.4333333 0.1205585 0.5229491), wk = 0.0022727 k( 437) = ( -0.4500000 0.1251954 0.5229491), wk = 0.0022727 k( 438) = ( -0.4666667 0.1298323 0.5229491), wk = 0.0022727 k( 439) = ( -0.4833333 0.1344691 0.5229491), wk = 0.0022727 k( 440) = ( -0.5000000 0.1391060 0.5229491), wk = 0.0022727 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 2) = ( 0.0046440 0.0046440 -0.0000000), wk = 0.0022727 k( 3) = ( 0.0092879 0.0092879 -0.0000000), wk = 0.0022727 k( 4) = ( 0.0139319 0.0139319 0.0000000), wk = 0.0022727 k( 5) = ( 0.0185759 0.0185759 -0.0000000), wk = 0.0022727 k( 6) = ( 0.0232199 0.0232199 -0.0000000), wk = 0.0022727 k( 7) = ( 0.0278638 0.0278638 0.0000000), wk = 0.0022727 k( 8) = ( 0.0325078 0.0325078 0.0000000), wk = 0.0022727 k( 9) = ( 0.0371518 0.0371518 0.0000000), wk = 0.0022727 k( 10) = ( 0.0417958 0.0417958 0.0000000), wk = 0.0022727 k( 11) = ( 0.0464397 0.0464397 -0.0000000), wk = 0.0022727 k( 12) = ( 0.0510837 0.0510837 0.0000000), wk = 0.0022727 k( 13) = ( 0.0557277 0.0557277 0.0000000), wk = 0.0022727 k( 14) = ( 0.0603717 0.0603717 0.0000000), wk = 0.0022727 k( 15) = ( 0.0650156 0.0650156 0.0000000), wk = 0.0022727 k( 16) = ( 0.0696596 0.0696596 0.0000000), wk = 0.0022727 k( 17) = ( 0.0743036 0.0743036 0.0000000), wk = 0.0022727 k( 18) = ( 0.0789476 0.0789476 0.0000000), wk = 0.0022727 k( 19) = ( 0.0835915 0.0835915 0.0000000), wk = 0.0022727 k( 20) = ( 0.0882355 0.0882355 -0.0000000), wk = 0.0022727 k( 21) = ( 0.0928795 0.0928795 -0.0000000), wk = 0.0022727 k( 22) = ( 0.0975234 0.0975234 0.0000000), wk = 0.0022727 k( 23) = ( 0.1021674 0.1021674 0.0000000), wk = 0.0022727 k( 24) = ( 0.1068114 0.1068114 0.0000000), wk = 0.0022727 k( 25) = ( 0.1114554 0.1114554 0.0000000), wk = 0.0022727 k( 26) = ( 0.1160994 0.1160994 -0.0000000), wk = 0.0022727 k( 27) = ( 0.1207433 0.1207433 0.0000000), wk = 0.0022727 k( 28) = ( 0.1253873 0.1253873 0.0000000), wk = 0.0022727 k( 29) = ( 0.1300313 0.1300313 0.0000000), wk = 0.0022727 k( 30) = ( 0.1346752 0.1346752 0.0000000), wk = 0.0022727 k( 31) = ( 0.1393192 0.1393192 0.0000000), wk = 0.0022727 k( 32) = ( 0.1439632 0.1439632 0.0000000), wk = 0.0022727 k( 33) = ( 0.1486072 0.1486072 0.0000000), wk = 0.0022727 k( 34) = ( 0.1532511 0.1532511 0.0000000), wk = 0.0022727 k( 35) = ( 0.1578951 0.1578951 0.0000000), wk = 0.0022727 k( 36) = ( 0.1625391 0.1625391 0.0000000), wk = 0.0022727 k( 37) = ( 0.1671831 0.1671831 0.0000000), wk = 0.0022727 k( 38) = ( 0.1718270 0.1718270 0.0000000), wk = 0.0022727 k( 39) = ( 0.1764710 0.1764710 0.0000000), wk = 0.0022727 k( 40) = ( 0.1811150 0.1811150 -0.0000000), wk = 0.0022727 k( 41) = ( 0.1857590 0.1857590 0.0000000), wk = 0.0022727 k( 42) = ( 0.1904029 0.1904029 0.0000000), wk = 0.0022727 k( 43) = ( 0.1950469 0.1950469 0.0000000), wk = 0.0022727 k( 44) = ( 0.1996909 0.1996909 0.0000000), wk = 0.0022727 k( 45) = ( 0.2043349 0.2043349 -0.0000000), wk = 0.0022727 k( 46) = ( 0.2089788 0.2089788 0.0000000), wk = 0.0022727 k( 47) = ( 0.2136228 0.2136228 0.0000000), wk = 0.0022727 k( 48) = ( 0.2182668 0.2182668 0.0000000), wk = 0.0022727 k( 49) = ( 0.2229107 0.2229107 0.0000000), wk = 0.0022727 k( 50) = ( 0.2275547 0.2275547 0.0000000), wk = 0.0022727 k( 51) = ( 0.2321987 0.2321987 -0.0000000), wk = 0.0022727 k( 52) = ( 0.2368427 0.2368427 -0.0000000), wk = 0.0022727 k( 53) = ( 0.2414866 0.2414866 0.0000000), wk = 0.0022727 k( 54) = ( 0.2461306 0.2461306 0.0000000), wk = 0.0022727 k( 55) = ( 0.2507746 0.2507746 0.0000000), wk = 0.0022727 k( 56) = ( 0.2554186 0.2554186 0.0000000), wk = 0.0022727 k( 57) = ( 0.2600625 0.2600625 0.0000000), wk = 0.0022727 k( 58) = ( 0.2647065 0.2647065 -0.0000000), wk = 0.0022727 k( 59) = ( 0.2693505 0.2693505 0.0000000), wk = 0.0022727 k( 60) = ( 0.2693505 0.2693505 0.0000000), wk = 0.0022727 k( 61) = ( 0.2525161 0.2837661 0.0000000), wk = 0.0022727 k( 62) = ( 0.2356817 0.2981817 0.0000000), wk = 0.0022727 k( 63) = ( 0.2188473 0.3125973 0.0000000), wk = 0.0022727 k( 64) = ( 0.2020129 0.3270129 0.0000000), wk = 0.0022727 k( 65) = ( 0.1851785 0.3414285 0.0000000), wk = 0.0022727 k( 66) = ( 0.1683440 0.3558441 0.0000000), wk = 0.0022727 k( 67) = ( 0.1515096 0.3702596 0.0000000), wk = 0.0022727 k( 68) = ( 0.1346752 0.3846752 0.0000000), wk = 0.0022727 k( 69) = ( 0.1178408 0.3990908 0.0000000), wk = 0.0022727 k( 70) = ( 0.1010064 0.4135064 0.0000000), wk = 0.0022727 k( 71) = ( 0.0841720 0.4279220 0.0000000), wk = 0.0022727 k( 72) = ( 0.0673376 0.4423376 0.0000000), wk = 0.0022727 k( 73) = ( 0.0505032 0.4567532 0.0000000), wk = 0.0022727 k( 74) = ( 0.0336688 0.4711688 0.0000000), wk = 0.0022727 k( 75) = ( 0.0168344 0.4855844 0.0000000), wk = 0.0022727 k( 76) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022727 k( 77) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022727 k( 78) = ( 0.0000000 0.5000000 0.0166667), wk = 0.0022727 k( 79) = ( 0.0000000 0.5000000 0.0333333), wk = 0.0022727 k( 80) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0022727 k( 81) = ( 0.0000000 0.5000000 0.0666667), wk = 0.0022727 k( 82) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0022727 k( 83) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0022727 k( 84) = ( 0.0000000 0.5000000 0.1166667), wk = 0.0022727 k( 85) = ( 0.0000000 0.5000000 0.1333333), wk = 0.0022727 k( 86) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0022727 k( 87) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0022727 k( 88) = ( 0.0000000 0.5000000 0.1833333), wk = 0.0022727 k( 89) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0022727 k( 90) = ( 0.0000000 0.5000000 0.2166667), wk = 0.0022727 k( 91) = ( 0.0000000 0.5000000 0.2333333), wk = 0.0022727 k( 92) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0022727 k( 93) = ( 0.0000000 0.5000000 0.2666667), wk = 0.0022727 k( 94) = ( 0.0000000 0.5000000 0.2833333), wk = 0.0022727 k( 95) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0022727 k( 96) = ( 0.0000000 0.5000000 0.3166667), wk = 0.0022727 k( 97) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0022727 k( 98) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0022727 k( 99) = ( 0.0000000 0.5000000 0.3666667), wk = 0.0022727 k( 100) = ( 0.0000000 0.5000000 0.3833333), wk = 0.0022727 k( 101) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0022727 k( 102) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0022727 k( 103) = ( 0.0000000 0.5000000 0.4333333), wk = 0.0022727 k( 104) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0022727 k( 105) = ( 0.0000000 0.5000000 0.4666667), wk = 0.0022727 k( 106) = ( 0.0000000 0.5000000 0.4833333), wk = 0.0022727 k( 107) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022727 k( 108) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022727 k( 109) = ( 0.0168344 0.4855844 0.5000000), wk = 0.0022727 k( 110) = ( 0.0336688 0.4711688 0.5000000), wk = 0.0022727 k( 111) = ( 0.0505032 0.4567532 0.5000000), wk = 0.0022727 k( 112) = ( 0.0673376 0.4423376 0.5000000), wk = 0.0022727 k( 113) = ( 0.0841720 0.4279220 0.5000000), wk = 0.0022727 k( 114) = ( 0.1010064 0.4135064 0.5000000), wk = 0.0022727 k( 115) = ( 0.1178408 0.3990908 0.5000000), wk = 0.0022727 k( 116) = ( 0.1346752 0.3846752 0.5000000), wk = 0.0022727 k( 117) = ( 0.1515096 0.3702596 0.5000000), wk = 0.0022727 k( 118) = ( 0.1683440 0.3558441 0.5000000), wk = 0.0022727 k( 119) = ( 0.1851785 0.3414285 0.5000000), wk = 0.0022727 k( 120) = ( 0.2020129 0.3270129 0.5000000), wk = 0.0022727 k( 121) = ( 0.2188473 0.3125973 0.5000000), wk = 0.0022727 k( 122) = ( 0.2356817 0.2981817 0.5000000), wk = 0.0022727 k( 123) = ( 0.2525161 0.2837661 0.5000000), wk = 0.0022727 k( 124) = ( 0.2693505 0.2693505 0.5000000), wk = 0.0022727 k( 125) = ( 0.2693505 0.2693505 0.5000000), wk = 0.0022727 k( 126) = ( 0.2647065 0.2647065 0.5000000), wk = 0.0022727 k( 127) = ( 0.2600625 0.2600625 0.5000000), wk = 0.0022727 k( 128) = ( 0.2554186 0.2554186 0.5000000), wk = 0.0022727 k( 129) = ( 0.2507746 0.2507746 0.5000000), wk = 0.0022727 k( 130) = ( 0.2461306 0.2461306 0.5000000), wk = 0.0022727 k( 131) = ( 0.2414866 0.2414866 0.5000000), wk = 0.0022727 k( 132) = ( 0.2368427 0.2368427 0.5000000), wk = 0.0022727 k( 133) = ( 0.2321987 0.2321987 0.5000000), wk = 0.0022727 k( 134) = ( 0.2275547 0.2275547 0.5000000), wk = 0.0022727 k( 135) = ( 0.2229107 0.2229107 0.5000000), wk = 0.0022727 k( 136) = ( 0.2182668 0.2182668 0.5000000), wk = 0.0022727 k( 137) = ( 0.2136228 0.2136228 0.5000000), wk = 0.0022727 k( 138) = ( 0.2089788 0.2089788 0.5000000), wk = 0.0022727 k( 139) = ( 0.2043349 0.2043349 0.5000000), wk = 0.0022727 k( 140) = ( 0.1996909 0.1996909 0.5000000), wk = 0.0022727 k( 141) = ( 0.1950469 0.1950469 0.5000000), wk = 0.0022727 k( 142) = ( 0.1904029 0.1904029 0.5000000), wk = 0.0022727 k( 143) = ( 0.1857590 0.1857590 0.5000000), wk = 0.0022727 k( 144) = ( 0.1811150 0.1811150 0.5000000), wk = 0.0022727 k( 145) = ( 0.1764710 0.1764710 0.5000000), wk = 0.0022727 k( 146) = ( 0.1718270 0.1718270 0.5000000), wk = 0.0022727 k( 147) = ( 0.1671831 0.1671831 0.5000000), wk = 0.0022727 k( 148) = ( 0.1625391 0.1625391 0.5000000), wk = 0.0022727 k( 149) = ( 0.1578951 0.1578951 0.5000000), wk = 0.0022727 k( 150) = ( 0.1532511 0.1532511 0.5000000), wk = 0.0022727 k( 151) = ( 0.1486072 0.1486072 0.5000000), wk = 0.0022727 k( 152) = ( 0.1439632 0.1439632 0.5000000), wk = 0.0022727 k( 153) = ( 0.1393192 0.1393192 0.5000000), wk = 0.0022727 k( 154) = ( 0.1346752 0.1346752 0.5000000), wk = 0.0022727 k( 155) = ( 0.1300313 0.1300313 0.5000000), wk = 0.0022727 k( 156) = ( 0.1253873 0.1253873 0.5000000), wk = 0.0022727 k( 157) = ( 0.1207433 0.1207433 0.5000000), wk = 0.0022727 k( 158) = ( 0.1160994 0.1160994 0.5000000), wk = 0.0022727 k( 159) = ( 0.1114554 0.1114554 0.5000000), wk = 0.0022727 k( 160) = ( 0.1068114 0.1068114 0.5000000), wk = 0.0022727 k( 161) = ( 0.1021674 0.1021674 0.5000000), wk = 0.0022727 k( 162) = ( 0.0975234 0.0975234 0.5000000), wk = 0.0022727 k( 163) = ( 0.0928795 0.0928795 0.5000000), wk = 0.0022727 k( 164) = ( 0.0882355 0.0882355 0.5000000), wk = 0.0022727 k( 165) = ( 0.0835915 0.0835915 0.5000000), wk = 0.0022727 k( 166) = ( 0.0789476 0.0789476 0.5000000), wk = 0.0022727 k( 167) = ( 0.0743036 0.0743036 0.5000000), wk = 0.0022727 k( 168) = ( 0.0696596 0.0696596 0.5000000), wk = 0.0022727 k( 169) = ( 0.0650156 0.0650156 0.5000000), wk = 0.0022727 k( 170) = ( 0.0603717 0.0603717 0.5000000), wk = 0.0022727 k( 171) = ( 0.0557277 0.0557277 0.5000000), wk = 0.0022727 k( 172) = ( 0.0510837 0.0510837 0.5000000), wk = 0.0022727 k( 173) = ( 0.0464397 0.0464397 0.5000000), wk = 0.0022727 k( 174) = ( 0.0417958 0.0417958 0.5000000), wk = 0.0022727 k( 175) = ( 0.0371518 0.0371518 0.5000000), wk = 0.0022727 k( 176) = ( 0.0325078 0.0325078 0.5000000), wk = 0.0022727 k( 177) = ( 0.0278638 0.0278638 0.5000000), wk = 0.0022727 k( 178) = ( 0.0232199 0.0232199 0.5000000), wk = 0.0022727 k( 179) = ( 0.0185759 0.0185759 0.5000000), wk = 0.0022727 k( 180) = ( 0.0139319 0.0139319 0.5000000), wk = 0.0022727 k( 181) = ( 0.0092879 0.0092879 0.5000000), wk = 0.0022727 k( 182) = ( 0.0046440 0.0046440 0.5000000), wk = 0.0022727 k( 183) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022727 k( 184) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022727 k( 185) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0022727 k( 186) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0022727 k( 187) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0022727 k( 188) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0022727 k( 189) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0022727 k( 190) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0022727 k( 191) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0022727 k( 192) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0022727 k( 193) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0022727 k( 194) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0022727 k( 195) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0022727 k( 196) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0022727 k( 197) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0022727 k( 198) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0022727 k( 199) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0022727 k( 200) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0022727 k( 201) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0022727 k( 202) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0022727 k( 203) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0022727 k( 204) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0022727 k( 205) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0022727 k( 206) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0022727 k( 207) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0022727 k( 208) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0022727 k( 209) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0022727 k( 210) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0022727 k( 211) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0022727 k( 212) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0022727 k( 213) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0022727 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 215) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022727 k( 216) = ( -0.0166667 0.0166667 -0.0000000), wk = 0.0022727 k( 217) = ( -0.0333333 0.0333333 -0.0000000), wk = 0.0022727 k( 218) = ( -0.0500000 0.0500000 0.0000000), wk = 0.0022727 k( 219) = ( -0.0666667 0.0666667 -0.0000000), wk = 0.0022727 k( 220) = ( -0.0833333 0.0833333 -0.0000000), wk = 0.0022727 k( 221) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0022727 k( 222) = ( -0.1166667 0.1166667 -0.0000000), wk = 0.0022727 k( 223) = ( -0.1333333 0.1333333 0.0000000), wk = 0.0022727 k( 224) = ( -0.1500000 0.1500000 -0.0000000), wk = 0.0022727 k( 225) = ( -0.1666667 0.1666667 0.0000000), wk = 0.0022727 k( 226) = ( -0.1833333 0.1833333 0.0000000), wk = 0.0022727 k( 227) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0022727 k( 228) = ( -0.2166667 0.2166667 -0.0000000), wk = 0.0022727 k( 229) = ( -0.2333333 0.2333333 -0.0000000), wk = 0.0022727 k( 230) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0022727 k( 231) = ( -0.2666667 0.2666667 -0.0000000), wk = 0.0022727 k( 232) = ( -0.2833333 0.2833333 -0.0000000), wk = 0.0022727 k( 233) = ( -0.3000000 0.3000000 -0.0000000), wk = 0.0022727 k( 234) = ( -0.3166667 0.3166667 0.0000000), wk = 0.0022727 k( 235) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0022727 k( 236) = ( -0.3500000 0.3500000 0.0000000), wk = 0.0022727 k( 237) = ( -0.3666667 0.3666667 -0.0000000), wk = 0.0022727 k( 238) = ( -0.3833333 0.3833333 -0.0000000), wk = 0.0022727 k( 239) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0022727 k( 240) = ( -0.4166667 0.4166667 -0.0000000), wk = 0.0022727 k( 241) = ( -0.4333333 0.4333333 -0.0000000), wk = 0.0022727 k( 242) = ( -0.4500000 0.4500000 -0.0000000), wk = 0.0022727 k( 243) = ( -0.4666667 0.4666667 -0.0000000), wk = 0.0022727 k( 244) = ( -0.4833333 0.4833333 -0.0000000), wk = 0.0022727 k( 245) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022727 k( 246) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022727 k( 247) = ( -0.4953870 0.5046130 0.0000000), wk = 0.0022727 k( 248) = ( -0.4907740 0.5092260 0.0000000), wk = 0.0022727 k( 249) = ( -0.4861610 0.5138390 -0.0000000), wk = 0.0022727 k( 250) = ( -0.4815480 0.5184520 0.0000000), wk = 0.0022727 k( 251) = ( -0.4769351 0.5230649 0.0000000), wk = 0.0022727 k( 252) = ( -0.4723221 0.5276779 0.0000000), wk = 0.0022727 k( 253) = ( -0.4677091 0.5322909 0.0000000), wk = 0.0022727 k( 254) = ( -0.4630961 0.5369039 0.0000000), wk = 0.0022727 k( 255) = ( -0.4584831 0.5415169 0.0000000), wk = 0.0022727 k( 256) = ( -0.4538701 0.5461299 0.0000000), wk = 0.0022727 k( 257) = ( -0.4492571 0.5507429 0.0000000), wk = 0.0022727 k( 258) = ( -0.4446441 0.5553559 0.0000000), wk = 0.0022727 k( 259) = ( -0.4400311 0.5599689 0.0000000), wk = 0.0022727 k( 260) = ( -0.4354181 0.5645819 0.0000000), wk = 0.0022727 k( 261) = ( -0.4308051 0.5691949 0.0000000), wk = 0.0022727 k( 262) = ( -0.4261921 0.5738079 -0.0000000), wk = 0.0022727 k( 263) = ( -0.4215792 0.5784208 0.0000000), wk = 0.0022727 k( 264) = ( -0.4169662 0.5830338 0.0000000), wk = 0.0022727 k( 265) = ( -0.4123532 0.5876468 0.0000000), wk = 0.0022727 k( 266) = ( -0.4077402 0.5922598 0.0000000), wk = 0.0022727 k( 267) = ( -0.4031272 0.5968728 -0.0000000), wk = 0.0022727 k( 268) = ( -0.3985142 0.6014858 0.0000000), wk = 0.0022727 k( 269) = ( -0.3939012 0.6060988 -0.0000000), wk = 0.0022727 k( 270) = ( -0.3892882 0.6107118 0.0000000), wk = 0.0022727 k( 271) = ( -0.3846752 0.6153248 -0.0000000), wk = 0.0022727 k( 272) = ( -0.3800622 0.6199377 -0.0000000), wk = 0.0022727 k( 273) = ( -0.3754493 0.6245507 0.0000000), wk = 0.0022727 k( 274) = ( -0.3708363 0.6291637 0.0000000), wk = 0.0022727 k( 275) = ( -0.3662233 0.6337767 0.0000000), wk = 0.0022727 k( 276) = ( -0.3616103 0.6383897 -0.0000000), wk = 0.0022727 k( 277) = ( -0.3569973 0.6430027 0.0000000), wk = 0.0022727 k( 278) = ( -0.3523843 0.6476157 0.0000000), wk = 0.0022727 k( 279) = ( -0.3477713 0.6522287 0.0000000), wk = 0.0022727 k( 280) = ( -0.3431583 0.6568417 -0.0000000), wk = 0.0022727 k( 281) = ( -0.3385453 0.6614547 -0.0000000), wk = 0.0022727 k( 282) = ( -0.3339323 0.6660677 -0.0000000), wk = 0.0022727 k( 283) = ( -0.3293194 0.6706806 0.0000000), wk = 0.0022727 k( 284) = ( -0.3247064 0.6752936 -0.0000000), wk = 0.0022727 k( 285) = ( -0.3200934 0.6799066 -0.0000000), wk = 0.0022727 k( 286) = ( -0.3154804 0.6845196 -0.0000000), wk = 0.0022727 k( 287) = ( -0.3108674 0.6891326 -0.0000000), wk = 0.0022727 k( 288) = ( -0.3062544 0.6937456 0.0000000), wk = 0.0022727 k( 289) = ( -0.3016414 0.6983586 0.0000000), wk = 0.0022727 k( 290) = ( -0.2970284 0.7029716 0.0000000), wk = 0.0022727 k( 291) = ( -0.2924154 0.7075846 0.0000000), wk = 0.0022727 k( 292) = ( -0.2878024 0.7121976 -0.0000000), wk = 0.0022727 k( 293) = ( -0.2831895 0.7168106 0.0000000), wk = 0.0022727 k( 294) = ( -0.2785765 0.7214235 0.0000000), wk = 0.0022727 k( 295) = ( -0.2739635 0.7260365 -0.0000000), wk = 0.0022727 k( 296) = ( -0.2693505 0.7306495 0.0000000), wk = 0.0022727 k( 297) = ( -0.2693505 0.7306495 0.0000000), wk = 0.0022727 k( 298) = ( -0.2693505 0.7306495 0.0166667), wk = 0.0022727 k( 299) = ( -0.2693505 0.7306495 0.0333333), wk = 0.0022727 k( 300) = ( -0.2693505 0.7306495 0.0500000), wk = 0.0022727 k( 301) = ( -0.2693505 0.7306495 0.0666667), wk = 0.0022727 k( 302) = ( -0.2693505 0.7306495 0.0833333), wk = 0.0022727 k( 303) = ( -0.2693505 0.7306495 0.1000000), wk = 0.0022727 k( 304) = ( -0.2693505 0.7306495 0.1166667), wk = 0.0022727 k( 305) = ( -0.2693505 0.7306495 0.1333333), wk = 0.0022727 k( 306) = ( -0.2693505 0.7306495 0.1500000), wk = 0.0022727 k( 307) = ( -0.2693505 0.7306495 0.1666667), wk = 0.0022727 k( 308) = ( -0.2693505 0.7306495 0.1833333), wk = 0.0022727 k( 309) = ( -0.2693505 0.7306495 0.2000000), wk = 0.0022727 k( 310) = ( -0.2693505 0.7306495 0.2166667), wk = 0.0022727 k( 311) = ( -0.2693505 0.7306495 0.2333333), wk = 0.0022727 k( 312) = ( -0.2693505 0.7306495 0.2500000), wk = 0.0022727 k( 313) = ( -0.2693505 0.7306495 0.2666667), wk = 0.0022727 k( 314) = ( -0.2693505 0.7306495 0.2833333), wk = 0.0022727 k( 315) = ( -0.2693505 0.7306495 0.3000000), wk = 0.0022727 k( 316) = ( -0.2693505 0.7306495 0.3166667), wk = 0.0022727 k( 317) = ( -0.2693505 0.7306495 0.3333333), wk = 0.0022727 k( 318) = ( -0.2693505 0.7306495 0.3500000), wk = 0.0022727 k( 319) = ( -0.2693505 0.7306495 0.3666667), wk = 0.0022727 k( 320) = ( -0.2693505 0.7306495 0.3833333), wk = 0.0022727 k( 321) = ( -0.2693505 0.7306495 0.4000000), wk = 0.0022727 k( 322) = ( -0.2693505 0.7306495 0.4166667), wk = 0.0022727 k( 323) = ( -0.2693505 0.7306495 0.4333333), wk = 0.0022727 k( 324) = ( -0.2693505 0.7306495 0.4500000), wk = 0.0022727 k( 325) = ( -0.2693505 0.7306495 0.4666667), wk = 0.0022727 k( 326) = ( -0.2693505 0.7306495 0.4833333), wk = 0.0022727 k( 327) = ( -0.2693505 0.7306495 0.5000000), wk = 0.0022727 k( 328) = ( -0.2693505 0.7306495 0.5000000), wk = 0.0022727 k( 329) = ( -0.2739635 0.7260365 0.5000000), wk = 0.0022727 k( 330) = ( -0.2785765 0.7214235 0.5000000), wk = 0.0022727 k( 331) = ( -0.2831895 0.7168106 0.5000000), wk = 0.0022727 k( 332) = ( -0.2878024 0.7121976 0.5000000), wk = 0.0022727 k( 333) = ( -0.2924154 0.7075846 0.5000000), wk = 0.0022727 k( 334) = ( -0.2970284 0.7029716 0.5000000), wk = 0.0022727 k( 335) = ( -0.3016414 0.6983586 0.5000000), wk = 0.0022727 k( 336) = ( -0.3062544 0.6937456 0.5000000), wk = 0.0022727 k( 337) = ( -0.3108674 0.6891326 0.5000000), wk = 0.0022727 k( 338) = ( -0.3154804 0.6845196 0.5000000), wk = 0.0022727 k( 339) = ( -0.3200934 0.6799066 0.5000000), wk = 0.0022727 k( 340) = ( -0.3247064 0.6752936 0.5000000), wk = 0.0022727 k( 341) = ( -0.3293194 0.6706806 0.5000000), wk = 0.0022727 k( 342) = ( -0.3339323 0.6660677 0.5000000), wk = 0.0022727 k( 343) = ( -0.3385453 0.6614547 0.5000000), wk = 0.0022727 k( 344) = ( -0.3431583 0.6568417 0.5000000), wk = 0.0022727 k( 345) = ( -0.3477713 0.6522287 0.5000000), wk = 0.0022727 k( 346) = ( -0.3523843 0.6476157 0.5000000), wk = 0.0022727 k( 347) = ( -0.3569973 0.6430027 0.5000000), wk = 0.0022727 k( 348) = ( -0.3616103 0.6383897 0.5000000), wk = 0.0022727 k( 349) = ( -0.3662233 0.6337767 0.5000000), wk = 0.0022727 k( 350) = ( -0.3708363 0.6291637 0.5000000), wk = 0.0022727 k( 351) = ( -0.3754493 0.6245507 0.5000000), wk = 0.0022727 k( 352) = ( -0.3800622 0.6199377 0.5000000), wk = 0.0022727 k( 353) = ( -0.3846752 0.6153248 0.5000000), wk = 0.0022727 k( 354) = ( -0.3892882 0.6107118 0.5000000), wk = 0.0022727 k( 355) = ( -0.3939012 0.6060988 0.5000000), wk = 0.0022727 k( 356) = ( -0.3985142 0.6014858 0.5000000), wk = 0.0022727 k( 357) = ( -0.4031272 0.5968728 0.5000000), wk = 0.0022727 k( 358) = ( -0.4077402 0.5922598 0.5000000), wk = 0.0022727 k( 359) = ( -0.4123532 0.5876468 0.5000000), wk = 0.0022727 k( 360) = ( -0.4169662 0.5830338 0.5000000), wk = 0.0022727 k( 361) = ( -0.4215792 0.5784208 0.5000000), wk = 0.0022727 k( 362) = ( -0.4261921 0.5738079 0.5000000), wk = 0.0022727 k( 363) = ( -0.4308051 0.5691949 0.5000000), wk = 0.0022727 k( 364) = ( -0.4354181 0.5645819 0.5000000), wk = 0.0022727 k( 365) = ( -0.4400311 0.5599689 0.5000000), wk = 0.0022727 k( 366) = ( -0.4446441 0.5553559 0.5000000), wk = 0.0022727 k( 367) = ( -0.4492571 0.5507429 0.5000000), wk = 0.0022727 k( 368) = ( -0.4538701 0.5461299 0.5000000), wk = 0.0022727 k( 369) = ( -0.4584831 0.5415169 0.5000000), wk = 0.0022727 k( 370) = ( -0.4630961 0.5369039 0.5000000), wk = 0.0022727 k( 371) = ( -0.4677091 0.5322909 0.5000000), wk = 0.0022727 k( 372) = ( -0.4723221 0.5276779 0.5000000), wk = 0.0022727 k( 373) = ( -0.4769351 0.5230649 0.5000000), wk = 0.0022727 k( 374) = ( -0.4815480 0.5184520 0.5000000), wk = 0.0022727 k( 375) = ( -0.4861610 0.5138390 0.5000000), wk = 0.0022727 k( 376) = ( -0.4907740 0.5092260 0.5000000), wk = 0.0022727 k( 377) = ( -0.4953870 0.5046130 0.5000000), wk = 0.0022727 k( 378) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022727 k( 379) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022727 k( 380) = ( -0.5000000 0.5000000 0.4833333), wk = 0.0022727 k( 381) = ( -0.5000000 0.5000000 0.4666667), wk = 0.0022727 k( 382) = ( -0.5000000 0.5000000 0.4500000), wk = 0.0022727 k( 383) = ( -0.5000000 0.5000000 0.4333333), wk = 0.0022727 k( 384) = ( -0.5000000 0.5000000 0.4166667), wk = 0.0022727 k( 385) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0022727 k( 386) = ( -0.5000000 0.5000000 0.3833333), wk = 0.0022727 k( 387) = ( -0.5000000 0.5000000 0.3666667), wk = 0.0022727 k( 388) = ( -0.5000000 0.5000000 0.3500000), wk = 0.0022727 k( 389) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0022727 k( 390) = ( -0.5000000 0.5000000 0.3166667), wk = 0.0022727 k( 391) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0022727 k( 392) = ( -0.5000000 0.5000000 0.2833333), wk = 0.0022727 k( 393) = ( -0.5000000 0.5000000 0.2666667), wk = 0.0022727 k( 394) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0022727 k( 395) = ( -0.5000000 0.5000000 0.2333333), wk = 0.0022727 k( 396) = ( -0.5000000 0.5000000 0.2166667), wk = 0.0022727 k( 397) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0022727 k( 398) = ( -0.5000000 0.5000000 0.1833333), wk = 0.0022727 k( 399) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0022727 k( 400) = ( -0.5000000 0.5000000 0.1500000), wk = 0.0022727 k( 401) = ( -0.5000000 0.5000000 0.1333333), wk = 0.0022727 k( 402) = ( -0.5000000 0.5000000 0.1166667), wk = 0.0022727 k( 403) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0022727 k( 404) = ( -0.5000000 0.5000000 0.0833333), wk = 0.0022727 k( 405) = ( -0.5000000 0.5000000 0.0666667), wk = 0.0022727 k( 406) = ( -0.5000000 0.5000000 0.0500000), wk = 0.0022727 k( 407) = ( -0.5000000 0.5000000 0.0333333), wk = 0.0022727 k( 408) = ( -0.5000000 0.5000000 0.0166667), wk = 0.0022727 k( 409) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0022727 k( 410) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022727 k( 411) = ( -0.0166667 0.0166667 0.5000000), wk = 0.0022727 k( 412) = ( -0.0333333 0.0333333 0.5000000), wk = 0.0022727 k( 413) = ( -0.0500000 0.0500000 0.5000000), wk = 0.0022727 k( 414) = ( -0.0666667 0.0666667 0.5000000), wk = 0.0022727 k( 415) = ( -0.0833333 0.0833333 0.5000000), wk = 0.0022727 k( 416) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0022727 k( 417) = ( -0.1166667 0.1166667 0.5000000), wk = 0.0022727 k( 418) = ( -0.1333333 0.1333333 0.5000000), wk = 0.0022727 k( 419) = ( -0.1500000 0.1500000 0.5000000), wk = 0.0022727 k( 420) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0022727 k( 421) = ( -0.1833333 0.1833333 0.5000000), wk = 0.0022727 k( 422) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0022727 k( 423) = ( -0.2166667 0.2166667 0.5000000), wk = 0.0022727 k( 424) = ( -0.2333333 0.2333333 0.5000000), wk = 0.0022727 k( 425) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0022727 k( 426) = ( -0.2666667 0.2666667 0.5000000), wk = 0.0022727 k( 427) = ( -0.2833333 0.2833333 0.5000000), wk = 0.0022727 k( 428) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0022727 k( 429) = ( -0.3166667 0.3166667 0.5000000), wk = 0.0022727 k( 430) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0022727 k( 431) = ( -0.3500000 0.3500000 0.5000000), wk = 0.0022727 k( 432) = ( -0.3666667 0.3666667 0.5000000), wk = 0.0022727 k( 433) = ( -0.3833333 0.3833333 0.5000000), wk = 0.0022727 k( 434) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0022727 k( 435) = ( -0.4166667 0.4166667 0.5000000), wk = 0.0022727 k( 436) = ( -0.4333333 0.4333333 0.5000000), wk = 0.0022727 k( 437) = ( -0.4500000 0.4500000 0.5000000), wk = 0.0022727 k( 438) = ( -0.4666667 0.4666667 0.5000000), wk = 0.0022727 k( 439) = ( -0.4833333 0.4833333 0.5000000), wk = 0.0022727 k( 440) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022727 Dense grid: 54491 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 24113 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 184, 60) NL pseudopotentials 0.19 Mb ( 92, 132) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1516) G-vector shells 0.01 Mb ( 778) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.67 Mb ( 184, 240) Each subspace H/S matrix 0.05 Mb ( 60, 60) Each matrix 0.24 Mb ( 132, 2, 60) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./CuxHOx2.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.7 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 4.0 secs Computing kpt #: 4 total cpu time spent up to now is 4.7 secs Computing kpt #: 5 total cpu time spent up to now is 5.4 secs Computing kpt #: 6 total cpu time spent up to now is 6.1 secs Computing kpt #: 7 total cpu time spent up to now is 6.8 secs Computing kpt #: 8 total cpu time spent up to now is 7.6 secs Computing kpt #: 9 total cpu time spent up to now is 8.3 secs Computing kpt #: 10 total cpu time spent up to now is 9.0 secs Computing kpt #: 11 total cpu time spent up to now is 9.7 secs Computing kpt #: 12 total cpu time spent up to now is 10.4 secs Computing kpt #: 13 total cpu time spent up to now is 11.1 secs Computing kpt #: 14 total cpu time spent up to now is 11.8 secs Computing kpt #: 15 total cpu time spent up to now is 12.5 secs Computing kpt #: 16 total cpu time spent up to now is 13.2 secs Computing kpt #: 17 total cpu time spent up to now is 13.8 secs Computing kpt #: 18 total cpu time spent up to now is 14.6 secs Computing kpt #: 19 total cpu time spent up to now is 15.3 secs Computing kpt #: 20 total cpu time spent up to now is 16.0 secs Computing kpt #: 21 total cpu time spent up to now is 16.7 secs Computing kpt #: 22 total cpu time spent up to now is 17.4 secs Computing kpt #: 23 total cpu time spent up to now is 18.1 secs Computing kpt #: 24 total cpu time spent up to now is 18.8 secs Computing kpt #: 25 total cpu time spent up to now is 19.5 secs Computing kpt #: 26 total cpu time spent up to now is 20.2 secs Computing kpt #: 27 total cpu time spent up to now is 21.0 secs Computing kpt #: 28 total cpu time spent up to now is 21.6 secs Computing kpt #: 29 total cpu time spent up to now is 22.4 secs Computing kpt #: 30 total cpu time spent up to now is 23.0 secs Computing kpt #: 31 total cpu time spent up to now is 23.8 secs Computing kpt #: 32 total cpu time spent up to now is 24.5 secs Computing kpt #: 33 total cpu time spent up to now is 25.3 secs Computing kpt #: 34 total cpu time spent up to now is 26.0 secs Computing kpt #: 35 total cpu time spent up to now is 26.7 secs Computing kpt #: 36 total cpu time spent up to now is 27.4 secs Computing kpt #: 37 total cpu time spent up to now is 28.1 secs Computing kpt #: 38 total cpu time spent up to now is 28.8 secs Computing kpt #: 39 total cpu time spent up to now is 29.6 secs Computing kpt #: 40 total cpu time spent up to now is 30.3 secs Computing kpt #: 41 total cpu time spent up to now is 31.0 secs Computing kpt #: 42 total cpu time spent up to now is 31.7 secs Computing kpt #: 43 total cpu time spent up to now is 32.5 secs Computing kpt #: 44 total cpu time spent up to now is 33.3 secs Computing kpt #: 45 total cpu time spent up to now is 34.0 secs Computing kpt #: 46 total cpu time spent up to now is 34.7 secs Computing kpt #: 47 total cpu time spent up to now is 35.5 secs Computing kpt #: 48 total cpu time spent up to now is 36.2 secs Computing kpt #: 49 total cpu time spent up to now is 36.9 secs Computing kpt #: 50 total cpu time spent up to now is 37.7 secs Computing kpt #: 51 total cpu time spent up to now is 38.4 secs Computing kpt #: 52 total cpu time spent up to now is 39.2 secs Computing kpt #: 53 total cpu time spent up to now is 39.9 secs Computing kpt #: 54 total cpu time spent up to now is 40.6 secs Computing kpt #: 55 total cpu time spent up to now is 41.3 secs Computing kpt #: 56 total cpu time spent up to now is 42.1 secs Computing kpt #: 57 total cpu time spent up to now is 42.8 secs Computing kpt #: 58 total cpu time spent up to now is 43.5 secs Computing kpt #: 59 total cpu time spent up to now is 44.3 secs Computing kpt #: 60 total cpu time spent up to now is 45.0 secs Computing kpt #: 61 total cpu time spent up to now is 45.7 secs Computing kpt #: 62 total cpu time spent up to now is 46.5 secs Computing kpt #: 63 total cpu time spent up to now is 47.2 secs Computing kpt #: 64 total cpu time spent up to now is 47.9 secs Computing kpt #: 65 total cpu time spent up to now is 48.7 secs Computing kpt #: 66 total cpu time spent up to now is 49.4 secs Computing kpt #: 67 total cpu time spent up to now is 50.1 secs Computing kpt #: 68 total cpu time spent up to now is 50.9 secs Computing kpt #: 69 total cpu time spent up to now is 51.6 secs Computing kpt #: 70 total cpu time spent up to now is 52.3 secs Computing kpt #: 71 total cpu time spent up to now is 53.1 secs Computing kpt #: 72 total cpu time spent up to now is 53.8 secs Computing kpt #: 73 total cpu time spent up to now is 54.6 secs Computing kpt #: 74 total cpu time spent up to now is 55.3 secs Computing kpt #: 75 total cpu time spent up to now is 56.0 secs Computing kpt #: 76 total cpu time spent up to now is 56.8 secs Computing kpt #: 77 total cpu time spent up to now is 57.5 secs Computing kpt #: 78 total cpu time spent up to now is 58.2 secs Computing kpt #: 79 total cpu time spent up to now is 59.0 secs Computing kpt #: 80 total cpu time spent up to now is 60.0 secs Computing kpt #: 81 total cpu time spent up to now is 60.8 secs Computing kpt #: 82 total cpu time spent up to now is 61.5 secs Computing kpt #: 83 total cpu time spent up to now is 62.2 secs Computing kpt #: 84 total cpu time spent up to now is 63.0 secs Computing kpt #: 85 total cpu time spent up to now is 63.7 secs Computing kpt #: 86 total cpu time spent up to now is 64.5 secs Computing kpt #: 87 total cpu time spent up to now is 65.2 secs Computing kpt #: 88 total cpu time spent up to now is 65.9 secs Computing kpt #: 89 total cpu time spent up to now is 66.7 secs Computing kpt #: 90 total cpu time spent up to now is 67.4 secs Computing kpt #: 91 total cpu time spent up to now is 68.2 secs Computing kpt #: 92 total cpu time spent up to now is 68.9 secs Computing kpt #: 93 total cpu time spent up to now is 69.7 secs Computing kpt #: 94 total cpu time spent up to now is 70.4 secs Computing kpt #: 95 total cpu time spent up to now is 71.2 secs Computing kpt #: 96 total cpu time spent up to now is 71.9 secs Computing kpt #: 97 total cpu time spent up to now is 72.7 secs Computing kpt #: 98 total cpu time spent up to now is 73.5 secs Computing kpt #: 99 total cpu time spent up to now is 74.2 secs Computing kpt #: 100 total cpu time spent up to now is 75.0 secs Computing kpt #: 101 total cpu time spent up to now is 75.7 secs Computing kpt #: 102 total cpu time spent up to now is 76.5 secs Computing kpt #: 103 total cpu time spent up to now is 77.2 secs Computing kpt #: 104 total cpu time spent up to now is 78.0 secs Computing kpt #: 105 total cpu time spent up to now is 78.7 secs Computing kpt #: 106 total cpu time spent up to now is 79.5 secs Computing kpt #: 107 total cpu time spent up to now is 80.2 secs Computing kpt #: 108 total cpu time spent up to now is 81.0 secs Computing kpt #: 109 total cpu time spent up to now is 81.8 secs Computing kpt #: 110 total cpu time spent up to now is 82.5 secs Computing kpt #: 111 total cpu time spent up to now is 83.2 secs Computing kpt #: 112 total cpu time spent up to now is 84.0 secs Computing kpt #: 113 total cpu time spent up to now is 84.7 secs Computing kpt #: 114 total cpu time spent up to now is 85.5 secs Computing kpt #: 115 total cpu time spent up to now is 86.2 secs Computing kpt #: 116 total cpu time spent up to now is 87.0 secs Computing kpt #: 117 total cpu time spent up to now is 87.7 secs Computing kpt #: 118 total cpu time spent up to now is 88.4 secs Computing kpt #: 119 total cpu time spent up to now is 89.1 secs Computing kpt #: 120 total cpu time spent up to now is 89.8 secs Computing kpt #: 121 total cpu time spent up to now is 90.5 secs Computing kpt #: 122 total cpu time spent up to now is 91.2 secs Computing kpt #: 123 total cpu time spent up to now is 92.0 secs Computing kpt #: 124 total cpu time spent up to now is 92.7 secs Computing kpt #: 125 total cpu time spent up to now is 93.4 secs Computing kpt #: 126 total cpu time spent up to now is 94.1 secs Computing kpt #: 127 total cpu time spent up to now is 94.9 secs Computing kpt #: 128 total cpu time spent up to now is 95.6 secs Computing kpt #: 129 total cpu time spent up to now is 96.4 secs Computing kpt #: 130 total cpu time spent up to now is 97.1 secs Computing kpt #: 131 total cpu time spent up to now is 97.8 secs Computing kpt #: 132 total cpu time spent up to now is 98.5 secs Computing kpt #: 133 total cpu time spent up to now is 99.3 secs Computing kpt #: 134 total cpu time spent up to now is 100.0 secs Computing kpt #: 135 total cpu time spent up to now is 100.7 secs Computing kpt #: 136 total cpu time spent up to now is 101.5 secs Computing kpt #: 137 total cpu time spent up to now is 102.2 secs Computing kpt #: 138 total cpu time spent up to now is 102.9 secs Computing kpt #: 139 total cpu time spent up to now is 103.7 secs Computing kpt #: 140 total cpu time spent up to now is 104.4 secs Computing kpt #: 141 total cpu time spent up to now is 105.1 secs Computing kpt #: 142 total cpu time spent up to now is 105.8 secs Computing kpt #: 143 total cpu time spent up to now is 106.6 secs Computing kpt #: 144 total cpu time spent up to now is 107.3 secs Computing kpt #: 145 total cpu time spent up to now is 108.1 secs Computing kpt #: 146 total cpu time spent up to now is 108.8 secs Computing kpt #: 147 total cpu time spent up to now is 109.5 secs Computing kpt #: 148 total cpu time spent up to now is 110.3 secs Computing kpt #: 149 total cpu time spent up to now is 111.0 secs Computing kpt #: 150 total cpu time spent up to now is 111.8 secs Computing kpt #: 151 total cpu time spent up to now is 112.5 secs Computing kpt #: 152 total cpu time spent up to now is 113.3 secs Computing kpt #: 153 total cpu time spent up to now is 114.1 secs Computing kpt #: 154 total cpu time spent up to now is 114.8 secs Computing kpt #: 155 total cpu time spent up to now is 115.5 secs Computing kpt #: 156 total cpu time spent up to now is 116.3 secs Computing kpt #: 157 total cpu time spent up to now is 117.1 secs Computing kpt #: 158 total cpu time spent up to now is 117.8 secs Computing kpt #: 159 total cpu time spent up to now is 118.4 secs Computing kpt #: 160 total cpu time spent up to now is 119.1 secs Computing kpt #: 161 total cpu time spent up to now is 119.8 secs Computing kpt #: 162 total cpu time spent up to now is 120.4 secs Computing kpt #: 163 total cpu time spent up to now is 121.1 secs Computing kpt #: 164 total cpu time spent up to now is 121.7 secs Computing kpt #: 165 total cpu time spent up to now is 122.3 secs Computing kpt #: 166 total cpu time spent up to now is 122.9 secs Computing kpt #: 167 total cpu time spent up to now is 123.6 secs Computing kpt #: 168 total cpu time spent up to now is 124.4 secs Computing kpt #: 169 total cpu time spent up to now is 125.0 secs Computing kpt #: 170 total cpu time spent up to now is 125.6 secs Computing kpt #: 171 total cpu time spent up to now is 126.2 secs Computing kpt #: 172 total cpu time spent up to now is 126.8 secs Computing kpt #: 173 total cpu time spent up to now is 127.4 secs Computing kpt #: 174 total cpu time spent up to now is 128.0 secs Computing kpt #: 175 total cpu time spent up to now is 128.6 secs Computing kpt #: 176 total cpu time spent up to now is 129.2 secs Computing kpt #: 177 total cpu time spent up to now is 129.8 secs Computing kpt #: 178 total cpu time spent up to now is 130.4 secs Computing kpt #: 179 total cpu time spent up to now is 131.0 secs Computing kpt #: 180 total cpu time spent up to now is 131.6 secs Computing kpt #: 181 total cpu time spent up to now is 132.2 secs Computing kpt #: 182 total cpu time spent up to now is 132.8 secs Computing kpt #: 183 total cpu time spent up to now is 133.4 secs Computing kpt #: 184 total cpu time spent up to now is 134.0 secs Computing kpt #: 185 total cpu time spent up to now is 134.6 secs Computing kpt #: 186 total cpu time spent up to now is 135.2 secs Computing kpt #: 187 total cpu time spent up to now is 135.8 secs Computing kpt #: 188 total cpu time spent up to now is 136.4 secs Computing kpt #: 189 total cpu time spent up to now is 137.0 secs Computing kpt #: 190 total cpu time spent up to now is 137.6 secs Computing kpt #: 191 total cpu time spent up to now is 138.2 secs Computing kpt #: 192 total cpu time spent up to now is 138.8 secs Computing kpt #: 193 total cpu time spent up to now is 139.4 secs Computing kpt #: 194 total cpu time spent up to now is 140.0 secs Computing kpt #: 195 total cpu time spent up to now is 140.6 secs Computing kpt #: 196 total cpu time spent up to now is 141.2 secs Computing kpt #: 197 total cpu time spent up to now is 141.8 secs Computing kpt #: 198 total cpu time spent up to now is 142.5 secs Computing kpt #: 199 total cpu time spent up to now is 143.1 secs Computing kpt #: 200 total cpu time spent up to now is 143.6 secs Computing kpt #: 201 total cpu time spent up to now is 144.3 secs Computing kpt #: 202 total cpu time spent up to now is 145.0 secs Computing kpt #: 203 total cpu time spent up to now is 145.7 secs Computing kpt #: 204 total cpu time spent up to now is 146.4 secs Computing kpt #: 205 total cpu time spent up to now is 147.1 secs Computing kpt #: 206 total cpu time spent up to now is 147.7 secs Computing kpt #: 207 total cpu time spent up to now is 148.4 secs Computing kpt #: 208 total cpu time spent up to now is 149.1 secs Computing kpt #: 209 total cpu time spent up to now is 149.8 secs Computing kpt #: 210 total cpu time spent up to now is 150.5 secs Computing kpt #: 211 total cpu time spent up to now is 151.1 secs Computing kpt #: 212 total cpu time spent up to now is 151.9 secs Computing kpt #: 213 total cpu time spent up to now is 152.5 secs Computing kpt #: 214 total cpu time spent up to now is 153.2 secs Computing kpt #: 215 total cpu time spent up to now is 153.9 secs Computing kpt #: 216 total cpu time spent up to now is 154.7 secs Computing kpt #: 217 total cpu time spent up to now is 155.3 secs Computing kpt #: 218 total cpu time spent up to now is 156.1 secs Computing kpt #: 219 total cpu time spent up to now is 156.7 secs Computing kpt #: 220 total cpu time spent up to now is 157.5 secs Computing kpt #: 221 total cpu time spent up to now is 158.1 secs Computing kpt #: 222 total cpu time spent up to now is 158.9 secs Computing kpt #: 223 total cpu time spent up to now is 159.5 secs Computing kpt #: 224 total cpu time spent up to now is 160.2 secs Computing kpt #: 225 total cpu time spent up to now is 161.0 secs Computing kpt #: 226 total cpu time spent up to now is 161.7 secs Computing kpt #: 227 total cpu time spent up to now is 162.4 secs Computing kpt #: 228 total cpu time spent up to now is 163.2 secs Computing kpt #: 229 total cpu time spent up to now is 163.9 secs Computing kpt #: 230 total cpu time spent up to now is 164.7 secs Computing kpt #: 231 total cpu time spent up to now is 165.5 secs Computing kpt #: 232 total cpu time spent up to now is 166.3 secs Computing kpt #: 233 total cpu time spent up to now is 167.0 secs Computing kpt #: 234 total cpu time spent up to now is 167.7 secs Computing kpt #: 235 total cpu time spent up to now is 168.4 secs Computing kpt #: 236 total cpu time spent up to now is 169.1 secs Computing kpt #: 237 total cpu time spent up to now is 169.9 secs Computing kpt #: 238 total cpu time spent up to now is 170.6 secs Computing kpt #: 239 total cpu time spent up to now is 171.3 secs Computing kpt #: 240 total cpu time spent up to now is 171.9 secs Computing kpt #: 241 total cpu time spent up to now is 172.7 secs Computing kpt #: 242 total cpu time spent up to now is 173.3 secs Computing kpt #: 243 total cpu time spent up to now is 174.0 secs Computing kpt #: 244 total cpu time spent up to now is 174.7 secs Computing kpt #: 245 total cpu time spent up to now is 175.4 secs Computing kpt #: 246 total cpu time spent up to now is 176.1 secs Computing kpt #: 247 total cpu time spent up to now is 176.8 secs Computing kpt #: 248 total cpu time spent up to now is 177.5 secs Computing kpt #: 249 total cpu time spent up to now is 178.1 secs Computing kpt #: 250 total cpu time spent up to now is 178.8 secs Computing kpt #: 251 total cpu time spent up to now is 179.5 secs Computing kpt #: 252 total cpu time spent up to now is 180.3 secs Computing kpt #: 253 total cpu time spent up to now is 180.9 secs Computing kpt #: 254 total cpu time spent up to now is 181.7 secs Computing kpt #: 255 total cpu time spent up to now is 182.3 secs Computing kpt #: 256 total cpu time spent up to now is 183.1 secs Computing kpt #: 257 total cpu time spent up to now is 183.8 secs Computing kpt #: 258 total cpu time spent up to now is 184.5 secs Computing kpt #: 259 total cpu time spent up to now is 185.2 secs Computing kpt #: 260 total cpu time spent up to now is 185.9 secs Computing kpt #: 261 total cpu time spent up to now is 186.6 secs Computing kpt #: 262 total cpu time spent up to now is 187.4 secs Computing kpt #: 263 total cpu time spent up to now is 188.1 secs Computing kpt #: 264 total cpu time spent up to now is 188.8 secs Computing kpt #: 265 total cpu time spent up to now is 189.6 secs Computing kpt #: 266 total cpu time spent up to now is 190.3 secs Computing kpt #: 267 total cpu time spent up to now is 191.1 secs Computing kpt #: 268 total cpu time spent up to now is 191.8 secs Computing kpt #: 269 total cpu time spent up to now is 192.5 secs Computing kpt #: 270 total cpu time spent up to now is 193.2 secs Computing kpt #: 271 total cpu time spent up to now is 193.9 secs Computing kpt #: 272 total cpu time spent up to now is 194.7 secs Computing kpt #: 273 total cpu time spent up to now is 195.4 secs Computing kpt #: 274 total cpu time spent up to now is 196.2 secs Computing kpt #: 275 total cpu time spent up to now is 196.9 secs Computing kpt #: 276 total cpu time spent up to now is 197.6 secs Computing kpt #: 277 total cpu time spent up to now is 198.3 secs Computing kpt #: 278 total cpu time spent up to now is 199.1 secs Computing kpt #: 279 total cpu time spent up to now is 199.7 secs Computing kpt #: 280 total cpu time spent up to now is 200.5 secs Computing kpt #: 281 total cpu time spent up to now is 201.1 secs Computing kpt #: 282 total cpu time spent up to now is 201.7 secs Computing kpt #: 283 total cpu time spent up to now is 202.5 secs Computing kpt #: 284 total cpu time spent up to now is 203.2 secs Computing kpt #: 285 total cpu time spent up to now is 203.9 secs Computing kpt #: 286 total cpu time spent up to now is 204.6 secs Computing kpt #: 287 total cpu time spent up to now is 205.3 secs Computing kpt #: 288 total cpu time spent up to now is 206.1 secs Computing kpt #: 289 total cpu time spent up to now is 206.7 secs Computing kpt #: 290 total cpu time spent up to now is 207.4 secs Computing kpt #: 291 total cpu time spent up to now is 208.1 secs Computing kpt #: 292 total cpu time spent up to now is 208.9 secs Computing kpt #: 293 total cpu time spent up to now is 209.6 secs Computing kpt #: 294 total cpu time spent up to now is 210.3 secs Computing kpt #: 295 total cpu time spent up to now is 211.0 secs Computing kpt #: 296 total cpu time spent up to now is 211.8 secs Computing kpt #: 297 total cpu time spent up to now is 212.5 secs Computing kpt #: 298 total cpu time spent up to now is 213.2 secs Computing kpt #: 299 total cpu time spent up to now is 214.0 secs Computing kpt #: 300 total cpu time spent up to now is 214.7 secs Computing kpt #: 301 total cpu time spent up to now is 215.5 secs Computing kpt #: 302 total cpu time spent up to now is 216.2 secs Computing kpt #: 303 total cpu time spent up to now is 216.9 secs Computing kpt #: 304 total cpu time spent up to now is 217.6 secs Computing kpt #: 305 total cpu time spent up to now is 218.3 secs Computing kpt #: 306 total cpu time spent up to now is 219.0 secs Computing kpt #: 307 total cpu time spent up to now is 219.7 secs Computing kpt #: 308 total cpu time spent up to now is 220.5 secs Computing kpt #: 309 total cpu time spent up to now is 221.2 secs Computing kpt #: 310 total cpu time spent up to now is 221.9 secs Computing kpt #: 311 total cpu time spent up to now is 222.7 secs Computing kpt #: 312 total cpu time spent up to now is 223.4 secs Computing kpt #: 313 total cpu time spent up to now is 224.1 secs Computing kpt #: 314 total cpu time spent up to now is 224.9 secs Computing kpt #: 315 total cpu time spent up to now is 225.7 secs Computing kpt #: 316 total cpu time spent up to now is 226.3 secs Computing kpt #: 317 total cpu time spent up to now is 227.0 secs Computing kpt #: 318 total cpu time spent up to now is 227.7 secs Computing kpt #: 319 total cpu time spent up to now is 228.5 secs Computing kpt #: 320 total cpu time spent up to now is 229.2 secs Computing kpt #: 321 total cpu time spent up to now is 229.9 secs Computing kpt #: 322 total cpu time spent up to now is 230.6 secs Computing kpt #: 323 total cpu time spent up to now is 231.3 secs Computing kpt #: 324 total cpu time spent up to now is 232.1 secs Computing kpt #: 325 total cpu time spent up to now is 232.8 secs Computing kpt #: 326 total cpu time spent up to now is 233.5 secs Computing kpt #: 327 total cpu time spent up to now is 234.3 secs Computing kpt #: 328 total cpu time spent up to now is 234.9 secs Computing kpt #: 329 total cpu time spent up to now is 235.7 secs Computing kpt #: 330 total cpu time spent up to now is 236.4 secs Computing kpt #: 331 total cpu time spent up to now is 237.1 secs Computing kpt #: 332 total cpu time spent up to now is 237.8 secs Computing kpt #: 333 total cpu time spent up to now is 238.5 secs Computing kpt #: 334 total cpu time spent up to now is 239.1 secs Computing kpt #: 335 total cpu time spent up to now is 239.7 secs Computing kpt #: 336 total cpu time spent up to now is 240.3 secs Computing kpt #: 337 total cpu time spent up to now is 240.9 secs Computing kpt #: 338 total cpu time spent up to now is 241.5 secs Computing kpt #: 339 total cpu time spent up to now is 242.1 secs Computing kpt #: 340 total cpu time spent up to now is 242.8 secs Computing kpt #: 341 total cpu time spent up to now is 243.4 secs Computing kpt #: 342 total cpu time spent up to now is 244.0 secs Computing kpt #: 343 total cpu time spent up to now is 244.6 secs Computing kpt #: 344 total cpu time spent up to now is 245.3 secs Computing kpt #: 345 total cpu time spent up to now is 245.8 secs Computing kpt #: 346 total cpu time spent up to now is 246.4 secs Computing kpt #: 347 total cpu time spent up to now is 247.1 secs Computing kpt #: 348 total cpu time spent up to now is 247.6 secs Computing kpt #: 349 total cpu time spent up to now is 248.2 secs Computing kpt #: 350 total cpu time spent up to now is 248.8 secs Computing kpt #: 351 total cpu time spent up to now is 249.4 secs Computing kpt #: 352 total cpu time spent up to now is 250.0 secs Computing kpt #: 353 total cpu time spent up to now is 250.6 secs Computing kpt #: 354 total cpu time spent up to now is 251.2 secs Computing kpt #: 355 total cpu time spent up to now is 251.8 secs Computing kpt #: 356 total cpu time spent up to now is 252.4 secs Computing kpt #: 357 total cpu time spent up to now is 253.0 secs Computing kpt #: 358 total cpu time spent up to now is 253.6 secs Computing kpt #: 359 total cpu time spent up to now is 254.2 secs Computing kpt #: 360 total cpu time spent up to now is 254.8 secs Computing kpt #: 361 total cpu time spent up to now is 255.4 secs Computing kpt #: 362 total cpu time spent up to now is 256.0 secs Computing kpt #: 363 total cpu time spent up to now is 256.6 secs Computing kpt #: 364 total cpu time spent up to now is 257.2 secs Computing kpt #: 365 total cpu time spent up to now is 257.8 secs Computing kpt #: 366 total cpu time spent up to now is 258.4 secs Computing kpt #: 367 total cpu time spent up to now is 259.0 secs Computing kpt #: 368 total cpu time spent up to now is 259.6 secs Computing kpt #: 369 total cpu time spent up to now is 260.1 secs Computing kpt #: 370 total cpu time spent up to now is 260.7 secs Computing kpt #: 371 total cpu time spent up to now is 261.3 secs Computing kpt #: 372 total cpu time spent up to now is 261.9 secs Computing kpt #: 373 total cpu time spent up to now is 262.4 secs Computing kpt #: 374 total cpu time spent up to now is 263.0 secs Computing kpt #: 375 total cpu time spent up to now is 263.6 secs Computing kpt #: 376 total cpu time spent up to now is 264.2 secs Computing kpt #: 377 total cpu time spent up to now is 264.7 secs Computing kpt #: 378 total cpu time spent up to now is 265.3 secs Computing kpt #: 379 total cpu time spent up to now is 265.9 secs Computing kpt #: 380 total cpu time spent up to now is 266.4 secs Computing kpt #: 381 total cpu time spent up to now is 267.0 secs Computing kpt #: 382 total cpu time spent up to now is 267.6 secs Computing kpt #: 383 total cpu time spent up to now is 268.2 secs Computing kpt #: 384 total cpu time spent up to now is 268.8 secs Computing kpt #: 385 total cpu time spent up to now is 269.4 secs Computing kpt #: 386 total cpu time spent up to now is 270.0 secs Computing kpt #: 387 total cpu time spent up to now is 270.6 secs Computing kpt #: 388 total cpu time spent up to now is 271.1 secs Computing kpt #: 389 total cpu time spent up to now is 271.8 secs Computing kpt #: 390 total cpu time spent up to now is 272.4 secs Computing kpt #: 391 total cpu time spent up to now is 273.0 secs Computing kpt #: 392 total cpu time spent up to now is 273.6 secs Computing kpt #: 393 total cpu time spent up to now is 274.2 secs Computing kpt #: 394 total cpu time spent up to now is 274.8 secs Computing kpt #: 395 total cpu time spent up to now is 275.4 secs Computing kpt #: 396 total cpu time spent up to now is 276.0 secs Computing kpt #: 397 total cpu time spent up to now is 276.6 secs Computing kpt #: 398 total cpu time spent up to now is 277.2 secs Computing kpt #: 399 total cpu time spent up to now is 277.9 secs Computing kpt #: 400 total cpu time spent up to now is 278.5 secs Computing kpt #: 401 total cpu time spent up to now is 279.1 secs Computing kpt #: 402 total cpu time spent up to now is 279.7 secs Computing kpt #: 403 total cpu time spent up to now is 280.3 secs Computing kpt #: 404 total cpu time spent up to now is 281.0 secs Computing kpt #: 405 total cpu time spent up to now is 281.7 secs Computing kpt #: 406 total cpu time spent up to now is 282.3 secs Computing kpt #: 407 total cpu time spent up to now is 283.1 secs Computing kpt #: 408 total cpu time spent up to now is 283.7 secs Computing kpt #: 409 total cpu time spent up to now is 284.5 secs Computing kpt #: 410 total cpu time spent up to now is 285.0 secs Computing kpt #: 411 total cpu time spent up to now is 285.6 secs Computing kpt #: 412 total cpu time spent up to now is 286.3 secs Computing kpt #: 413 total cpu time spent up to now is 286.8 secs Computing kpt #: 414 total cpu time spent up to now is 287.4 secs Computing kpt #: 415 total cpu time spent up to now is 288.0 secs Computing kpt #: 416 total cpu time spent up to now is 288.6 secs Computing kpt #: 417 total cpu time spent up to now is 289.2 secs Computing kpt #: 418 total cpu time spent up to now is 289.8 secs Computing kpt #: 419 total cpu time spent up to now is 290.4 secs Computing kpt #: 420 total cpu time spent up to now is 291.0 secs Computing kpt #: 421 total cpu time spent up to now is 291.6 secs Computing kpt #: 422 total cpu time spent up to now is 292.2 secs Computing kpt #: 423 total cpu time spent up to now is 292.8 secs Computing kpt #: 424 total cpu time spent up to now is 293.4 secs Computing kpt #: 425 total cpu time spent up to now is 294.0 secs Computing kpt #: 426 total cpu time spent up to now is 294.6 secs Computing kpt #: 427 total cpu time spent up to now is 295.2 secs Computing kpt #: 428 total cpu time spent up to now is 295.8 secs Computing kpt #: 429 total cpu time spent up to now is 296.4 secs Computing kpt #: 430 total cpu time spent up to now is 297.0 secs Computing kpt #: 431 total cpu time spent up to now is 297.6 secs Computing kpt #: 432 total cpu time spent up to now is 298.2 secs Computing kpt #: 433 total cpu time spent up to now is 298.8 secs Computing kpt #: 434 total cpu time spent up to now is 299.4 secs Computing kpt #: 435 total cpu time spent up to now is 300.0 secs Computing kpt #: 436 total cpu time spent up to now is 300.6 secs Computing kpt #: 437 total cpu time spent up to now is 301.1 secs Computing kpt #: 438 total cpu time spent up to now is 301.8 secs Computing kpt #: 439 total cpu time spent up to now is 302.3 secs Computing kpt #: 440 total cpu time spent up to now is 302.9 secs ethr = 2.00E-08, avg # of iterations = 20.9 total cpu time spent up to now is 302.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3011 PWs) bands (ev): -14.8993 -14.8993 -14.1068 -14.1068 -13.6101 -13.6101 -13.5084 -13.5084 -3.1678 -3.1678 -3.0095 -3.0095 -2.0276 -2.0276 0.0084 0.0084 0.5912 0.5912 0.6842 0.6842 0.7019 0.7019 1.7872 1.7872 2.3065 2.3065 2.5563 2.5563 2.5716 2.5716 2.6824 2.6824 3.2767 3.2767 3.3200 3.3200 3.7667 3.7667 3.7883 3.7883 4.0028 4.0028 4.1210 4.1210 4.3481 4.3481 4.7231 4.7231 6.0515 6.0515 6.1306 6.1306 7.4103 7.4103 11.1926 11.1926 13.0041 13.0041 13.3064 13.3064 k = 0.0046 0.0167-0.0000 ( 3021 PWs) bands (ev): -14.8988 -14.8988 -14.1065 -14.1065 -13.6100 -13.6100 -13.5083 -13.5083 -3.1672 -3.1671 -3.0088 -3.0088 -2.0273 -2.0272 0.0073 0.0078 0.5908 0.5915 0.6832 0.6850 0.7014 0.7030 1.7878 1.7878 2.3056 2.3059 2.5514 2.5529 2.5643 2.5760 2.6746 2.6818 3.2787 3.2794 3.3206 3.3224 3.7620 3.7692 3.7863 3.7923 4.0023 4.0029 4.1185 4.1236 4.3475 4.3486 4.7210 4.7250 6.0498 6.0508 6.1293 6.1296 7.4140 7.4143 11.1946 11.1950 13.0054 13.0055 13.3060 13.3064 k = 0.0093 0.0334-0.0000 ( 3025 PWs) bands (ev): -14.8975 -14.8974 -14.1056 -14.1055 -13.6097 -13.6097 -13.5080 -13.5080 -3.1653 -3.1652 -3.0066 -3.0066 -2.0263 -2.0261 0.0047 0.0056 0.5904 0.5917 0.6821 0.6856 0.7017 0.7048 1.7897 1.7897 2.3031 2.3037 2.5383 2.5409 2.5541 2.5772 2.6593 2.6736 3.2850 3.2865 3.3246 3.3279 3.7556 3.7703 3.7862 3.7976 4.0017 4.0028 4.1162 4.1263 4.3468 4.3491 4.7185 4.7267 6.0456 6.0475 6.1257 6.1264 7.4254 7.4260 11.2009 11.2017 13.0095 13.0096 13.3052 13.3060 k = 0.0139 0.0501-0.0000 ( 3025 PWs) bands (ev): -14.8952 -14.8952 -14.1040 -14.1040 -13.6093 -13.6093 -13.5075 -13.5074 -3.1622 -3.1620 -3.0029 -3.0028 -2.0246 -2.0244 0.0006 0.0019 0.5899 0.5919 0.6812 0.6860 0.7030 0.7072 1.7928 1.7928 2.2987 2.2997 2.5178 2.5209 2.5405 2.5740 2.6383 2.6589 3.2953 3.2974 3.3316 3.3359 3.7481 3.7709 3.7872 3.8033 4.0008 4.0024 4.1142 4.1289 4.3461 4.3495 4.7159 4.7282 6.0389 6.0418 6.1200 6.1210 7.4444 7.4453 11.2114 11.2127 13.0163 13.0165 13.3041 13.3052 k = 0.0186 0.0668-0.0000 ( 3025 PWs) bands (ev): -14.8920 -14.8920 -14.1019 -14.1018 -13.6087 -13.6086 -13.5067 -13.5066 -3.1578 -3.1576 -2.9977 -2.9977 -2.0222 -2.0220 -0.0051 -0.0034 0.5895 0.5921 0.6803 0.6859 0.7052 0.7101 1.7970 1.7971 2.2918 2.2931 2.4910 2.4947 2.5217 2.5616 2.6173 2.6399 3.3087 3.3115 3.3410 3.3458 3.7400 3.7714 3.7891 3.8089 3.9997 4.0017 4.1124 4.1315 4.3452 4.3499 4.7130 4.7294 6.0299 6.0338 6.1122 6.1136 7.4707 7.4719 11.2262 11.2279 13.0256 13.0259 13.3025 13.3040 k = 0.0232 0.0835-0.0000 ( 3025 PWs) bands (ev): -14.8880 -14.8879 -14.0991 -14.0990 -13.6078 -13.6078 -13.5058 -13.5057 -3.1522 -3.1520 -2.9911 -2.9911 -2.0192 -2.0188 -0.0123 -0.0102 0.5890 0.5921 0.6793 0.6856 0.7084 0.7138 1.8024 1.8025 2.2812 2.2829 2.4601 2.4644 2.4959 2.5336 2.6034 2.6192 3.3245 3.3279 3.3525 3.3570 3.7318 3.7721 3.7914 3.8141 3.9984 4.0007 4.1109 4.1339 4.3442 4.3504 4.7099 4.7304 6.0188 6.0236 6.1025 6.1042 7.5041 7.5055 11.2450 11.2472 13.0373 13.0377 13.3004 13.3023 k = 0.0279 0.1002-0.0000 ( 3033 PWs) bands (ev): -14.8831 -14.8830 -14.0957 -14.0956 -13.6069 -13.6069 -13.5046 -13.5045 -3.1455 -3.1451 -2.9831 -2.9830 -2.0155 -2.0151 -0.0208 -0.0184 0.5884 0.5920 0.6784 0.6850 0.7125 0.7181 1.8088 1.8090 2.2651 2.2672 2.4275 2.4326 2.4614 2.4922 2.5956 2.5992 3.3419 3.3458 3.3654 3.3689 3.7237 3.7731 3.7940 3.8187 3.9968 3.9994 4.1096 4.1359 4.3430 4.3508 4.7066 4.7313 6.0055 6.0112 6.0908 6.0928 7.5442 7.5458 11.2677 11.2703 13.0513 13.0517 13.2977 13.2999 k = 0.0325 0.1168-0.0000 ( 3017 PWs) bands (ev): -14.8772 -14.8771 -14.0917 -14.0916 -13.6057 -13.6057 -13.5033 -13.5031 -3.1375 -3.1371 -2.9736 -2.9735 -2.0111 -2.0106 -0.0307 -0.0280 0.5879 0.5919 0.6775 0.6843 0.7174 0.7231 1.8162 1.8164 2.2411 2.2433 2.3960 2.4021 2.4187 2.4431 2.5811 2.5895 3.3603 3.3644 3.3795 3.3814 3.7159 3.7746 3.7970 3.8228 3.9952 3.9980 4.1086 4.1376 4.3418 4.3514 4.7032 4.7320 5.9904 5.9972 6.0775 6.0799 7.5906 7.5925 11.2942 11.2972 13.0674 13.0679 13.2944 13.2970 k = 0.0372 0.1335-0.0000 ( 3017 PWs) bands (ev): -14.8706 -14.8705 -14.0872 -14.0870 -13.6044 -13.6044 -13.5017 -13.5015 -3.1283 -3.1279 -2.9628 -2.9626 -2.0061 -2.0055 -0.0418 -0.0389 0.5873 0.5915 0.6767 0.6836 0.7231 0.7288 1.8243 1.8246 2.2071 2.2091 2.3638 2.3645 2.3798 2.3933 2.5644 2.5834 3.3790 3.3830 3.3939 3.3945 3.7085 3.7766 3.8002 3.8262 3.9932 3.9962 4.1075 4.1388 4.3404 4.3520 4.6996 4.7326 5.9737 5.9813 6.0627 6.0653 7.6430 7.6451 11.3241 11.3275 13.0852 13.0858 13.2904 13.2934 k = 0.0418 0.1502-0.0000 ( 3016 PWs) bands (ev): -14.8631 -14.8629 -14.0821 -14.0819 -13.6029 -13.6029 -13.4999 -13.4997 -3.1180 -3.1175 -2.9505 -2.9503 -2.0004 -1.9998 -0.0542 -0.0510 0.5865 0.5910 0.6760 0.6829 0.7295 0.7352 1.8330 1.8334 2.1631 2.1645 2.3080 2.3143 2.3585 2.3614 2.5488 2.5766 3.3976 3.4010 3.4064 3.4104 3.7016 3.7789 3.8034 3.8292 3.9910 3.9941 4.1065 4.1395 4.3388 4.3527 4.6960 4.7331 5.9554 5.9641 6.0465 6.0495 7.7009 7.7031 11.3573 11.3611 13.1046 13.1052 13.2856 13.2890 k = 0.0464 0.1669-0.0000 ( 3004 PWs) bands (ev): -14.8547 -14.8546 -14.0764 -14.0762 -13.6013 -13.6013 -13.4980 -13.4977 -3.1065 -3.1060 -2.9369 -2.9367 -1.9941 -1.9934 -0.0676 -0.0643 0.5856 0.5903 0.6755 0.6824 0.7366 0.7422 1.8422 1.8426 2.1107 2.1114 2.2455 2.2510 2.3421 2.3434 2.5336 2.5690 3.4158 3.4178 3.4188 3.4271 3.6955 3.7817 3.8069 3.8316 3.9885 3.9919 4.1053 4.1395 4.3372 4.3535 4.6923 4.7336 5.9360 5.9456 6.0293 6.0326 7.7638 7.7662 11.3935 11.3977 13.1252 13.1259 13.2800 13.2838 k = 0.0511 0.1836-0.0000 ( 3002 PWs) bands (ev): -14.8456 -14.8454 -14.0702 -14.0700 -13.5995 -13.5995 -13.4959 -13.4956 -3.0940 -3.0934 -2.9219 -2.9217 -1.9872 -1.9865 -0.0821 -0.0786 0.5846 0.5894 0.6751 0.6821 0.7443 0.7499 1.8514 1.8515 2.0520 2.0521 2.1790 2.1828 2.3282 2.3294 2.5185 2.5604 3.4299 3.4336 3.4342 3.4443 3.6899 3.7849 3.8103 3.8335 3.9857 3.9894 4.1039 4.1388 4.3354 4.3544 4.6886 4.7341 5.9157 5.9262 6.0111 6.0147 7.8313 7.8338 11.4323 11.4370 13.1468 13.1474 13.2735 13.2776 k = 0.0557 0.2003-0.0000 ( 3002 PWs) bands (ev): -14.8357 -14.8355 -14.0635 -14.0633 -13.5976 -13.5976 -13.4936 -13.4933 -3.0805 -3.0798 -2.9057 -2.9055 -1.9797 -1.9789 -0.0976 -0.0940 0.5833 0.5881 0.6751 0.6821 0.7526 0.7583 1.8594 1.8600 1.9881 1.9890 2.1101 2.1121 2.3153 2.3170 2.5033 2.5508 3.4414 3.4486 3.4512 3.4612 3.6851 3.7885 3.8137 3.8350 3.9825 3.9867 4.1021 4.1373 4.3336 4.3555 4.6849 4.7345 5.8946 5.9060 5.9922 5.9961 7.9030 7.9056 11.4735 11.4786 13.1689 13.1696 13.2661 13.2705 k = 0.0604 0.2170-0.0000 ( 3004 PWs) bands (ev): -14.8250 -14.8248 -14.0563 -14.0561 -13.5955 -13.5955 -13.4912 -13.4908 -3.0659 -3.0652 -2.8882 -2.8880 -1.9716 -1.9708 -0.1139 -0.1103 0.5818 0.5865 0.6754 0.6824 0.7614 0.7672 1.8626 1.8658 1.9210 1.9241 2.0413 2.0415 2.3027 2.3049 2.4877 2.5401 3.4524 3.4630 3.4674 3.4776 3.6811 3.7924 3.8172 3.8360 3.9790 3.9838 4.0997 4.1350 4.3318 4.3566 4.6814 4.7350 5.8730 5.8853 5.9728 5.9769 7.9783 7.9811 11.5168 11.5223 13.1913 13.1919 13.2577 13.2624 k = 0.0650 0.2337-0.0000 ( 3000 PWs) bands (ev): -14.8136 -14.8134 -14.0486 -14.0484 -13.5934 -13.5933 -13.4886 -13.4882 -3.0504 -3.0497 -2.8694 -2.8692 -1.9630 -1.9621 -0.1311 -0.1273 0.5799 0.5845 0.6761 0.6831 0.7708 0.7767 1.8390 1.8468 1.8674 1.8730 1.9773 1.9810 2.2897 2.2925 2.4718 2.5284 3.4629 3.4768 3.4828 3.4934 3.6778 3.7967 3.8207 3.8367 3.9751 3.9809 4.0967 4.1319 4.3299 4.3579 4.6779 4.7356 5.8513 5.8644 5.9532 5.9576 8.0571 8.0599 11.5617 11.5676 13.2136 13.2139 13.2487 13.2533 k = 0.0697 0.2504-0.0000 ( 3010 PWs) bands (ev): -14.8014 -14.8012 -14.0405 -14.0403 -13.5911 -13.5910 -13.4859 -13.4855 -3.0339 -3.0332 -2.8495 -2.8493 -1.9538 -1.9529 -0.1490 -0.1452 0.5776 0.5820 0.6774 0.6844 0.7807 0.7866 1.7733 1.7763 1.8325 1.8342 1.9407 1.9483 2.2761 2.2796 2.4555 2.5157 3.4729 3.4900 3.4972 3.5083 3.6752 3.8011 3.8240 3.8371 3.9708 3.9778 4.0929 4.1278 4.3281 4.3593 4.6746 4.7363 5.8295 5.8435 5.9335 5.9380 8.1387 8.1416 11.6079 11.6142 13.2312 13.2348 13.2429 13.2439 k = 0.0743 0.2671-0.0000 ( 3010 PWs) bands (ev): -14.7886 -14.7884 -14.0320 -14.0317 -13.5887 -13.5886 -13.4831 -13.4827 -3.0166 -3.0158 -2.8285 -2.8283 -1.9442 -1.9432 -0.1675 -0.1637 0.5748 0.5791 0.6792 0.6862 0.7910 0.7971 1.7003 1.7022 1.7676 1.7698 1.9360 1.9442 2.2616 2.2658 2.4387 2.5021 3.4826 3.5025 3.5107 3.5228 3.6733 3.8055 3.8273 3.8372 3.9661 3.9749 4.0883 4.1230 4.3264 4.3609 4.6715 4.7371 5.8079 5.8227 5.9138 5.9185 8.2230 8.2259 11.6550 11.6618 13.2243 13.2310 13.2576 13.2596 k = 0.0789 0.2838-0.0000 ( 3016 PWs) bands (ev): -14.7752 -14.7750 -14.0231 -14.0228 -13.5862 -13.5861 -13.4801 -13.4797 -2.9985 -2.9976 -2.8063 -2.8061 -1.9340 -1.9330 -0.1867 -0.1829 0.5715 0.5755 0.6815 0.6886 0.8016 0.8079 1.6251 1.6266 1.6922 1.6937 1.9426 1.9509 2.2460 2.2510 2.4215 2.4875 3.4919 3.5143 3.5233 3.5368 3.6720 3.8099 3.8305 3.8370 3.9610 3.9720 4.0828 4.1174 4.3248 4.3626 4.6686 4.7379 5.7868 5.8023 5.8943 5.8991 8.3096 8.3125 11.7026 11.7099 13.2119 13.2187 13.2779 13.2797 k = 0.0836 0.3005-0.0000 ( 3018 PWs) bands (ev): -14.7612 -14.7609 -14.0138 -14.0135 -13.5835 -13.5835 -13.4771 -13.4767 -2.9796 -2.9787 -2.7831 -2.7830 -1.9234 -1.9224 -0.2064 -0.2026 0.5675 0.5713 0.6847 0.6917 0.8126 0.8190 1.5487 1.5500 1.6131 1.6140 1.9524 1.9610 2.2294 2.2351 2.4039 2.4721 3.5007 3.5252 3.5349 3.5504 3.6714 3.8139 3.8335 3.8367 3.9556 3.9693 4.0763 4.1110 4.3233 4.3646 4.6660 4.7389 5.7664 5.7826 5.8752 5.8802 8.3981 8.4010 11.7504 11.7581 13.1982 13.2051 13.2971 13.2988 k = 0.0882 0.3172-0.0000 ( 3014 PWs) bands (ev): -14.7465 -14.7463 -14.0041 -14.0038 -13.5808 -13.5808 -13.4740 -13.4735 -2.9600 -2.9590 -2.7590 -2.7588 -1.9124 -1.9113 -0.2266 -0.2228 0.5628 0.5662 0.6885 0.6955 0.8238 0.8304 1.4715 1.4728 1.5328 1.5332 1.9636 1.9725 2.2116 2.2181 2.3859 2.4559 3.5092 3.5352 3.5457 3.5637 3.6714 3.8175 3.8361 3.8363 3.9498 3.9671 4.0688 4.1039 4.3220 4.3667 4.6636 4.7400 5.7467 5.7636 5.8567 5.8617 8.4883 8.4912 11.7978 11.8060 13.1832 13.1904 13.3148 13.3166 k = 0.0929 0.3338-0.0000 ( 3018 PWs) bands (ev): -14.7314 -14.7311 -13.9942 -13.9939 -13.5781 -13.5781 -13.4708 -13.4703 -2.9397 -2.9388 -2.7339 -2.7337 -1.9009 -1.8998 -0.2473 -0.2434 0.5572 0.5602 0.6932 0.7001 0.8351 0.8420 1.3939 1.3952 1.4522 1.4523 1.9753 1.9847 2.1926 2.2000 2.3676 2.4390 3.5173 3.5442 3.5555 3.5768 3.6717 3.8205 3.8353 3.8388 3.9438 3.9655 4.0603 4.0962 4.3209 4.3690 4.6615 4.7411 5.7279 5.7453 5.8387 5.8438 8.5799 8.5829 11.8446 11.8531 13.1672 13.1745 13.3308 13.3327 k = 0.0975 0.3505-0.0000 ( 3022 PWs) bands (ev): -14.7157 -14.7154 -13.9840 -13.9837 -13.5752 -13.5752 -13.4676 -13.4671 -2.9189 -2.9179 -2.7080 -2.7078 -1.8891 -1.8880 -0.2684 -0.2646 0.5504 0.5530 0.6986 0.7054 0.8463 0.8535 1.3163 1.3177 1.3720 1.3725 1.9872 1.9971 2.1725 2.1808 2.3490 2.4215 3.5250 3.5522 3.5645 3.5897 3.6724 3.8226 3.8341 3.8410 3.9375 3.9646 4.0510 4.0879 4.3200 4.3715 4.6596 4.7423 5.7102 5.7281 5.8215 5.8265 8.6728 8.6758 11.8902 11.8992 13.1501 13.1576 13.3450 13.3469 k = 0.1022 0.3672-0.0000 ( 3026 PWs) bands (ev): -14.6996 -14.6993 -13.9736 -13.9733 -13.5723 -13.5723 -13.4643 -13.4638 -2.8976 -2.8966 -2.6813 -2.6812 -1.8769 -1.8758 -0.2899 -0.2861 0.5422 0.5444 0.7049 0.7116 0.8572 0.8647 1.2392 1.2407 1.2930 1.2940 1.9992 2.0095 2.1514 2.1605 2.3303 2.4033 3.5323 3.5594 3.5728 3.6023 3.6735 3.8239 3.8325 3.8427 3.9309 3.9645 4.0407 4.0791 4.3193 4.3743 4.6580 4.7435 5.6936 5.7119 5.8050 5.8099 8.7666 8.7696 11.9343 11.9437 13.1319 13.1397 13.3572 13.3592 k = 0.1068 0.3839-0.0000 ( 3022 PWs) bands (ev): -14.6831 -14.6828 -13.9630 -13.9626 -13.5694 -13.5694 -13.4610 -13.4604 -2.8758 -2.8748 -2.6539 -2.6538 -1.8643 -1.8633 -0.3118 -0.3080 0.5324 0.5342 0.7119 0.7185 0.8674 0.8752 1.1632 1.1649 1.2161 1.2175 2.0111 2.0216 2.1294 2.1394 2.3115 2.3848 3.5391 3.5657 3.5803 3.6148 3.6749 3.8245 3.8302 3.8439 3.9243 3.9653 4.0298 4.0701 4.3189 4.3774 4.6565 4.7447 5.6782 5.6969 5.7892 5.7940 8.8613 8.8642 11.9764 11.9862 13.1128 13.1207 13.3673 13.3694 k = 0.1115 0.4006-0.0000 ( 3026 PWs) bands (ev): -14.6663 -14.6659 -13.9522 -13.9519 -13.5664 -13.5664 -13.4577 -13.4571 -2.8537 -2.8527 -2.6258 -2.6258 -1.8516 -1.8505 -0.3341 -0.3303 0.5205 0.5217 0.7196 0.7259 0.8759 0.8839 1.0897 1.0916 1.1419 1.1438 2.0228 2.0331 2.1067 2.1174 2.2929 2.3659 3.5454 3.5712 3.5872 3.6268 3.6763 3.8243 3.8273 3.8445 3.9176 3.9668 4.0185 4.0609 4.3187 4.3807 4.6553 4.7459 5.6640 5.6829 5.7742 5.7788 8.9566 8.9595 12.0161 12.0264 13.0927 13.1008 13.3753 13.3775 k = 0.1161 0.4173-0.0000 ( 3034 PWs) bands (ev): -14.6491 -14.6488 -13.9413 -13.9409 -13.5633 -13.5633 -13.4544 -13.4538 -2.8314 -2.8303 -2.5973 -2.5972 -1.8385 -1.8374 -0.3569 -0.3530 0.5059 0.5067 0.7278 0.7336 0.8797 0.8873 1.0223 1.0241 1.0714 1.0738 2.0339 2.0432 2.0842 2.0949 2.2747 2.3469 3.5512 3.5759 3.5933 3.6383 3.6778 3.8220 3.8252 3.8444 3.9110 3.9683 4.0075 4.0518 4.3187 4.3842 4.6541 4.7469 5.6509 5.6701 5.7599 5.7643 9.0523 9.0552 12.0532 12.0638 13.0718 13.0799 13.3812 13.3834 k = 0.1207 0.4340-0.0000 ( 3026 PWs) bands (ev): -14.6317 -14.6313 -13.9303 -13.9299 -13.5603 -13.5603 -13.4512 -13.4506 -2.8088 -2.8077 -2.5682 -2.5682 -1.8252 -1.8242 -0.3799 -0.3760 0.4881 0.4884 0.7358 0.7406 0.8694 0.8741 0.9727 0.9728 1.0056 1.0092 2.0440 2.0464 2.0669 2.0725 2.2575 2.3280 3.5564 3.5799 3.5989 3.6494 3.6793 3.8172 3.8247 3.8434 3.9045 3.9682 3.9984 4.0429 4.3189 4.3881 4.6532 4.7479 5.6390 5.6583 5.7465 5.7506 9.1484 9.1513 12.0873 12.0982 13.0501 13.0582 13.3849 13.3872 k = 0.1254 0.4507-0.0000 ( 3024 PWs) bands (ev): -14.6140 -14.6137 -13.9192 -13.9189 -13.5572 -13.5572 -13.4480 -13.4474 -2.7860 -2.7849 -2.5389 -2.5389 -1.8118 -1.8107 -0.4033 -0.3994 0.4660 0.4662 0.7409 0.7433 0.8324 0.8337 0.9418 0.9422 0.9563 0.9644 2.0296 2.0441 2.0590 2.0677 2.2417 2.3095 3.5610 3.5832 3.6038 3.6597 3.6807 3.8113 3.8245 3.8415 3.8982 3.9632 3.9945 4.0345 4.3195 4.3923 4.6523 4.7488 5.6282 5.6476 5.7337 5.7375 9.2447 9.2476 12.1180 12.1293 13.0277 13.0358 13.3866 13.3889 k = 0.1300 0.4674-0.0000 ( 3032 PWs) bands (ev): -14.5962 -14.5959 -13.9082 -13.9078 -13.5541 -13.5540 -13.4449 -13.4442 -2.7633 -2.7622 -2.5093 -2.5092 -1.7983 -1.7972 -0.4272 -0.4232 0.4389 0.4394 0.7254 0.7276 0.7924 0.7998 0.8905 0.8921 0.9550 0.9634 2.0062 2.0230 2.0653 2.0723 2.2283 2.2919 3.5647 3.5857 3.6082 3.6689 3.6818 3.8045 3.8247 3.8384 3.8922 3.9528 3.9960 4.0267 4.3203 4.3968 4.6514 4.7495 5.6184 5.6378 5.7214 5.7248 9.3411 9.3439 12.1451 12.1567 13.0046 13.0126 13.3864 13.3888 k = 0.1347 0.4841-0.0000 ( 3040 PWs) bands (ev): -14.5783 -14.5780 -13.8972 -13.8968 -13.5510 -13.5509 -13.4418 -13.4412 -2.7406 -2.7395 -2.4796 -2.4795 -1.7846 -1.7836 -0.4513 -0.4473 0.4065 0.4074 0.6737 0.6761 0.7869 0.7939 0.8456 0.8468 0.9621 0.9711 1.9822 2.0001 2.0719 2.0739 2.2186 2.2757 3.5678 3.5876 3.6120 3.6768 3.6826 3.7970 3.8255 3.8341 3.8868 3.9397 4.0004 4.0198 4.3213 4.4016 4.6505 4.7500 5.6095 5.6289 5.7097 5.7127 9.4374 9.4402 12.1686 12.1804 12.9810 12.9889 13.3844 13.3868 k = 0.1393 0.5008-0.0000 ( 3040 PWs) bands (ev): -14.5604 -14.5600 -13.8862 -13.8858 -13.5479 -13.5478 -13.4389 -13.4382 -2.7180 -2.7169 -2.4498 -2.4497 -1.7709 -1.7699 -0.4758 -0.4717 0.3689 0.3700 0.6100 0.6114 0.7910 0.7915 0.8117 0.8169 0.9716 0.9811 1.9585 1.9774 2.0708 2.0762 2.2138 2.2619 3.5701 3.5890 3.6152 3.6832 3.6832 3.7892 3.8272 3.8283 3.8822 3.9254 4.0059 4.0137 4.3228 4.4067 4.6497 4.7503 5.6014 5.6207 5.6985 5.7010 9.5337 9.5365 12.1881 12.2001 12.9571 12.9648 13.3808 13.3832 k = 0.1440 0.5175-0.0000 ( 3040 PWs) bands (ev): -14.5425 -14.5421 -13.8753 -13.8749 -13.5448 -13.5447 -13.4361 -13.4354 -2.6956 -2.6945 -2.4202 -2.4200 -1.7572 -1.7562 -0.5007 -0.4965 0.3266 0.3276 0.5442 0.5450 0.7681 0.7734 0.8092 0.8183 0.9824 0.9922 1.9354 1.9554 2.0625 2.0769 2.2141 2.2514 3.5716 3.5897 3.6179 3.6835 3.6878 3.7812 3.8209 3.8301 3.8786 3.9105 4.0086 4.0120 4.3246 4.4123 4.6488 4.7504 5.5940 5.6132 5.6876 5.6896 9.6297 9.6325 12.2038 12.2158 12.9328 12.9402 13.3758 13.3782 k = 0.1486 0.5342-0.0000 ( 3040 PWs) bands (ev): -14.5246 -14.5242 -13.8646 -13.8642 -13.5417 -13.5415 -13.4334 -13.4327 -2.6735 -2.6724 -2.3907 -2.3905 -1.7436 -1.7426 -0.5258 -0.5215 0.2804 0.2814 0.4789 0.4792 0.7449 0.7498 0.8194 0.8274 0.9942 1.0041 1.9133 1.9344 2.0497 2.0733 2.2189 2.2452 3.5723 3.5898 3.6199 3.6833 3.6902 3.7731 3.8121 3.8342 3.8761 3.8955 4.0045 4.0182 4.3269 4.4181 4.6478 4.7502 5.5872 5.6062 5.6769 5.6784 9.7255 9.7281 12.2155 12.2275 12.9084 12.9155 13.3696 13.3719 k = 0.1533 0.5508-0.0000 ( 3032 PWs) bands (ev): -14.5069 -14.5065 -13.8540 -13.8536 -13.5386 -13.5384 -13.4309 -13.4302 -2.6518 -2.6507 -2.3617 -2.3614 -1.7301 -1.7291 -0.5510 -0.5467 0.2318 0.2326 0.4148 0.4148 0.7264 0.7311 0.8299 0.8369 1.0072 1.0170 1.8926 1.9147 2.0334 2.0648 2.2270 2.2436 3.5723 3.5895 3.6213 3.6828 3.6903 3.7651 3.8018 3.8396 3.8750 3.8804 4.0012 4.0244 4.3296 4.4243 4.6467 4.7498 5.5808 5.5996 5.6664 5.6673 9.8208 9.8235 12.2234 12.2353 12.8840 12.8907 13.3625 13.3648 k = 0.1579 0.5675-0.0000 ( 3032 PWs) bands (ev): -14.4894 -14.4890 -13.8437 -13.8433 -13.5355 -13.5353 -13.4286 -13.4279 -2.6306 -2.6295 -2.3331 -2.3328 -1.7167 -1.7158 -0.5765 -0.5721 0.1817 0.1823 0.3523 0.3526 0.7125 0.7170 0.8394 0.8453 1.0217 1.0310 1.8735 1.8966 2.0147 2.0520 2.2375 2.2462 3.5715 3.5886 3.6220 3.6818 3.6883 3.7573 3.7903 3.8459 3.8659 3.8750 3.9986 4.0303 4.3328 4.4309 4.6454 4.7491 5.5747 5.5932 5.6559 5.6562 9.9158 9.9183 12.2276 12.2393 12.8598 12.8660 13.3546 13.3568 k = 0.1625 0.5842-0.0000 ( 3032 PWs) bands (ev): -14.4721 -14.4717 -13.8337 -13.8333 -13.5324 -13.5322 -13.4265 -13.4257 -2.6098 -2.6088 -2.3052 -2.3048 -1.7036 -1.7027 -0.6020 -0.5976 0.1312 0.1316 0.2920 0.2924 0.7024 0.7067 0.8472 0.8519 1.0379 1.0466 1.8562 1.8803 1.9943 2.0355 2.2494 2.2523 3.5699 3.5872 3.6220 3.6804 3.6842 3.7497 3.7779 3.8464 3.8584 3.8763 3.9967 4.0358 4.3366 4.4378 4.6440 4.7481 5.5686 5.5869 5.6450 5.6454 10.0102 10.0127 12.2282 12.2396 12.8358 12.8416 13.3463 13.3484 k = 0.1672 0.6009-0.0000 ( 3028 PWs) bands (ev): -14.4552 -14.4548 -13.8239 -13.8235 -13.5293 -13.5291 -13.4246 -13.4238 -2.5897 -2.5887 -2.2781 -2.2776 -1.6908 -1.6899 -0.6275 -0.6230 0.0811 0.0814 0.2340 0.2346 0.6955 0.6997 0.8527 0.8562 1.0562 1.0641 1.8410 1.8659 1.9728 2.0162 2.2609 2.2624 3.5678 3.5855 3.6215 3.6783 3.6787 3.7424 3.7647 3.8334 3.8656 3.8787 3.9952 4.0409 4.3410 4.4451 4.6423 4.7468 5.5626 5.5806 5.6337 5.6347 10.1041 10.1064 12.2254 12.2365 12.8124 12.8175 13.3377 13.3397 k = 0.1718 0.6176-0.0000 ( 3026 PWs) bands (ev): -14.4387 -14.4383 -13.8145 -13.8141 -13.5262 -13.5260 -13.4230 -13.4222 -2.5703 -2.5694 -2.2519 -2.2514 -1.6783 -1.6774 -0.6527 -0.6482 0.0320 0.0321 0.1786 0.1793 0.6915 0.6955 0.8556 0.8579 1.0767 1.0837 1.8280 1.8538 1.9504 1.9950 2.2712 2.2759 3.5650 3.5832 3.6203 3.6711 3.6765 3.7354 3.7511 3.8191 3.8754 3.8822 3.9940 4.0453 4.3460 4.4527 4.6404 4.7451 5.5564 5.5740 5.6220 5.6237 10.1972 10.1995 12.2195 12.2301 12.7896 12.7940 13.3292 13.3311 k = 0.1765 0.6343-0.0000 ( 3026 PWs) bands (ev): -14.4226 -14.4222 -13.8054 -13.8050 -13.5232 -13.5229 -13.4216 -13.4208 -2.5517 -2.5508 -2.2268 -2.2263 -1.6663 -1.6653 -0.6776 -0.6730 -0.0156 -0.0156 0.1260 0.1268 0.6899 0.6939 0.8557 0.8568 1.0996 1.1056 1.8174 1.8438 1.9273 1.9724 2.2827 2.2898 3.5616 3.5807 3.6186 3.6629 3.6739 3.7284 3.7373 3.8048 3.8859 3.8865 3.9930 4.0491 4.3517 4.4608 4.6381 4.7430 5.5499 5.5672 5.6099 5.6123 10.2897 10.2919 12.2107 12.2208 12.7676 12.7713 13.3210 13.3226 k = 0.1811 0.6510-0.0000 ( 3030 PWs) bands (ev): -14.4070 -14.4066 -13.7967 -13.7963 -13.5202 -13.5199 -13.4205 -13.4197 -2.5339 -2.5331 -2.2030 -2.2024 -1.6547 -1.6538 -0.7019 -0.6973 -0.0614 -0.0613 0.0761 0.0770 0.6906 0.6945 0.8530 0.8531 1.1246 1.1297 1.8091 1.8361 1.9038 1.9486 2.2950 2.3038 3.5577 3.5778 3.6164 3.6540 3.6710 3.7216 3.7234 3.7908 3.8917 3.8969 3.9921 4.0522 4.3582 4.4692 4.6355 4.7404 5.5430 5.5598 5.5973 5.6005 10.3813 10.3834 12.1993 12.2088 12.7465 12.7495 13.3131 13.3145 k = 0.1858 0.6677-0.0000 ( 3034 PWs) bands (ev): -14.3919 -14.3915 -13.7885 -13.7881 -13.5172 -13.5169 -13.4197 -13.4189 -2.5171 -2.5163 -2.1806 -2.1799 -1.6437 -1.6427 -0.7255 -0.7209 -0.1052 -0.1050 0.0293 0.0302 0.6933 0.6972 0.8470 0.8476 1.1517 1.1559 1.8032 1.8306 1.8798 1.9241 2.3076 2.3178 3.5535 3.5747 3.6140 3.6448 3.6676 3.7097 3.7149 3.7772 3.8975 3.9083 3.9911 4.0544 4.3653 4.4779 4.6325 4.7375 5.5354 5.5518 5.5842 5.5882 10.4721 10.4740 12.1856 12.1945 12.7265 12.7287 13.3058 13.3069 k = 0.1904 0.6844-0.0000 ( 3030 PWs) bands (ev): -14.3775 -14.3771 -13.7807 -13.7803 -13.5142 -13.5138 -13.4192 -13.4184 -2.5012 -2.5005 -2.1598 -2.1590 -1.6332 -1.6323 -0.7482 -0.7436 -0.1466 -0.1464 -0.0144 -0.0135 0.6980 0.7018 0.8388 0.8399 1.1806 1.1841 1.7994 1.8271 1.8556 1.8990 2.3205 2.3316 3.5490 3.5713 3.6112 3.6354 3.6637 3.6966 3.7083 3.7640 3.9041 3.9200 3.9902 4.0558 4.3732 4.4870 4.6292 4.7342 5.5272 5.5431 5.5706 5.5753 10.5619 10.5637 12.1698 12.1780 12.7078 12.7092 13.2990 13.2997 k = 0.1950 0.7011-0.0000 ( 3026 PWs) bands (ev): -14.3638 -14.3634 -13.7734 -13.7730 -13.5112 -13.5108 -13.4190 -13.4182 -2.4863 -2.4857 -2.1406 -2.1398 -1.6234 -1.6225 -0.7697 -0.7652 -0.1856 -0.1854 -0.0550 -0.0540 0.7045 0.7084 0.8288 0.8302 1.2112 1.2141 1.7977 1.8256 1.8313 1.8736 2.3334 2.3451 3.5443 3.5679 3.6084 3.6262 3.6592 3.6843 3.7019 3.7514 3.9111 3.9317 3.9892 4.0564 4.3818 4.4964 4.6254 4.7304 5.5183 5.5336 5.5562 5.5618 10.6507 10.6523 12.1522 12.1597 12.6904 12.6910 13.2922 13.2923 k = 0.1997 0.7178-0.0000 ( 3026 PWs) bands (ev): -14.3507 -14.3504 -13.7667 -13.7662 -13.5083 -13.5079 -13.4191 -13.4184 -2.4726 -2.4721 -2.1232 -2.1223 -1.6143 -1.6134 -0.7900 -0.7855 -0.2221 -0.2219 -0.0923 -0.0913 0.7128 0.7167 0.8173 0.8189 1.2433 1.2457 1.7966 1.8080 1.8248 1.8488 2.3461 2.3581 3.5395 3.5645 3.6054 3.6172 3.6538 3.6732 3.6956 3.7392 3.9184 3.9435 3.9880 4.0562 4.3909 4.5061 4.6211 4.7260 5.5085 5.5231 5.5411 5.5477 10.7383 10.7398 12.1331 12.1399 12.6742 12.6744 13.2831 13.2838 k = 0.2043 0.7345-0.0000 ( 3026 PWs) bands (ev): -14.3385 -14.3382 -13.7604 -13.7600 -13.5054 -13.5049 -13.4197 -13.4189 -2.4601 -2.4596 -2.1076 -2.1067 -1.6060 -1.6050 -0.8089 -0.8045 -0.2559 -0.2557 -0.1262 -0.1252 0.7228 0.7267 0.8048 0.8064 1.2766 1.2786 1.7795 1.8022 1.8151 1.8343 2.3585 2.3706 3.5347 3.5610 3.6022 3.6086 3.6473 3.6639 3.6895 3.7277 3.9261 3.9553 3.9866 4.0551 4.4007 4.5161 4.6163 4.7211 5.4977 5.5116 5.5253 5.5329 10.8248 10.8260 12.1126 12.1187 12.6590 12.6600 13.2677 13.2696 k = 0.2090 0.7511-0.0000 ( 3030 PWs) bands (ev): -14.3271 -14.3267 -13.7548 -13.7544 -13.5025 -13.5020 -13.4206 -13.4198 -2.4487 -2.4484 -2.0940 -2.0931 -1.5984 -1.5974 -0.8264 -0.8221 -0.2869 -0.2868 -0.1567 -0.1558 0.7344 0.7384 0.7915 0.7929 1.3111 1.3127 1.7546 1.7907 1.8056 1.8358 2.3704 2.3824 3.5300 3.5576 3.5987 3.6007 3.6399 3.6565 3.6838 3.7167 3.9339 3.9669 3.9850 4.0534 4.4109 4.5263 4.6110 4.7157 5.4859 5.4989 5.5087 5.5174 10.9100 10.9109 12.0911 12.0965 12.6455 12.6473 13.2363 13.2391 k = 0.2136 0.7678-0.0000 ( 3022 PWs) bands (ev): -14.3165 -14.3162 -13.7497 -13.7493 -13.4997 -13.4991 -13.4218 -13.4211 -2.4386 -2.4384 -2.0823 -2.0813 -1.5916 -1.5905 -0.8423 -0.8382 -0.3152 -0.3151 -0.1838 -0.1830 0.7476 0.7516 0.7777 0.7789 1.3465 1.3477 1.7291 1.7639 1.8109 1.8408 2.3817 2.3934 3.5254 3.5544 3.5935 3.5950 3.6325 3.6504 3.6784 3.7065 3.9419 3.9783 3.9833 4.0510 4.4216 4.5367 4.6051 4.7098 5.4733 5.4852 5.4914 5.5014 10.9937 10.9945 12.0688 12.0735 12.6337 12.6363 13.1829 13.1855 k = 0.2183 0.7845-0.0000 ( 3026 PWs) bands (ev): -14.3068 -14.3065 -13.7453 -13.7449 -13.4969 -13.4963 -13.4235 -13.4228 -2.4298 -2.4297 -2.0725 -2.0715 -1.5856 -1.5845 -0.8568 -0.8528 -0.3405 -0.3404 -0.2075 -0.2067 0.7622 0.7638 0.7642 0.7669 1.3826 1.3836 1.7033 1.7364 1.8175 1.8473 2.3924 2.4036 3.5211 3.5513 3.5870 3.5908 3.6260 3.6451 3.6735 3.6971 3.9499 3.9814 3.9894 4.0480 4.4325 4.5472 4.5986 4.7032 5.4595 5.4702 5.4734 5.4847 11.0760 11.0765 12.0457 12.0498 12.6238 12.6270 13.1153 13.1172 k = 0.2229 0.8012-0.0000 ( 3024 PWs) bands (ev): -14.2981 -14.2978 -13.7415 -13.7411 -13.4941 -13.4935 -13.4256 -13.4248 -2.4224 -2.4224 -2.0646 -2.0636 -1.5803 -1.5792 -0.8698 -0.8660 -0.3628 -0.3625 -0.2278 -0.2271 0.7499 0.7503 0.7783 0.7826 1.4194 1.4201 1.6771 1.7085 1.8251 1.8549 2.4022 2.4128 3.5172 3.5483 3.5815 3.5861 3.6210 3.6402 3.6692 3.6885 3.9576 3.9796 3.9999 4.0448 4.4437 4.5578 4.5915 4.6961 5.4446 5.4541 5.4546 5.4674 11.1567 11.1569 12.0222 12.0257 12.6157 12.6196 13.0416 13.0429 k = 0.2276 0.8179-0.0000 ( 3020 PWs) bands (ev): -14.2903 -14.2900 -13.7384 -13.7379 -13.4915 -13.4907 -13.4280 -13.4273 -2.4164 -2.4163 -2.0585 -2.0575 -1.5758 -1.5746 -0.8817 -0.8781 -0.3819 -0.3814 -0.2446 -0.2440 0.7364 0.7364 0.7957 0.8001 1.4566 1.4571 1.6508 1.6804 1.8337 1.8636 2.4113 2.4210 3.5137 3.5456 3.5770 3.5810 3.6176 3.6359 3.6654 3.6809 3.9647 3.9783 4.0093 4.0419 4.4551 4.5685 4.5838 4.6883 5.4287 5.4352 5.4369 5.4494 11.2356 11.2357 11.9983 12.0012 12.6095 12.6141 12.9656 12.9665 k = 0.2322 0.8346-0.0000 ( 3028 PWs) bands (ev): -14.2834 -14.2832 -13.7359 -13.7354 -13.4889 -13.4881 -13.4309 -13.4302 -2.4118 -2.4115 -2.0540 -2.0530 -1.5720 -1.5708 -0.8925 -0.8891 -0.3977 -0.3970 -0.2581 -0.2576 0.7229 0.7234 0.8143 0.8187 1.4939 1.4942 1.6243 1.6521 1.8430 1.8730 2.4194 2.4281 3.5105 3.5429 3.5734 3.5757 3.6154 3.6320 3.6622 3.6745 3.9688 3.9796 4.0160 4.0410 4.4665 4.5754 4.5790 4.6799 5.4117 5.4152 5.4187 5.4306 11.3124 11.3129 11.9741 11.9766 12.6053 12.6105 12.8888 12.8894 k = 0.2368 0.8513-0.0000 ( 3024 PWs) bands (ev): -14.2776 -14.2774 -13.7341 -13.7336 -13.4864 -13.4856 -13.4341 -13.4335 -2.4086 -2.4082 -2.0511 -2.0500 -1.5688 -1.5676 -0.9024 -0.8993 -0.4100 -0.4091 -0.2682 -0.2678 0.7102 0.7112 0.8339 0.8385 1.5311 1.5312 1.5980 1.6237 1.8529 1.8831 2.4266 2.4342 3.5079 3.5405 3.5707 3.5708 3.6142 3.6291 3.6595 3.6697 3.9685 3.9852 4.0174 4.0445 4.4779 4.5664 4.5895 4.6708 5.3938 5.3947 5.3998 5.4111 11.3875 11.3883 11.9499 11.9519 12.6030 12.6089 12.8119 12.8124 k = 0.2415 0.8680-0.0000 ( 3024 PWs) bands (ev): -14.2727 -14.2725 -13.7330 -13.7325 -13.4840 -13.4831 -13.4378 -13.4372 -2.4068 -2.4062 -2.0494 -2.0484 -1.5663 -1.5650 -0.9118 -0.9088 -0.4186 -0.4176 -0.2751 -0.2748 0.6982 0.6997 0.8545 0.8592 1.5609 1.5665 1.5785 1.5970 1.8632 1.8937 2.4329 2.4393 3.5057 3.5383 3.5661 3.5692 3.6133 3.6276 3.6571 3.6669 3.9663 3.9923 4.0142 4.0519 4.4891 4.5566 4.5998 4.6611 5.3738 5.3750 5.3803 5.3908 11.4605 11.4617 11.9256 11.9271 12.6027 12.6092 12.7353 12.7357 k = 0.2461 0.8847-0.0000 ( 3020 PWs) bands (ev): -14.2689 -14.2687 -13.7325 -13.7320 -13.4817 -13.4808 -13.4419 -13.4413 -2.4064 -2.4057 -2.0489 -2.0478 -1.5643 -1.5630 -0.9207 -0.9180 -0.4236 -0.4223 -0.2788 -0.2787 0.6872 0.6892 0.8760 0.8808 1.5411 1.5626 1.6082 1.6090 1.8740 1.9048 2.4382 2.4433 3.5041 3.5361 3.5622 3.5685 3.6121 3.6281 3.6548 3.6663 3.9638 3.9996 4.0089 4.0607 4.5000 4.5462 4.6099 4.6508 5.3525 5.3554 5.3603 5.3698 11.5316 11.5331 11.9013 11.9025 12.6041 12.6114 12.6592 12.6598 k = 0.2508 0.9014-0.0000 ( 3020 PWs) bands (ev): -14.2660 -14.2658 -13.7329 -13.7323 -13.4796 -13.4787 -13.4463 -13.4457 -2.4073 -2.4065 -2.0493 -2.0483 -1.5628 -1.5614 -0.9295 -0.9270 -0.4249 -0.4234 -0.2794 -0.2794 0.6772 0.6798 0.8980 0.9029 1.5141 1.5344 1.6445 1.6446 1.8851 1.9162 2.4427 2.4464 3.5030 3.5342 3.5589 3.5686 3.6106 3.6305 3.6531 3.6677 3.9610 4.0025 4.0069 4.0699 4.5106 4.5351 4.6195 4.6399 5.3311 5.3352 5.3402 5.3480 11.6006 11.6025 11.8771 11.8779 12.5819 12.5834 12.6102 12.6160 k = 0.2554 0.9181-0.0000 ( 3008 PWs) bands (ev): -14.2641 -14.2640 -13.7339 -13.7333 -13.4777 -13.4767 -13.4511 -13.4506 -2.4096 -2.4087 -2.0504 -2.0494 -1.5617 -1.5603 -0.9382 -0.9360 -0.4224 -0.4207 -0.2770 -0.2769 0.6684 0.6715 0.9206 0.9256 1.4866 1.5053 1.6805 1.6806 1.8964 1.9280 2.4464 2.4486 3.5024 3.5325 3.5564 3.5694 3.6092 3.6347 3.6526 3.6710 3.9582 3.9955 4.0140 4.0792 4.5208 4.5235 4.6261 4.6311 5.3097 5.3145 5.3200 5.3257 11.6675 11.6697 11.8530 11.8534 12.5081 12.5087 12.6149 12.6221 k = 0.2601 0.9348-0.0000 ( 3012 PWs) bands (ev): -14.2631 -14.2631 -13.7356 -13.7351 -13.4760 -13.4749 -13.4563 -13.4558 -2.4133 -2.4122 -2.0521 -2.0511 -1.5609 -1.5596 -0.9470 -0.9450 -0.4162 -0.4143 -0.2718 -0.2715 0.6607 0.6643 0.9434 0.9484 1.4588 1.4759 1.7156 1.7160 1.9078 1.9401 2.4493 2.4501 3.5023 3.5310 3.5546 3.5706 3.6081 3.6400 3.6532 3.6758 3.9554 3.9880 4.0208 4.0883 4.5109 4.5305 4.6154 4.6383 5.2881 5.2934 5.2999 5.3028 11.7322 11.7348 11.8290 11.8290 12.4340 12.4346 12.6225 12.6302 k = 0.2647 0.9515-0.0000 ( 3008 PWs) bands (ev): -14.2631 -14.2631 -13.7381 -13.7375 -13.4744 -13.4733 -13.4619 -13.4614 -2.4182 -2.4170 -2.0541 -2.0531 -1.5605 -1.5591 -0.9559 -0.9541 -0.4064 -0.4043 -0.2637 -0.2632 0.6542 0.6583 0.9663 0.9714 1.4308 1.4463 1.7497 1.7504 1.9194 1.9526 2.4509 2.4516 3.5026 3.5299 3.5537 3.5724 3.6076 3.6466 3.6551 3.6821 3.9529 3.9802 4.0274 4.0972 4.4977 4.5395 4.6024 4.6466 5.2666 5.2724 5.2787 5.2809 11.7940 11.7974 11.8052 11.8058 12.3607 12.3614 12.6322 12.6403 k = 0.2694 0.9681-0.0000 ( 3006 PWs) bands (ev): -14.2641 -14.2640 -13.7413 -13.7407 -13.4732 -13.4720 -13.4677 -13.4673 -2.4244 -2.4231 -2.0564 -2.0554 -1.5603 -1.5589 -0.9649 -0.9633 -0.3931 -0.3909 -0.2528 -0.2522 0.6489 0.6534 0.9890 0.9941 1.4028 1.4167 1.7824 1.7837 1.9311 1.9653 2.4513 2.4533 3.5032 3.5291 3.5535 3.5745 3.6079 3.6541 3.6584 3.6899 3.9505 3.9722 4.0337 4.1058 4.4839 4.5479 4.5887 4.6543 5.2452 5.2519 5.2554 5.2616 11.7804 11.7807 11.8556 11.8586 12.2881 12.2890 12.6438 12.6522 k = 0.2694 0.9681-0.0000 ( 3006 PWs) bands (ev): -14.2641 -14.2640 -13.7413 -13.7407 -13.4732 -13.4720 -13.4677 -13.4673 -2.4244 -2.4231 -2.0564 -2.0554 -1.5603 -1.5589 -0.9649 -0.9633 -0.3931 -0.3909 -0.2528 -0.2522 0.6489 0.6534 0.9890 0.9941 1.4028 1.4167 1.7824 1.7837 1.9311 1.9653 2.4513 2.4533 3.5032 3.5291 3.5535 3.5745 3.6079 3.6541 3.6584 3.6899 3.9505 3.9722 4.0337 4.1058 4.4839 4.5479 4.5887 4.6543 5.2452 5.2519 5.2554 5.2616 11.7804 11.7807 11.8556 11.8586 12.2881 12.2890 12.6438 12.6522 k = 0.2525 0.9681-0.0000 ( 3001 PWs) bands (ev): -14.2638 -14.2637 -13.7404 -13.7398 -13.4735 -13.4724 -13.4660 -13.4656 -2.4231 -2.4218 -2.0545 -2.0535 -1.5618 -1.5603 -0.9620 -0.9604 -0.3981 -0.3958 -0.2547 -0.2540 0.6501 0.6545 0.9830 0.9881 1.4104 1.4247 1.7734 1.7749 1.9279 1.9617 2.4511 2.4529 3.5032 3.5294 3.5533 3.5740 3.6078 3.6520 3.6575 3.6877 3.9512 3.9743 4.0323 4.1036 4.4870 4.5446 4.5934 4.6526 5.2502 5.2556 5.2638 5.2679 11.7834 11.7840 11.8431 11.8459 12.3064 12.3075 12.6424 12.6508 k = 0.2357 0.9681-0.0000 ( 3002 PWs) bands (ev): -14.2636 -14.2636 -13.7395 -13.7390 -13.4739 -13.4729 -13.4642 -13.4639 -2.4224 -2.4212 -2.0502 -2.0491 -1.5660 -1.5644 -0.9582 -0.9565 -0.4049 -0.4026 -0.2541 -0.2530 0.6513 0.6555 0.9768 0.9819 1.4185 1.4331 1.7633 1.7653 1.9243 1.9575 2.4505 2.4525 3.5035 3.5300 3.5529 3.5734 3.6078 3.6499 3.6566 3.6857 3.9518 3.9762 4.0313 4.1015 4.4891 4.5394 4.5994 4.6514 5.2545 5.2589 5.2734 5.2764 11.7790 11.7802 11.8378 11.8400 12.3229 12.3247 12.6452 12.6534 k = 0.2188 0.9681-0.0000 ( 3000 PWs) bands (ev): -14.2636 -14.2636 -13.7387 -13.7382 -13.4741 -13.4732 -13.4626 -13.4622 -2.4226 -2.4214 -2.0434 -2.0422 -1.5728 -1.5710 -0.9535 -0.9518 -0.4131 -0.4108 -0.2514 -0.2500 0.6524 0.6565 0.9705 0.9756 1.4271 1.4420 1.7524 1.7551 1.9206 1.9528 2.4496 2.4520 3.5041 3.5308 3.5523 3.5730 3.6078 3.6478 3.6560 3.6837 3.9525 3.9778 4.0308 4.0994 4.4901 4.5333 4.6057 4.6507 5.2587 5.2626 5.2834 5.2863 11.7688 11.7706 11.8387 11.8404 12.3370 12.3397 12.6522 12.6602 k = 0.2020 0.9681-0.0000 ( 2998 PWs) bands (ev): -14.2637 -14.2637 -13.7379 -13.7374 -13.4742 -13.4733 -13.4610 -13.4607 -2.4233 -2.4222 -2.0342 -2.0329 -1.5820 -1.5800 -0.9482 -0.9465 -0.4222 -0.4199 -0.2470 -0.2454 0.6535 0.6573 0.9644 0.9694 1.4361 1.4512 1.7407 1.7442 1.9166 1.9478 2.4487 2.4513 3.5050 3.5318 3.5515 3.5725 3.6080 3.6456 3.6555 3.6817 3.9533 3.9791 4.0309 4.0974 4.4901 4.5268 4.6121 4.6505 5.2630 5.2666 5.2936 5.2966 11.7563 11.7584 11.8426 11.8439 12.3483 12.3517 12.6634 12.6712 k = 0.1852 0.9681-0.0000 ( 2998 PWs) bands (ev): -14.2639 -14.2638 -13.7372 -13.7367 -13.4742 -13.4734 -13.4595 -13.4592 -2.4246 -2.4235 -2.0230 -2.0215 -1.5935 -1.5913 -0.9424 -0.9408 -0.4318 -0.4296 -0.2414 -0.2397 0.6544 0.6579 0.9586 0.9634 1.4456 1.4608 1.7284 1.7328 1.9126 1.9423 2.4477 2.4506 3.5061 3.5331 3.5504 3.5720 3.6084 3.6434 3.6552 3.6799 3.9541 3.9800 4.0316 4.0953 4.4892 4.5201 4.6181 4.6506 5.2675 5.2709 5.3039 5.3069 11.7436 11.7458 11.8475 11.8487 12.3568 12.3607 12.6784 12.6860 k = 0.1683 0.9681-0.0000 ( 3002 PWs) bands (ev): -14.2641 -14.2641 -13.7366 -13.7361 -13.4741 -13.4734 -13.4582 -13.4579 -2.4262 -2.4252 -2.0097 -2.0081 -1.6070 -1.6047 -0.9365 -0.9349 -0.4415 -0.4393 -0.2350 -0.2334 0.6551 0.6584 0.9531 0.9578 1.4555 1.4707 1.7157 1.7208 1.9085 1.9367 2.4467 2.4497 3.5074 3.5344 3.5492 3.5715 3.6088 3.6413 3.6550 3.6780 3.9550 3.9805 4.0329 4.0933 4.4875 4.5133 4.6238 4.6511 5.2722 5.2753 5.3140 5.3170 11.7316 11.7339 11.8528 11.8537 12.3627 12.3670 12.6963 12.7036 k = 0.1515 0.9681-0.0000 ( 3004 PWs) bands (ev): -14.2644 -14.2643 -13.7360 -13.7356 -13.4739 -13.4732 -13.4570 -13.4568 -2.4281 -2.4272 -1.9947 -1.9929 -1.6224 -1.6199 -0.9306 -0.9290 -0.4509 -0.4489 -0.2282 -0.2266 0.6557 0.6587 0.9481 0.9527 1.4657 1.4810 1.7026 1.7085 1.9046 1.9309 2.4458 2.4488 3.5090 3.5359 3.5479 3.5708 3.6094 3.6391 3.6550 3.6762 3.9561 3.9804 4.0350 4.0912 4.4854 4.5067 4.6290 4.6517 5.2768 5.2797 5.3236 5.3266 11.7208 11.7230 11.8579 11.8587 12.3666 12.3710 12.7164 12.7233 k = 0.1347 0.9681-0.0000 ( 3014 PWs) bands (ev): -14.2647 -14.2646 -13.7355 -13.7351 -13.4737 -13.4730 -13.4560 -13.4558 -2.4302 -2.4294 -1.9781 -1.9762 -1.6394 -1.6368 -0.9247 -0.9233 -0.4599 -0.4581 -0.2214 -0.2199 0.6560 0.6587 0.9438 0.9481 1.4763 1.4914 1.6893 1.6960 1.9010 1.9251 2.4448 2.4479 3.5106 3.5373 3.5467 3.5701 3.6101 3.6369 3.6552 3.6744 3.9571 3.9800 4.0375 4.0890 4.4828 4.5004 4.6337 4.6525 5.2814 5.2840 5.3328 5.3357 11.7112 11.7133 11.8628 11.8635 12.3690 12.3733 12.7375 12.7439 k = 0.1178 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2650 -14.2650 -13.7350 -13.7347 -13.4733 -13.4727 -13.4551 -13.4549 -2.4322 -2.4315 -1.9601 -1.9580 -1.6577 -1.6550 -0.9192 -0.9179 -0.4682 -0.4666 -0.2147 -0.2133 0.6562 0.6586 0.9400 0.9440 1.4871 1.5020 1.6758 1.6832 1.8976 1.9194 2.4440 2.4469 3.5125 3.5382 3.5460 3.5692 3.6110 3.6348 3.6555 3.6727 3.9583 3.9792 4.0405 4.0867 4.4801 4.4945 4.6379 4.6533 5.2858 5.2881 5.3413 5.3440 11.7030 11.7049 11.8673 11.8679 12.3703 12.3744 12.7588 12.7646 k = 0.1010 0.9681-0.0000 ( 3016 PWs) bands (ev): -14.2653 -14.2652 -13.7346 -13.7343 -13.4730 -13.4725 -13.4544 -13.4542 -2.4342 -2.4336 -1.9409 -1.9386 -1.6773 -1.6745 -0.9141 -0.9129 -0.4757 -0.4743 -0.2084 -0.2072 0.6561 0.6583 0.9369 0.9405 1.4982 1.5128 1.6623 1.6704 1.8948 1.9139 2.4433 2.4460 3.5144 3.5382 3.5462 3.5681 3.6121 3.6327 3.6561 3.6710 3.9597 3.9781 4.0440 4.0844 4.4775 4.4891 4.6416 4.6541 5.2899 5.2920 5.3490 5.3514 11.6960 11.6978 11.8713 11.8718 12.3710 12.3747 12.7793 12.7845 k = 0.0842 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2655 -14.2655 -13.7343 -13.7340 -13.4726 -13.4722 -13.4538 -13.4536 -2.4360 -2.4354 -1.9206 -1.9183 -1.6979 -1.6950 -0.9095 -0.9085 -0.4823 -0.4811 -0.2027 -0.2016 0.6560 0.6578 0.9345 0.9376 1.5095 1.5237 1.6489 1.6576 1.8925 1.9088 2.4427 2.4451 3.5165 3.5372 3.5475 3.5669 3.6133 3.6307 3.6567 3.6693 3.9610 3.9768 4.0476 4.0819 4.4751 4.4842 4.6448 4.6547 5.2936 5.2954 5.3557 5.3578 11.6903 11.6919 11.8748 11.8752 12.3713 12.3746 12.7983 12.8029 k = 0.0673 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2658 -14.2658 -13.7340 -13.7338 -13.4723 -13.4719 -13.4533 -13.4531 -2.4375 -2.4370 -1.8995 -1.8970 -1.7193 -1.7164 -0.9056 -0.9048 -0.4878 -0.4869 -0.1977 -0.1969 0.6558 0.6572 0.9327 0.9353 1.5210 1.5345 1.6359 1.6449 1.8909 1.9041 2.4423 2.4443 3.5186 3.5355 3.5493 3.5654 3.6146 3.6287 3.6575 3.6677 3.9625 3.9754 4.0515 4.0793 4.4730 4.4800 4.6476 4.6551 5.2968 5.2983 5.3614 5.3632 11.6859 11.6871 11.8778 11.8781 12.3715 12.3742 12.8152 12.8189 k = 0.0505 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2660 -14.2660 -13.7338 -13.7337 -13.4720 -13.4717 -13.4529 -13.4528 -2.4387 -2.4384 -1.8777 -1.8751 -1.7413 -1.7384 -0.9024 -0.9018 -0.4922 -0.4915 -0.1937 -0.1930 0.6556 0.6567 0.9314 0.9334 1.5324 1.5449 1.6235 1.6326 1.8899 1.9000 2.4420 2.4436 3.5207 3.5336 3.5514 3.5637 3.6161 3.6267 3.6584 3.6662 3.9640 3.9738 4.0554 4.0764 4.4714 4.4765 4.6499 4.6553 5.2995 5.3005 5.3660 5.3674 11.6825 11.6835 11.8801 11.8803 12.3716 12.3737 12.8291 12.8320 k = 0.0337 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2661 -14.2661 -13.7337 -13.7336 -13.4717 -13.4716 -13.4526 -13.4525 -2.4396 -2.4394 -1.8554 -1.8527 -1.7638 -1.7609 -0.9001 -0.8997 -0.4954 -0.4949 -0.1907 -0.1902 0.6554 0.6562 0.9307 0.9320 1.5434 1.5541 1.6127 1.6211 1.8897 1.8965 2.4419 2.4430 3.5229 3.5316 3.5536 3.5619 3.6176 3.6247 3.6595 3.6647 3.9656 3.9722 4.0592 4.0734 4.4704 4.4737 4.6517 4.6553 5.3015 5.3022 5.3695 5.3704 11.6802 11.6809 11.8818 11.8819 12.3718 12.3732 12.8397 12.8416 k = 0.0168 0.9681-0.0000 ( 3022 PWs) bands (ev): -14.2662 -14.2662 -13.7335 -13.7335 -13.4716 -13.4715 -13.4524 -13.4524 -2.4401 -2.4400 -1.8328 -1.8301 -1.7865 -1.7837 -0.8986 -0.8984 -0.4972 -0.4970 -0.1888 -0.1885 0.6554 0.6558 0.9304 0.9311 1.5533 1.5602 1.6053 1.6111 1.8903 1.8937 2.4419 2.4425 3.5251 3.5294 3.5558 3.5600 3.6193 3.6228 3.6606 3.6632 3.9672 3.9705 4.0630 4.0701 4.4701 4.4717 4.6532 4.6549 5.3027 5.3031 5.3716 5.3720 11.6789 11.6792 11.8828 11.8829 12.3720 12.3727 12.8464 12.8474 k = 0.0000 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2662 -14.2662 -13.7335 -13.7335 -13.4715 -13.4715 -13.4524 -13.4524 -2.4403 -2.4403 -1.8119 -1.8119 -1.8047 -1.8047 -0.8981 -0.8981 -0.4978 -0.4978 -0.1881 -0.1881 0.6555 0.6555 0.9305 0.9305 1.5600 1.5600 1.6048 1.6048 1.8916 1.8916 2.4421 2.4421 3.5273 3.5273 3.5579 3.5579 3.6210 3.6210 3.6619 3.6619 3.9689 3.9689 4.0667 4.0667 4.4705 4.4705 4.6542 4.6542 5.3033 5.3033 5.3725 5.3725 11.6786 11.6786 11.8832 11.8832 12.3723 12.3723 12.8490 12.8490 k = 0.0000 0.9681-0.0000 ( 3018 PWs) bands (ev): -14.2662 -14.2662 -13.7335 -13.7335 -13.4715 -13.4715 -13.4524 -13.4524 -2.4403 -2.4403 -1.8119 -1.8119 -1.8047 -1.8047 -0.8981 -0.8981 -0.4978 -0.4978 -0.1881 -0.1881 0.6555 0.6555 0.9305 0.9305 1.5600 1.5600 1.6048 1.6048 1.8916 1.8916 2.4421 2.4421 3.5273 3.5273 3.5579 3.5579 3.6210 3.6210 3.6619 3.6619 3.9689 3.9689 4.0667 4.0667 4.4705 4.4705 4.6542 4.6542 5.3033 5.3033 5.3725 5.3725 11.6786 11.6786 11.8832 11.8832 12.3723 12.3723 12.8490 12.8490 k = 0.0000 0.9681 0.0174 ( 3022 PWs) bands (ev): -14.2659 -14.2659 -13.7339 -13.7339 -13.4715 -13.4715 -13.4524 -13.4524 -2.4396 -2.4396 -1.8116 -1.8116 -1.8049 -1.8048 -0.8991 -0.8991 -0.4977 -0.4977 -0.1886 -0.1885 0.6556 0.6557 0.9300 0.9301 1.5600 1.5607 1.6043 1.6045 1.8914 1.8916 2.4410 2.4412 3.5255 3.5293 3.5576 3.5585 3.6205 3.6217 3.6607 3.6631 3.9682 3.9699 4.0655 4.0684 4.4705 4.4734 4.6553 4.6554 5.3033 5.3035 5.3724 5.3727 11.6753 11.6758 11.8820 11.8821 12.3735 12.3746 12.8525 12.8535 k = 0.0000 0.9681 0.0349 ( 3020 PWs) bands (ev): -14.2648 -14.2648 -13.7349 -13.7349 -13.4714 -13.4714 -13.4525 -13.4525 -2.4378 -2.4377 -1.8108 -1.8107 -1.8055 -1.8054 -0.9021 -0.9021 -0.4973 -0.4973 -0.1901 -0.1899 0.6558 0.6562 0.9286 0.9287 1.5607 1.5620 1.6031 1.6035 1.8911 1.8915 2.4379 2.4381 3.5242 3.5315 3.5576 3.5593 3.6202 3.6225 3.6596 3.6644 3.9679 3.9712 4.0649 4.0705 4.4736 4.4792 4.6587 4.6588 5.3037 5.3042 5.3725 5.3731 11.6661 11.6671 11.8786 11.8789 12.3782 12.3803 12.8638 12.8657 k = 0.0000 0.9681 0.0523 ( 3016 PWs) bands (ev): -14.2631 -14.2631 -13.7367 -13.7367 -13.4714 -13.4713 -13.4527 -13.4527 -2.4346 -2.4345 -1.8096 -1.8094 -1.8063 -1.8061 -0.9072 -0.9071 -0.4967 -0.4967 -0.1926 -0.1923 0.6564 0.6568 0.9262 0.9264 1.5619 1.5641 1.6011 1.6018 1.8907 1.8913 2.4328 2.4331 3.5233 3.5338 3.5581 3.5603 3.6200 3.6235 3.6587 3.6657 3.9681 3.9728 4.0649 4.0730 4.4796 4.4879 4.6642 4.6645 5.3045 5.3051 5.3727 5.3737 11.6515 11.6529 11.8730 11.8734 12.3865 12.3894 12.8824 12.8851 k = 0.0000 0.9681 0.0697 ( 3016 PWs) bands (ev): -14.2606 -14.2606 -13.7392 -13.7391 -13.4712 -13.4712 -13.4530 -13.4530 -2.4303 -2.4301 -1.8095 -1.8092 -1.8058 -1.8056 -0.9142 -0.9141 -0.4958 -0.4958 -0.1960 -0.1956 0.6571 0.6577 0.9230 0.9233 1.5636 1.5666 1.5985 1.5995 1.8901 1.8908 2.4257 2.4262 3.5230 3.5361 3.5591 3.5615 3.6199 3.6246 3.6578 3.6670 3.9687 3.9746 4.0655 4.0757 4.4886 4.4992 4.6720 4.6725 5.3055 5.3064 5.3732 5.3745 11.6320 11.6337 11.8652 11.8658 12.3985 12.4021 12.9076 12.9110 k = 0.0000 0.9681 0.0872 ( 3018 PWs) bands (ev): -14.2575 -14.2575 -13.7423 -13.7423 -13.4711 -13.4711 -13.4533 -13.4533 -2.4247 -2.4245 -1.8112 -1.8108 -1.8033 -1.8030 -0.9232 -0.9230 -0.4947 -0.4947 -0.2003 -0.1998 0.6581 0.6589 0.9189 0.9193 1.5657 1.5697 1.5954 1.5969 1.8894 1.8903 2.4168 2.4174 3.5232 3.5381 3.5606 3.5627 3.6199 3.6259 3.6571 3.6682 3.9698 3.9766 4.0664 4.0783 4.5005 4.5132 4.6818 4.6827 5.3069 5.3080 5.3737 5.3754 11.6084 11.6104 11.8551 11.8559 12.4143 12.4184 12.9384 12.9425 k = 0.0000 0.9681 0.1046 ( 3014 PWs) bands (ev): -14.2537 -14.2537 -13.7462 -13.7462 -13.4710 -13.4709 -13.4537 -13.4537 -2.4178 -2.4177 -1.8137 -1.8132 -1.7998 -1.7994 -0.9340 -0.9338 -0.4934 -0.4934 -0.2054 -0.2048 0.6593 0.6602 0.9141 0.9145 1.5678 1.5730 1.5919 1.5941 1.8886 1.8896 2.4063 2.4070 3.5240 3.5400 3.5627 3.5641 3.6201 3.6272 3.6566 3.6693 3.9714 3.9788 4.0678 4.0809 4.5152 4.5296 4.6938 4.6952 5.3085 5.3100 5.3745 5.3765 11.5816 11.5838 11.8430 11.8439 12.4338 12.4383 12.9741 12.9786 k = 0.0000 0.9681 0.1220 ( 3012 PWs) bands (ev): -14.2492 -14.2492 -13.7508 -13.7508 -13.4708 -13.4708 -13.4542 -13.4542 -2.4099 -2.4097 -1.8167 -1.8162 -1.7956 -1.7952 -0.9467 -0.9465 -0.4918 -0.4918 -0.2112 -0.2105 0.6607 0.6617 0.9086 0.9091 1.5696 1.5765 1.5883 1.5916 1.8878 1.8888 2.3942 2.3950 3.5253 3.5417 3.5653 3.5656 3.6203 3.6286 3.6562 3.6703 3.9733 3.9811 4.0692 4.0832 4.5325 4.5484 4.7077 4.7097 5.3105 5.3122 5.3754 5.3777 11.5522 11.5546 11.8287 11.8298 12.4571 12.4619 13.0135 13.0185 k = 0.0000 0.9681 0.1395 ( 3010 PWs) bands (ev): -14.2441 -14.2441 -13.7560 -13.7560 -13.4706 -13.4705 -13.4547 -13.4547 -2.4008 -2.4005 -1.8202 -1.8196 -1.7907 -1.7902 -0.9612 -0.9609 -0.4900 -0.4900 -0.2176 -0.2169 0.6623 0.6635 0.9026 0.9031 1.5704 1.5790 1.5855 1.5901 1.8869 1.8880 2.3806 2.3816 3.5271 3.5433 3.5672 3.5682 3.6206 3.6301 3.6559 3.6712 3.9757 3.9835 4.0707 4.0852 4.5522 4.5693 4.7234 4.7263 5.3127 5.3148 5.3765 5.3792 11.5211 11.5237 11.8123 11.8135 12.4841 12.4890 13.0560 13.0613 k = 0.0000 0.9681 0.1569 ( 3014 PWs) bands (ev): -14.2383 -14.2383 -13.7620 -13.7620 -13.4703 -13.4703 -13.4552 -13.4552 -2.3906 -2.3903 -1.8243 -1.8236 -1.7852 -1.7846 -0.9773 -0.9770 -0.4880 -0.4880 -0.2247 -0.2239 0.6641 0.6654 0.8959 0.8966 1.5697 1.5776 1.5865 1.5899 1.8860 1.8871 2.3658 2.3669 3.5294 3.5449 3.5689 3.5713 3.6209 3.6316 3.6557 3.6719 3.9783 3.9860 4.0721 4.0867 4.5742 4.5921 4.7409 4.7447 5.3151 5.3176 5.3776 5.3807 11.4890 11.4916 11.7938 11.7952 12.5147 12.5197 13.1007 13.1063 k = 0.0000 0.9681 0.1743 ( 3010 PWs) bands (ev): -14.2319 -14.2319 -13.7686 -13.7686 -13.4701 -13.4701 -13.4557 -13.4557 -2.3793 -2.3790 -1.8288 -1.8280 -1.7789 -1.7783 -0.9951 -0.9948 -0.4858 -0.4858 -0.2322 -0.2313 0.6660 0.6675 0.8889 0.8896 1.5677 1.5740 1.5898 1.5912 1.8851 1.8862 2.3500 2.3511 3.5321 3.5466 3.5708 3.5745 3.6212 3.6330 3.6556 3.6725 3.9813 3.9886 4.0733 4.0879 4.5980 4.6166 4.7599 4.7648 5.3178 5.3207 5.3790 5.3824 11.4564 11.4592 11.7734 11.7749 12.5489 12.5539 13.1470 13.1529 k = 0.0000 0.9681 0.1917 ( 3012 PWs) bands (ev): -14.2249 -14.2249 -13.7759 -13.7759 -13.4698 -13.4698 -13.4563 -13.4563 -2.3671 -2.3667 -1.8338 -1.8330 -1.7720 -1.7714 -1.0143 -1.0140 -0.4834 -0.4833 -0.2401 -0.2392 0.6682 0.6698 0.8814 0.8822 1.5649 1.5702 1.5933 1.5934 1.8844 1.8854 2.3331 2.3343 3.5352 3.5485 3.5727 3.5777 3.6216 3.6345 3.6556 3.6729 3.9845 3.9912 4.0742 4.0885 4.6235 4.6426 4.7802 4.7862 5.3207 5.3240 5.3805 5.3843 11.4240 11.4268 11.7511 11.7528 12.5864 12.5914 13.1942 13.2003 k = 0.0000 0.9681 0.2092 ( 3014 PWs) bands (ev): -14.2172 -14.2172 -13.7838 -13.7838 -13.4695 -13.4695 -13.4569 -13.4568 -2.3539 -2.3535 -1.8394 -1.8385 -1.7644 -1.7637 -1.0349 -1.0346 -0.4808 -0.4807 -0.2483 -0.2474 0.6705 0.6722 0.8737 0.8746 1.5619 1.5666 1.5957 1.5968 1.8837 1.8846 2.3154 2.3167 3.5387 3.5505 3.5748 3.5809 3.6220 3.6358 3.6556 3.6731 3.9879 3.9939 4.0748 4.0887 4.6503 4.6697 4.8016 4.8088 5.3238 5.3276 5.3820 5.3863 11.3921 11.3950 11.7270 11.7289 12.6271 12.6321 13.2418 13.2481 k = 0.0000 0.9681 0.2266 ( 3020 PWs) bands (ev): -14.2090 -14.2090 -13.7924 -13.7923 -13.4692 -13.4692 -13.4574 -13.4574 -2.3397 -2.3393 -1.8455 -1.8446 -1.7561 -1.7554 -1.0568 -1.0565 -0.4780 -0.4779 -0.2568 -0.2559 0.6729 0.6748 0.8657 0.8667 1.5589 1.5633 1.5980 1.5998 1.8833 1.8841 2.2971 2.2984 3.5423 3.5527 3.5770 3.5840 3.6224 3.6371 3.6557 3.6731 3.9913 3.9965 4.0750 4.0885 4.6780 4.6978 4.8237 4.8323 5.3271 5.3315 5.3837 5.3885 11.3613 11.3642 11.7013 11.7032 12.6709 12.6758 13.2895 13.2958 k = 0.0000 0.9681 0.2440 ( 3028 PWs) bands (ev): -14.2002 -14.2002 -13.8015 -13.8015 -13.4689 -13.4689 -13.4580 -13.4579 -2.3248 -2.3244 -1.8521 -1.8512 -1.7471 -1.7464 -1.0799 -1.0796 -0.4750 -0.4748 -0.2655 -0.2646 0.6755 0.6774 0.8576 0.8586 1.5563 1.5605 1.6001 1.6025 1.8831 1.8838 2.2782 2.2795 3.5463 3.5551 3.5792 3.5870 3.6228 3.6383 3.6558 3.6730 3.9948 3.9991 4.0748 4.0878 4.7065 4.7265 4.8464 4.8562 5.3306 5.3356 5.3855 5.3907 11.3319 11.3349 11.6740 11.6761 12.7176 12.7224 13.3367 13.3432 k = 0.0000 0.9681 0.2615 ( 3030 PWs) bands (ev): -14.1909 -14.1908 -13.8113 -13.8112 -13.4686 -13.4686 -13.4585 -13.4585 -2.3091 -2.3086 -1.8593 -1.8583 -1.7374 -1.7366 -1.1039 -1.1036 -0.4717 -0.4716 -0.2744 -0.2734 0.6782 0.6803 0.8493 0.8504 1.5542 1.5583 1.6019 1.6048 1.8833 1.8838 2.2588 2.2602 3.5504 3.5577 3.5816 3.5898 3.6232 3.6395 3.6560 3.6728 3.9984 4.0017 4.0743 4.0868 4.7353 4.7556 4.8692 4.8804 5.3343 5.3399 5.3874 5.3931 11.3042 11.3073 11.6454 11.6476 12.7670 12.7718 13.3832 13.3898 k = 0.0000 0.9681 0.2789 ( 3022 PWs) bands (ev): -14.1810 -14.1810 -13.8215 -13.8215 -13.4682 -13.4682 -13.4590 -13.4589 -2.2927 -2.2922 -1.8670 -1.8660 -1.7270 -1.7261 -1.1288 -1.1285 -0.4683 -0.4681 -0.2833 -0.2823 0.6811 0.6832 0.8410 0.8422 1.5527 1.5567 1.6034 1.6066 1.8839 1.8843 2.2390 2.2405 3.5546 3.5605 3.5841 3.5925 3.6237 3.6406 3.6562 3.6724 4.0021 4.0044 4.0735 4.0856 4.7642 4.7848 4.8918 4.9044 5.3383 5.3446 5.3893 5.3956 11.2785 11.2816 11.6157 11.6180 12.8189 12.8235 13.4288 13.4354 k = 0.0000 0.9681 0.2963 ( 3026 PWs) bands (ev): -14.1706 -14.1706 -13.8323 -13.8323 -13.4679 -13.4679 -13.4594 -13.4594 -2.2757 -2.2752 -1.8753 -1.8742 -1.7158 -1.7149 -1.1544 -1.1542 -0.4647 -0.4645 -0.2922 -0.2913 0.6841 0.6863 0.8327 0.8339 1.5517 1.5557 1.6043 1.6079 1.8850 1.8852 2.2191 2.2205 3.5589 3.5634 3.5865 3.5950 3.6242 3.6416 3.6563 3.6718 4.0057 4.0070 4.0722 4.0839 4.7929 4.8137 4.9139 4.9279 5.3424 5.3494 5.3913 5.3981 11.2552 11.2583 11.5850 11.5875 12.8729 12.8775 13.4732 13.4798 k = 0.0000 0.9681 0.3138 ( 3028 PWs) bands (ev): -14.1597 -14.1597 -13.8436 -13.8436 -13.4676 -13.4676 -13.4599 -13.4599 -2.2582 -2.2576 -1.8842 -1.8831 -1.7038 -1.7030 -1.1807 -1.1804 -0.4609 -0.4607 -0.3012 -0.3002 0.6872 0.6895 0.8244 0.8257 1.5514 1.5554 1.6049 1.6088 1.8868 1.8868 2.1989 2.2004 3.5632 3.5664 3.5889 3.5972 3.6248 3.6425 3.6565 3.6710 4.0093 4.0096 4.0707 4.0820 4.8210 4.8421 4.9351 4.9504 5.3468 5.3545 5.3933 5.4006 11.2343 11.2375 11.5536 11.5562 12.9290 12.9335 13.5161 13.5228 k = 0.0000 0.9681 0.3312 ( 3034 PWs) bands (ev): -14.1484 -14.1484 -13.8554 -13.8554 -13.4673 -13.4672 -13.4603 -13.4603 -2.2402 -2.2396 -1.8937 -1.8925 -1.6910 -1.6902 -1.2073 -1.2071 -0.4569 -0.4566 -0.3101 -0.3091 0.6905 0.6928 0.8161 0.8175 1.5517 1.5558 1.6050 1.6091 1.8890 1.8892 2.1787 2.1802 3.5674 3.5695 3.5912 3.5991 3.6255 3.6434 3.6565 3.6701 4.0121 4.0128 4.0689 4.0799 4.8483 4.8697 4.9551 4.9718 5.3513 5.3598 5.3953 5.4032 11.2161 11.2193 11.5217 11.5244 12.9866 12.9910 13.5577 13.5643 k = 0.0000 0.9681 0.3486 ( 3034 PWs) bands (ev): -14.1367 -14.1367 -13.8675 -13.8675 -13.4669 -13.4669 -13.4607 -13.4607 -2.2219 -2.2212 -1.9038 -1.9026 -1.6775 -1.6766 -1.2343 -1.2341 -0.4526 -0.4524 -0.3189 -0.3180 0.6939 0.6962 0.8080 0.8095 1.5526 1.5568 1.6046 1.6089 1.8920 1.8923 2.1586 2.1600 3.5715 3.5726 3.5935 3.6008 3.6263 3.6444 3.6566 3.6690 4.0147 4.0163 4.0669 4.0776 4.8745 4.8963 4.9737 4.9916 5.3561 5.3654 5.3972 5.4057 11.2008 11.2040 11.4897 11.4925 13.0455 13.0498 13.5977 13.6042 k = 0.0000 0.9681 0.3661 ( 3036 PWs) bands (ev): -14.1246 -14.1246 -13.8801 -13.8801 -13.4666 -13.4666 -13.4611 -13.4611 -2.2034 -2.2026 -1.9145 -1.9133 -1.6631 -1.6623 -1.2614 -1.2613 -0.4482 -0.4479 -0.3276 -0.3267 0.6975 0.6998 0.8001 0.8016 1.5541 1.5584 1.6038 1.6083 1.8959 1.8964 2.1385 2.1400 3.5754 3.5758 3.5956 3.6022 3.6273 3.6452 3.6566 3.6677 4.0173 4.0197 4.0648 4.0751 4.8994 4.9216 4.9905 5.0096 5.3610 5.3710 5.3991 5.4081 11.1885 11.1918 11.4577 11.4606 13.1053 13.1095 13.6359 13.6411 k = 0.0000 0.9681 0.3835 ( 3036 PWs) bands (ev): -14.1121 -14.1121 -13.8930 -13.8930 -13.4663 -13.4662 -13.4615 -13.4615 -2.1846 -2.1838 -1.9259 -1.9246 -1.6478 -1.6470 -1.2885 -1.2885 -0.4435 -0.4432 -0.3361 -0.3353 0.7012 0.7036 0.7923 0.7939 1.5561 1.5605 1.6026 1.6072 1.9007 1.9014 2.1187 2.1201 3.5789 3.5791 3.5974 3.6033 3.6286 3.6461 3.6565 3.6662 4.0199 4.0231 4.0624 4.0725 4.9229 4.9455 5.0053 5.0255 5.3660 5.3767 5.4007 5.4103 11.1792 11.1826 11.4261 11.4291 13.1655 13.1696 13.6558 13.6560 k = 0.0000 0.9681 0.4009 ( 3042 PWs) bands (ev): -14.0993 -14.0993 -13.9062 -13.9061 -13.4659 -13.4659 -13.4618 -13.4618 -2.1658 -2.1650 -1.9378 -1.9366 -1.6316 -1.6309 -1.3156 -1.3156 -0.4386 -0.4383 -0.3445 -0.3437 0.7051 0.7075 0.7847 0.7864 1.5586 1.5630 1.6010 1.6057 1.9066 1.9073 2.0991 2.1006 3.5820 3.5825 3.5989 3.6040 3.6302 3.6470 3.6563 3.6646 4.0224 4.0265 4.0599 4.0698 4.9446 4.9676 5.0179 5.0391 5.3710 5.3825 5.4022 5.4123 11.1732 11.1766 11.3952 11.3982 13.2255 13.2296 13.6630 13.6633 k = 0.0000 0.9681 0.4184 ( 3038 PWs) bands (ev): -14.0862 -14.0862 -13.9196 -13.9196 -13.4656 -13.4656 -13.4621 -13.4621 -2.1470 -2.1461 -1.9505 -1.9492 -1.6146 -1.6139 -1.3424 -1.3424 -0.4335 -0.4331 -0.3528 -0.3520 0.7092 0.7116 0.7773 0.7791 1.5614 1.5659 1.5991 1.6039 1.9135 1.9143 2.0800 2.0814 3.5850 3.5857 3.6000 3.6044 3.6321 3.6479 3.6560 3.6627 4.0250 4.0298 4.0574 4.0670 4.9646 4.9879 5.0282 5.0504 5.3762 5.3881 5.4033 5.4140 11.1704 11.1738 11.3652 11.3683 13.2849 13.2889 13.6668 13.6673 k = 0.0000 0.9681 0.4358 ( 3040 PWs) bands (ev): -14.0729 -14.0729 -13.9333 -13.9333 -13.4653 -13.4653 -13.4624 -13.4624 -2.1284 -2.1274 -1.9638 -1.9625 -1.5966 -1.5959 -1.3689 -1.3688 -0.4281 -0.4277 -0.3608 -0.3600 0.7135 0.7158 0.7702 0.7721 1.5646 1.5691 1.5969 1.6017 1.9215 1.9225 2.0613 2.0628 3.5879 3.5886 3.6007 3.6044 3.6343 3.6488 3.6557 3.6607 4.0277 4.0331 4.0548 4.0641 4.9825 5.0062 5.0362 5.0591 5.3811 5.3935 5.4041 5.4153 11.1709 11.1743 11.3364 11.3395 13.3428 13.3467 13.6664 13.6672 k = 0.0000 0.9681 0.4532 ( 3040 PWs) bands (ev): -14.0593 -14.0593 -13.9471 -13.9471 -13.4650 -13.4650 -13.4627 -13.4627 -2.1099 -2.1089 -1.9777 -1.9764 -1.5777 -1.5771 -1.3950 -1.3948 -0.4225 -0.4221 -0.3686 -0.3679 0.7180 0.7203 0.7633 0.7653 1.5679 1.5726 1.5943 1.5992 1.9307 1.9318 2.0433 2.0447 3.5907 3.5912 3.6010 3.6041 3.6367 3.6497 3.6553 3.6584 4.0303 4.0363 4.0521 4.0612 4.9983 5.0223 5.0417 5.0652 5.3857 5.3985 5.4044 5.4161 11.1746 11.1780 11.3091 11.3123 13.3985 13.4022 13.6613 13.6625 k = 0.0000 0.9681 0.4707 ( 3040 PWs) bands (ev): -14.0455 -14.0455 -13.9611 -13.9611 -13.4647 -13.4647 -13.4630 -13.4630 -2.0917 -2.0907 -1.9922 -1.9910 -1.5579 -1.5573 -1.4205 -1.4203 -0.4166 -0.4162 -0.3762 -0.3755 0.7228 0.7251 0.7567 0.7587 1.5714 1.5761 1.5915 1.5964 1.9410 1.9422 2.0259 2.0273 3.5933 3.5936 3.6010 3.6034 3.6394 3.6506 3.6549 3.6560 4.0330 4.0395 4.0494 4.0582 5.0120 5.0362 5.0447 5.0687 5.3901 5.4030 5.4042 5.4163 11.1815 11.1849 11.2836 11.2869 13.4510 13.4546 13.6507 13.6522 k = 0.0000 0.9681 0.4881 ( 3038 PWs) bands (ev): -14.0316 -14.0316 -13.9752 -13.9752 -13.4644 -13.4644 -13.4633 -13.4633 -2.0739 -2.0728 -2.0074 -2.0062 -1.5371 -1.5366 -1.4454 -1.4451 -0.4105 -0.4100 -0.3836 -0.3829 0.7278 0.7300 0.7504 0.7524 1.5749 1.5797 1.5885 1.5934 1.9526 1.9538 2.0094 2.0107 3.5956 3.5956 3.6006 3.6025 3.6422 3.6514 3.6535 3.6543 4.0357 4.0427 4.0466 4.0552 5.0234 5.0453 5.0478 5.0696 5.3939 5.4034 5.4070 5.4159 11.1915 11.1949 11.2602 11.2635 13.4994 13.5027 13.6338 13.6357 k = 0.0000 0.9681 0.5055 ( 3038 PWs) bands (ev): -14.0176 -14.0175 -13.9893 -13.9893 -13.4642 -13.4641 -13.4636 -13.4636 -2.0565 -2.0554 -2.0232 -2.0221 -1.5155 -1.5150 -1.4695 -1.4692 -0.4042 -0.4036 -0.3907 -0.3901 0.7330 0.7352 0.7443 0.7464 1.5785 1.5833 1.5853 1.5902 1.9652 1.9664 1.9937 1.9950 3.5973 3.5978 3.5998 3.6012 3.6451 3.6508 3.6522 3.6537 4.0384 4.0438 4.0458 4.0521 5.0325 5.0435 5.0570 5.0680 5.3972 5.4020 5.4103 5.4147 11.2046 11.2079 11.2391 11.2424 13.5426 13.5457 13.6102 13.6126 k = 0.0000 0.9681 0.5229 ( 3036 PWs) bands (ev): -14.0035 -14.0035 -14.0034 -14.0034 -13.4639 -13.4639 -13.4639 -13.4639 -2.0396 -2.0396 -2.0385 -2.0385 -1.4929 -1.4929 -1.4925 -1.4925 -0.3975 -0.3975 -0.3970 -0.3970 0.7385 0.7385 0.7407 0.7407 1.5820 1.5820 1.5868 1.5868 1.9789 1.9789 1.9802 1.9802 3.5987 3.5987 3.5996 3.5996 3.6480 3.6480 3.6530 3.6530 4.0411 4.0411 4.0490 4.0490 5.0392 5.0392 5.0638 5.0638 5.3999 5.3999 5.4129 5.4129 11.2205 11.2205 11.2238 11.2238 13.5798 13.5798 13.5825 13.5825 k = 0.0000 0.9681 0.5229 ( 3036 PWs) bands (ev): -14.0035 -14.0035 -14.0034 -14.0034 -13.4639 -13.4639 -13.4639 -13.4639 -2.0396 -2.0396 -2.0385 -2.0385 -1.4929 -1.4929 -1.4925 -1.4925 -0.3975 -0.3975 -0.3970 -0.3970 0.7385 0.7385 0.7407 0.7407 1.5820 1.5820 1.5868 1.5868 1.9789 1.9789 1.9802 1.9802 3.5987 3.5987 3.5996 3.5996 3.6480 3.6480 3.6530 3.6530 4.0411 4.0411 4.0490 4.0490 5.0392 5.0392 5.0638 5.0638 5.3999 5.3999 5.4129 5.4129 11.2205 11.2205 11.2238 11.2238 13.5798 13.5798 13.5825 13.5825 k = 0.0168 0.9681 0.5229 ( 3036 PWs) bands (ev): -14.0034 -14.0034 -14.0034 -14.0034 -13.4640 -13.4640 -13.4639 -13.4639 -2.0399 -2.0399 -2.0387 -2.0387 -1.4927 -1.4927 -1.4922 -1.4922 -0.3977 -0.3977 -0.3971 -0.3971 0.7388 0.7388 0.7411 0.7411 1.5822 1.5822 1.5871 1.5871 1.9785 1.9785 1.9803 1.9803 3.5986 3.5986 3.5998 3.5998 3.6480 3.6480 3.6531 3.6531 4.0412 4.0412 4.0491 4.0491 5.0391 5.0391 5.0637 5.0637 5.3995 5.3995 5.4125 5.4125 11.2208 11.2208 11.2242 11.2242 13.5780 13.5780 13.5810 13.5810 k = 0.0337 0.9681 0.5229 ( 3032 PWs) bands (ev): -14.0034 -14.0034 -14.0033 -14.0033 -13.4642 -13.4642 -13.4641 -13.4641 -2.0406 -2.0406 -2.0393 -2.0393 -1.4921 -1.4921 -1.4913 -1.4913 -0.3984 -0.3984 -0.3976 -0.3976 0.7397 0.7397 0.7423 0.7423 1.5830 1.5830 1.5881 1.5881 1.9775 1.9775 1.9803 1.9803 3.5985 3.5985 3.6003 3.6003 3.6480 3.6480 3.6533 3.6533 4.0414 4.0414 4.0495 4.0495 5.0387 5.0387 5.0635 5.0635 5.3980 5.3980 5.4112 5.4112 11.2217 11.2217 11.2252 11.2252 13.5727 13.5727 13.5764 13.5764 k = 0.0505 0.9681 0.5229 ( 3034 PWs) bands (ev): -14.0033 -14.0033 -14.0032 -14.0032 -13.4645 -13.4645 -13.4644 -13.4644 -2.0418 -2.0418 -2.0403 -2.0403 -1.4911 -1.4911 -1.4900 -1.4900 -0.3993 -0.3993 -0.3983 -0.3983 0.7413 0.7413 0.7442 0.7442 1.5842 1.5842 1.5896 1.5896 1.9761 1.9761 1.9801 1.9801 3.5984 3.5984 3.6009 3.6009 3.6479 3.6479 3.6536 3.6536 4.0417 4.0417 4.0501 4.0501 5.0382 5.0382 5.0632 5.0632 5.3956 5.3956 5.4090 5.4090 11.2232 11.2232 11.2268 11.2268 13.5643 13.5643 13.5687 13.5687 k = 0.0673 0.9681 0.5229 ( 3030 PWs) bands (ev): -14.0032 -14.0032 -14.0030 -14.0030 -13.4650 -13.4650 -13.4648 -13.4648 -2.0434 -2.0434 -2.0417 -2.0417 -1.4897 -1.4897 -1.4884 -1.4884 -0.4005 -0.4005 -0.3993 -0.3993 0.7434 0.7434 0.7468 0.7468 1.5859 1.5859 1.5916 1.5916 1.9745 1.9745 1.9796 1.9796 3.5984 3.5984 3.6016 3.6016 3.6479 3.6479 3.6541 3.6541 4.0422 4.0422 4.0509 4.0509 5.0374 5.0374 5.0628 5.0628 5.3924 5.3924 5.4060 5.4060 11.2253 11.2253 11.2291 11.2291 13.5528 13.5528 13.5581 13.5581 k = 0.0842 0.9681 0.5229 ( 3034 PWs) bands (ev): -14.0030 -14.0030 -14.0028 -14.0028 -13.4656 -13.4656 -13.4654 -13.4654 -2.0453 -2.0453 -2.0435 -2.0435 -1.4881 -1.4881 -1.4865 -1.4865 -0.4019 -0.4019 -0.4005 -0.4005 0.7460 0.7460 0.7500 0.7500 1.5880 1.5880 1.5941 1.5941 1.9726 1.9726 1.9789 1.9789 3.5985 3.5985 3.6025 3.6025 3.6479 3.6479 3.6546 3.6546 4.0428 4.0428 4.0519 4.0519 5.0364 5.0364 5.0622 5.0622 5.3884 5.3884 5.4023 5.4023 11.2280 11.2280 11.2320 11.2320 13.5387 13.5387 13.5448 13.5448 k = 0.1010 0.9681 0.5229 ( 3028 PWs) bands (ev): -14.0028 -14.0028 -14.0026 -14.0026 -13.4663 -13.4663 -13.4660 -13.4660 -2.0475 -2.0475 -2.0454 -2.0454 -1.4863 -1.4863 -1.4844 -1.4844 -0.4033 -0.4033 -0.4016 -0.4016 0.7492 0.7492 0.7536 0.7536 1.5904 1.5904 1.5970 1.5970 1.9706 1.9706 1.9781 1.9781 3.5986 3.5986 3.6035 3.6035 3.6480 3.6480 3.6552 3.6552 4.0435 4.0435 4.0530 4.0530 5.0351 5.0351 5.0615 5.0615 5.3837 5.3837 5.3980 5.3980 11.2312 11.2312 11.2355 11.2355 13.5222 13.5222 13.5290 13.5290 k = 0.1178 0.9681 0.5229 ( 3024 PWs) bands (ev): -14.0027 -14.0027 -14.0024 -14.0024 -13.4671 -13.4671 -13.4668 -13.4668 -2.0498 -2.0498 -2.0476 -2.0476 -1.4845 -1.4845 -1.4824 -1.4824 -0.4046 -0.4046 -0.4028 -0.4028 0.7527 0.7527 0.7577 0.7577 1.5930 1.5930 1.6001 1.6001 1.9686 1.9686 1.9772 1.9772 3.5988 3.5988 3.6046 3.6046 3.6481 3.6481 3.6559 3.6559 4.0443 4.0443 4.0543 4.0543 5.0336 5.0336 5.0606 5.0606 5.3783 5.3783 5.3931 5.3931 11.2350 11.2350 11.2395 11.2395 13.5038 13.5038 13.5111 13.5111 k = 0.1347 0.9681 0.5229 ( 3022 PWs) bands (ev): -14.0025 -14.0025 -14.0022 -14.0022 -13.4680 -13.4680 -13.4677 -13.4677 -2.0522 -2.0522 -2.0498 -2.0498 -1.4828 -1.4828 -1.4805 -1.4805 -0.4057 -0.4057 -0.4037 -0.4037 0.7566 0.7566 0.7620 0.7620 1.5957 1.5957 1.6033 1.6033 1.9666 1.9666 1.9763 1.9763 3.5990 3.5990 3.6058 3.6058 3.6483 3.6483 3.6567 3.6567 4.0452 4.0452 4.0557 4.0557 5.0318 5.0318 5.0594 5.0594 5.3726 5.3726 5.3878 5.3878 11.2393 11.2393 11.2439 11.2439 13.4838 13.4838 13.4916 13.4916 k = 0.1515 0.9681 0.5229 ( 3022 PWs) bands (ev): -14.0023 -14.0023 -14.0019 -14.0019 -13.4690 -13.4690 -13.4686 -13.4686 -2.0546 -2.0546 -2.0521 -2.0521 -1.4813 -1.4813 -1.4789 -1.4789 -0.4064 -0.4064 -0.4043 -0.4043 0.7607 0.7607 0.7665 0.7665 1.5984 1.5984 1.6066 1.6066 1.9647 1.9647 1.9755 1.9755 3.5992 3.5992 3.6070 3.6070 3.6486 3.6486 3.6575 3.6575 4.0461 4.0461 4.0571 4.0571 5.0298 5.0298 5.0581 5.0581 5.3665 5.3665 5.3823 5.3823 11.2439 11.2439 11.2488 11.2488 13.4627 13.4627 13.4708 13.4708 k = 0.1683 0.9681 0.5229 ( 3018 PWs) bands (ev): -14.0021 -14.0021 -14.0017 -14.0017 -13.4700 -13.4700 -13.4696 -13.4696 -2.0570 -2.0570 -2.0542 -2.0542 -1.4802 -1.4802 -1.4776 -1.4776 -0.4067 -0.4067 -0.4044 -0.4044 0.7649 0.7649 0.7711 0.7711 1.6010 1.6010 1.6096 1.6096 1.9631 1.9631 1.9749 1.9749 3.5995 3.5995 3.6084 3.6084 3.6490 3.6490 3.6584 3.6584 4.0471 4.0471 4.0585 4.0585 5.0275 5.0275 5.0565 5.0565 5.3602 5.3602 5.3765 5.3765 11.2490 11.2490 11.2541 11.2541 13.4409 13.4409 13.4493 13.4493 k = 0.1852 0.9681 0.5229 ( 3016 PWs) bands (ev): -14.0020 -14.0020 -14.0016 -14.0016 -13.4711 -13.4711 -13.4706 -13.4706 -2.0592 -2.0592 -2.0563 -2.0563 -1.4795 -1.4795 -1.4768 -1.4768 -0.4064 -0.4064 -0.4040 -0.4040 0.7691 0.7691 0.7757 0.7757 1.6033 1.6033 1.6124 1.6124 1.9618 1.9618 1.9745 1.9745 3.5997 3.5997 3.6097 3.6097 3.6495 3.6495 3.6593 3.6593 4.0480 4.0480 4.0599 4.0599 5.0249 5.0249 5.0547 5.0547 5.3540 5.3540 5.3708 5.3708 11.2543 11.2543 11.2595 11.2595 13.4188 13.4188 13.4274 13.4274 k = 0.2020 0.9681 0.5229 ( 3016 PWs) bands (ev): -14.0019 -14.0019 -14.0015 -14.0015 -13.4722 -13.4722 -13.4716 -13.4716 -2.0612 -2.0612 -2.0582 -2.0582 -1.4794 -1.4794 -1.4766 -1.4766 -0.4054 -0.4054 -0.4029 -0.4029 0.7733 0.7733 0.7801 0.7801 1.6053 1.6053 1.6149 1.6149 1.9610 1.9610 1.9745 1.9745 3.5999 3.5999 3.6110 3.6110 3.6501 3.6501 3.6603 3.6603 4.0489 4.0489 4.0612 4.0612 5.0222 5.0222 5.0526 5.0526 5.3479 5.3479 5.3652 5.3652 11.2598 11.2598 11.2652 11.2652 13.3969 13.3969 13.4055 13.4055 k = 0.2188 0.9681 0.5229 ( 3018 PWs) bands (ev): -14.0019 -14.0019 -14.0014 -14.0014 -13.4733 -13.4733 -13.4727 -13.4727 -2.0630 -2.0630 -2.0599 -2.0599 -1.4798 -1.4798 -1.4769 -1.4769 -0.4037 -0.4037 -0.4011 -0.4011 0.7772 0.7772 0.7843 0.7843 1.6068 1.6068 1.6168 1.6168 1.9606 1.9606 1.9748 1.9748 3.6000 3.6000 3.6123 3.6123 3.6508 3.6508 3.6613 3.6613 4.0497 4.0497 4.0623 4.0623 5.0192 5.0192 5.0504 5.0504 5.3421 5.3421 5.3598 5.3598 11.2653 11.2653 11.2708 11.2708 13.3754 13.3754 13.3841 13.3841 k = 0.2357 0.9681 0.5229 ( 3024 PWs) bands (ev): -14.0020 -14.0020 -14.0015 -14.0015 -13.4744 -13.4744 -13.4738 -13.4738 -2.0645 -2.0645 -2.0614 -2.0614 -1.4808 -1.4808 -1.4779 -1.4779 -0.4013 -0.4013 -0.3985 -0.3985 0.7809 0.7809 0.7882 0.7882 1.6078 1.6078 1.6181 1.6181 1.9608 1.9608 1.9756 1.9756 3.6001 3.6001 3.6135 3.6135 3.6515 3.6515 3.6624 3.6624 4.0504 4.0504 4.0633 4.0633 5.0162 5.0162 5.0479 5.0479 5.3368 5.3368 5.3548 5.3548 11.2708 11.2708 11.2764 11.2764 13.3549 13.3549 13.3635 13.3635 k = 0.2525 0.9681 0.5229 ( 3026 PWs) bands (ev): -14.0022 -14.0022 -14.0017 -14.0017 -13.4754 -13.4754 -13.4748 -13.4748 -2.0658 -2.0658 -2.0626 -2.0626 -1.4823 -1.4823 -1.4794 -1.4794 -0.3980 -0.3980 -0.3951 -0.3951 0.7842 0.7842 0.7917 0.7917 1.6082 1.6082 1.6187 1.6187 1.9615 1.9615 1.9768 1.9768 3.6003 3.6003 3.6148 3.6148 3.6525 3.6525 3.6635 3.6635 4.0509 4.0509 4.0641 4.0641 5.0130 5.0130 5.0454 5.0454 5.3320 5.3320 5.3503 5.3503 11.2761 11.2761 11.2818 11.2818 13.3355 13.3355 13.3441 13.3441 k = 0.2694 0.9681 0.5229 ( 3026 PWs) bands (ev): -14.0025 -14.0025 -14.0019 -14.0019 -13.4764 -13.4764 -13.4757 -13.4757 -2.0668 -2.0668 -2.0636 -2.0636 -1.4843 -1.4843 -1.4814 -1.4814 -0.3939 -0.3939 -0.3910 -0.3910 0.7871 0.7871 0.7947 0.7947 1.6081 1.6081 1.6187 1.6187 1.9627 1.9627 1.9784 1.9784 3.6004 3.6004 3.6160 3.6160 3.6536 3.6536 3.6647 3.6647 4.0513 4.0513 4.0647 4.0647 5.0099 5.0099 5.0428 5.0428 5.3279 5.3279 5.3464 5.3464 11.2811 11.2811 11.2867 11.2867 13.3176 13.3176 13.3262 13.3262 k = 0.2694 0.9681 0.5229 ( 3026 PWs) bands (ev): -14.0025 -14.0025 -14.0019 -14.0019 -13.4764 -13.4764 -13.4757 -13.4757 -2.0668 -2.0668 -2.0636 -2.0636 -1.4843 -1.4843 -1.4814 -1.4814 -0.3939 -0.3939 -0.3910 -0.3910 0.7871 0.7871 0.7947 0.7947 1.6081 1.6081 1.6187 1.6187 1.9627 1.9627 1.9784 1.9784 3.6004 3.6004 3.6160 3.6160 3.6536 3.6536 3.6647 3.6647 4.0513 4.0513 4.0647 4.0647 5.0099 5.0099 5.0428 5.0428 5.3279 5.3279 5.3464 5.3464 11.2811 11.2811 11.2867 11.2867 13.3176 13.3176 13.3262 13.3262 k = 0.2647 0.9515 0.5229 ( 3030 PWs) bands (ev): -14.0015 -14.0015 -14.0010 -14.0010 -13.4729 -13.4729 -13.4723 -13.4723 -2.0640 -2.0640 -2.0608 -2.0608 -1.4754 -1.4754 -1.4724 -1.4724 -0.4096 -0.4096 -0.4069 -0.4069 0.7768 0.7768 0.7841 0.7841 1.6094 1.6094 1.6196 1.6196 1.9575 1.9575 1.9720 1.9720 3.6002 3.6002 3.6115 3.6115 3.6500 3.6500 3.6605 3.6605 4.0501 4.0501 4.0627 4.0627 5.0211 5.0211 5.0524 5.0524 5.3424 5.3424 5.3604 5.3604 11.2628 11.2628 11.2685 11.2685 13.3834 13.3834 13.3923 13.3923 k = 0.2601 0.9348 0.5229 ( 3026 PWs) bands (ev): -14.0012 -14.0012 -14.0009 -14.0009 -13.4697 -13.4697 -13.4693 -13.4693 -2.0625 -2.0625 -2.0594 -2.0594 -1.4656 -1.4656 -1.4625 -1.4625 -0.4223 -0.4223 -0.4198 -0.4198 0.7660 0.7660 0.7731 0.7731 1.6102 1.6102 1.6199 1.6199 1.9530 1.9530 1.9661 1.9661 3.6003 3.6003 3.6071 3.6071 3.6477 3.6477 3.6575 3.6575 4.0484 4.0484 4.0601 4.0601 5.0315 5.0315 5.0612 5.0612 5.3579 5.3579 5.3751 5.3751 11.2444 11.2444 11.2501 11.2501 13.4499 13.4499 13.4590 13.4590 k = 0.2554 0.9181 0.5229 ( 3026 PWs) bands (ev): -14.0018 -14.0018 -14.0016 -14.0016 -13.4668 -13.4668 -13.4666 -13.4666 -2.0625 -2.0625 -2.0595 -2.0595 -1.4551 -1.4551 -1.4519 -1.4519 -0.4319 -0.4319 -0.4297 -0.4297 0.7550 0.7550 0.7618 0.7618 1.6104 1.6104 1.6196 1.6196 1.9492 1.9492 1.9608 1.9608 3.6003 3.6003 3.6035 3.6035 3.6466 3.6466 3.6557 3.6557 4.0462 4.0462 4.0572 4.0572 5.0408 5.0408 5.0692 5.0692 5.3738 5.3738 5.3904 5.3904 11.2259 11.2259 11.2317 11.2317 13.5168 13.5168 13.5263 13.5263 k = 0.2508 0.9014 0.5229 ( 3026 PWs) bands (ev): -14.0032 -14.0032 -14.0031 -14.0031 -13.4643 -13.4643 -13.4642 -13.4642 -2.0641 -2.0641 -2.0611 -2.0611 -1.4439 -1.4439 -1.4406 -1.4406 -0.4383 -0.4383 -0.4363 -0.4363 0.7438 0.7438 0.7503 0.7503 1.6102 1.6102 1.6188 1.6188 1.9458 1.9458 1.9559 1.9559 3.5983 3.5983 3.6026 3.6026 3.6466 3.6466 3.6550 3.6550 4.0435 4.0435 4.0538 4.0538 5.0490 5.0490 5.0762 5.0762 5.3902 5.3902 5.4061 5.4061 11.2074 11.2074 11.2133 11.2133 13.5841 13.5841 13.5938 13.5938 k = 0.2461 0.8847 0.5229 ( 3012 PWs) bands (ev): -14.0054 -14.0054 -14.0053 -14.0053 -13.4621 -13.4621 -13.4621 -13.4621 -2.0672 -2.0672 -2.0644 -2.0644 -1.4319 -1.4319 -1.4286 -1.4286 -0.4414 -0.4414 -0.4395 -0.4395 0.7326 0.7326 0.7388 0.7388 1.6096 1.6096 1.6178 1.6178 1.9429 1.9429 1.9515 1.9515 3.5956 3.5956 3.6036 3.6036 3.6477 3.6477 3.6554 3.6554 4.0403 4.0403 4.0502 4.0502 5.0563 5.0563 5.0825 5.0825 5.4069 5.4069 5.4222 5.4222 11.1889 11.1889 11.1948 11.1948 13.6510 13.6510 13.6610 13.6610 k = 0.2415 0.8680 0.5229 ( 3012 PWs) bands (ev): -14.0085 -14.0085 -14.0083 -14.0083 -13.4604 -13.4604 -13.4602 -13.4602 -2.0722 -2.0722 -2.0695 -2.0695 -1.4194 -1.4194 -1.4160 -1.4160 -0.4411 -0.4411 -0.4394 -0.4394 0.7213 0.7213 0.7273 0.7273 1.6087 1.6087 1.6165 1.6165 1.9403 1.9403 1.9474 1.9474 3.5934 3.5934 3.6050 3.6050 3.6496 3.6496 3.6565 3.6565 4.0366 4.0366 4.0462 4.0462 5.0626 5.0626 5.0879 5.0879 5.4236 5.4236 5.4383 5.4383 11.1704 11.1704 11.1762 11.1762 13.7146 13.7146 13.7240 13.7240 k = 0.2368 0.8513 0.5229 ( 3016 PWs) bands (ev): -14.0125 -14.0125 -14.0122 -14.0122 -13.4590 -13.4590 -13.4586 -13.4586 -2.0790 -2.0790 -2.0763 -2.0763 -1.4064 -1.4064 -1.4028 -1.4028 -0.4374 -0.4374 -0.4357 -0.4357 0.7101 0.7101 0.7160 0.7160 1.6076 1.6076 1.6152 1.6152 1.9380 1.9380 1.9436 1.9436 3.5920 3.5920 3.6068 3.6068 3.6524 3.6524 3.6585 3.6585 4.0324 4.0324 4.0419 4.0419 5.0678 5.0678 5.0925 5.0925 5.4402 5.4402 5.4544 5.4544 11.1516 11.1516 11.1575 11.1575 13.7534 13.7534 13.7561 13.7561 k = 0.2322 0.8346 0.5229 ( 3014 PWs) bands (ev): -14.0173 -14.0173 -14.0168 -14.0168 -13.4578 -13.4578 -13.4573 -13.4573 -2.0876 -2.0876 -2.0851 -2.0851 -1.3928 -1.3928 -1.3892 -1.3892 -0.4300 -0.4300 -0.4284 -0.4284 0.6992 0.6992 0.7049 0.7049 1.6064 1.6064 1.6139 1.6139 1.9358 1.9358 1.9402 1.9402 3.5914 3.5914 3.6091 3.6091 3.6561 3.6561 3.6610 3.6610 4.0276 4.0276 4.0375 4.0375 5.0722 5.0722 5.0964 5.0964 5.4565 5.4565 5.4704 5.4704 11.1327 11.1327 11.1386 11.1386 13.7418 13.7418 13.7449 13.7449 k = 0.2276 0.8179 0.5229 ( 3014 PWs) bands (ev): -14.0228 -14.0228 -14.0223 -14.0223 -13.4570 -13.4570 -13.4564 -13.4564 -2.0982 -2.0982 -2.0958 -2.0958 -1.3788 -1.3788 -1.3752 -1.3752 -0.4190 -0.4190 -0.4175 -0.4175 0.6885 0.6885 0.6942 0.6942 1.6051 1.6051 1.6127 1.6127 1.9336 1.9336 1.9372 1.9372 3.5916 3.5916 3.6117 3.6117 3.6607 3.6607 3.6640 3.6640 4.0223 4.0223 4.0330 4.0330 5.0758 5.0758 5.0996 5.0996 5.4725 5.4725 5.4861 5.4861 11.1135 11.1135 11.1195 11.1195 13.7209 13.7209 13.7248 13.7248 k = 0.2229 0.8012 0.5229 ( 3018 PWs) bands (ev): -14.0292 -14.0292 -14.0285 -14.0285 -13.4564 -13.4564 -13.4556 -13.4556 -2.1108 -2.1108 -2.1085 -2.1085 -1.3645 -1.3645 -1.3608 -1.3608 -0.4043 -0.4043 -0.4029 -0.4029 0.6781 0.6781 0.6838 0.6838 1.6038 1.6038 1.6118 1.6118 1.9312 1.9312 1.9346 1.9346 3.5926 3.5926 3.6149 3.6149 3.6659 3.6659 3.6675 3.6675 4.0166 4.0166 4.0283 4.0283 5.0786 5.0786 5.1022 5.1022 5.4880 5.4880 5.5014 5.5014 11.0940 11.0940 11.0999 11.0999 13.7003 13.7003 13.7044 13.7044 k = 0.2183 0.7845 0.5229 ( 3022 PWs) bands (ev): -14.0364 -14.0364 -14.0356 -14.0356 -13.4561 -13.4561 -13.4552 -13.4552 -2.1252 -2.1252 -2.1231 -2.1231 -1.3499 -1.3499 -1.3461 -1.3461 -0.3860 -0.3860 -0.3846 -0.3846 0.6682 0.6682 0.6738 0.6738 1.6027 1.6027 1.6112 1.6112 1.9285 1.9285 1.9326 1.9326 3.5943 3.5943 3.6185 3.6185 3.6706 3.6706 3.6724 3.6724 4.0105 4.0105 4.0235 4.0235 5.0807 5.0807 5.1042 5.1042 5.5029 5.5029 5.5162 5.5162 11.0739 11.0739 11.0798 11.0798 13.6811 13.6811 13.6853 13.6853 k = 0.2136 0.7678 0.5229 ( 3026 PWs) bands (ev): -14.0443 -14.0443 -14.0435 -14.0435 -13.4560 -13.4560 -13.4550 -13.4550 -2.1416 -2.1416 -2.1396 -2.1396 -1.3350 -1.3350 -1.3311 -1.3311 -0.3640 -0.3640 -0.3627 -0.3627 0.6587 0.6587 0.6644 0.6644 1.6018 1.6018 1.6109 1.6109 1.9258 1.9258 1.9309 1.9309 3.5968 3.5968 3.6227 3.6227 3.6745 3.6745 3.6790 3.6790 4.0039 4.0039 4.0187 4.0187 5.0821 5.0821 5.1056 5.1056 5.5172 5.5172 5.5304 5.5304 11.0531 11.0531 11.0591 11.0591 13.6635 13.6635 13.6678 13.6678 k = 0.2090 0.7511 0.5229 ( 3022 PWs) bands (ev): -14.0530 -14.0530 -14.0520 -14.0520 -13.4562 -13.4562 -13.4551 -13.4551 -2.1599 -2.1599 -2.1580 -2.1580 -1.3200 -1.3200 -1.3160 -1.3160 -0.3384 -0.3384 -0.3370 -0.3370 0.6497 0.6497 0.6555 0.6555 1.6011 1.6011 1.6110 1.6110 1.9231 1.9231 1.9295 1.9295 3.5998 3.5998 3.6274 3.6274 3.6784 3.6784 3.6863 3.6863 3.9972 3.9972 4.0138 4.0138 5.0830 5.0830 5.1066 5.1066 5.5308 5.5308 5.5440 5.5440 11.0316 11.0316 11.0376 11.0376 13.6476 13.6476 13.6519 13.6519 k = 0.2043 0.7345 0.5229 ( 3026 PWs) bands (ev): -14.0624 -14.0624 -14.0613 -14.0613 -13.4566 -13.4566 -13.4554 -13.4554 -2.1799 -2.1799 -2.1781 -2.1781 -1.3048 -1.3048 -1.3009 -1.3009 -0.3091 -0.3091 -0.3078 -0.3078 0.6412 0.6412 0.6471 0.6471 1.6008 1.6008 1.6115 1.6115 1.9206 1.9206 1.9283 1.9283 3.6034 3.6034 3.6326 3.6326 3.6823 3.6823 3.6942 3.6942 3.9902 3.9902 4.0090 4.0090 5.0833 5.0833 5.1070 5.1070 5.5437 5.5437 5.5570 5.5570 11.0092 11.0092 11.0152 11.0152 13.6333 13.6333 13.6376 13.6376 k = 0.1997 0.7178 0.5229 ( 3026 PWs) bands (ev): -14.0725 -14.0725 -14.0713 -14.0713 -13.4572 -13.4572 -13.4559 -13.4559 -2.2017 -2.2017 -2.2000 -2.2000 -1.2897 -1.2897 -1.2856 -1.2856 -0.2764 -0.2764 -0.2750 -0.2750 0.6333 0.6333 0.6392 0.6392 1.6007 1.6007 1.6123 1.6123 1.9183 1.9183 1.9273 1.9273 3.6075 3.6075 3.6382 3.6382 3.6862 3.6862 3.7027 3.7027 3.9830 3.9830 4.0042 4.0042 5.0831 5.0831 5.1070 5.1070 5.5558 5.5558 5.5693 5.5693 10.9858 10.9858 10.9918 10.9918 13.6202 13.6202 13.6246 13.6246 k = 0.1950 0.7011 0.5229 ( 3018 PWs) bands (ev): -14.0832 -14.0832 -14.0820 -14.0820 -13.4580 -13.4580 -13.4566 -13.4566 -2.2251 -2.2251 -2.2235 -2.2235 -1.2746 -1.2746 -1.2705 -1.2705 -0.2402 -0.2402 -0.2388 -0.2388 0.6260 0.6260 0.6320 0.6320 1.6009 1.6009 1.6134 1.6134 1.9164 1.9164 1.9267 1.9267 3.6118 3.6118 3.6442 3.6442 3.6901 3.6901 3.7118 3.7118 3.9758 3.9758 3.9996 3.9996 5.0825 5.0825 5.1066 5.1066 5.5673 5.5673 5.5809 5.5809 10.9611 10.9611 10.9671 10.9671 13.6080 13.6080 13.6127 13.6127 k = 0.1904 0.6844 0.5229 ( 3020 PWs) bands (ev): -14.0945 -14.0945 -14.0932 -14.0932 -13.4590 -13.4590 -13.4576 -13.4576 -2.2499 -2.2499 -2.2485 -2.2485 -1.2595 -1.2595 -1.2554 -1.2554 -0.2007 -0.2007 -0.1992 -0.1992 0.6192 0.6192 0.6252 0.6252 1.6014 1.6014 1.6148 1.6148 1.9150 1.9150 1.9265 1.9265 3.6162 3.6162 3.6506 3.6506 3.6938 3.6938 3.7213 3.7213 3.9684 3.9684 3.9950 3.9950 5.0814 5.0814 5.1058 5.1058 5.5780 5.5780 5.5918 5.5918 10.9352 10.9352 10.9412 10.9412 13.5965 13.5965 13.6014 13.6014 k = 0.1858 0.6677 0.5229 ( 3020 PWs) bands (ev): -14.1064 -14.1064 -14.1051 -14.1051 -13.4602 -13.4602 -13.4587 -13.4587 -2.2761 -2.2761 -2.2748 -2.2748 -1.2447 -1.2447 -1.2405 -1.2405 -0.1580 -0.1580 -0.1565 -0.1565 0.6129 0.6129 0.6191 0.6191 1.6021 1.6021 1.6164 1.6164 1.9141 1.9141 1.9268 1.9268 3.6207 3.6207 3.6571 3.6571 3.6975 3.6975 3.7313 3.7313 3.9610 3.9610 3.9906 3.9906 5.0800 5.0800 5.1047 5.1047 5.5881 5.5881 5.6021 5.6021 10.9078 10.9078 10.9138 10.9138 13.5850 13.5850 13.5903 13.5903 k = 0.1811 0.6510 0.5229 ( 3020 PWs) bands (ev): -14.1189 -14.1189 -14.1175 -14.1175 -13.4616 -13.4616 -13.4600 -13.4600 -2.3036 -2.3036 -2.3024 -2.3024 -1.2300 -1.2300 -1.2258 -1.2258 -0.1122 -0.1122 -0.1107 -0.1107 0.6072 0.6072 0.6135 0.6135 1.6029 1.6029 1.6181 1.6181 1.9139 1.9139 1.9277 1.9277 3.6251 3.6251 3.6637 3.6637 3.7011 3.7011 3.7417 3.7417 3.9537 3.9537 3.9865 3.9865 5.0782 5.0782 5.1032 5.1032 5.5976 5.5976 5.6118 5.6118 10.8788 10.8788 10.8849 10.8849 13.5729 13.5729 13.5788 13.5788 k = 0.1765 0.6343 0.5229 ( 3016 PWs) bands (ev): -14.1318 -14.1318 -14.1303 -14.1303 -13.4631 -13.4631 -13.4615 -13.4615 -2.3322 -2.3322 -2.3310 -2.3310 -1.2156 -1.2156 -1.2113 -1.2113 -0.0635 -0.0635 -0.0619 -0.0619 0.6021 0.6021 0.6084 0.6084 1.6038 1.6038 1.6198 1.6198 1.9146 1.9146 1.9292 1.9292 3.6294 3.6294 3.6701 3.6701 3.7050 3.7050 3.7524 3.7524 3.9465 3.9465 3.9827 3.9827 5.0762 5.0762 5.1015 5.1015 5.6065 5.6065 5.6209 5.6209 10.8483 10.8483 10.8544 10.8544 13.5594 13.5594 13.5661 13.5661 k = 0.1718 0.6176 0.5229 ( 3020 PWs) bands (ev): -14.1451 -14.1451 -14.1437 -14.1437 -13.4648 -13.4648 -13.4632 -13.4632 -2.3617 -2.3617 -2.3607 -2.3607 -1.2015 -1.2015 -1.1971 -1.1971 -0.0121 -0.0121 -0.0105 -0.0105 0.5975 0.5975 0.6039 0.6039 1.6047 1.6047 1.6214 1.6214 1.9162 1.9162 1.9316 1.9316 3.6334 3.6334 3.6759 3.6759 3.7090 3.7090 3.7633 3.7633 3.9394 3.9394 3.9792 3.9792 5.0739 5.0739 5.0995 5.0995 5.6150 5.6150 5.6297 5.6297 10.8160 10.8160 10.8222 10.8222 13.5436 13.5436 13.5511 13.5511 k = 0.1672 0.6009 0.5229 ( 3020 PWs) bands (ev): -14.1589 -14.1589 -14.1574 -14.1574 -13.4667 -13.4667 -13.4650 -13.4650 -2.3920 -2.3920 -2.3911 -2.3911 -1.1877 -1.1877 -1.1832 -1.1832 0.0419 0.0419 0.0436 0.0436 0.5934 0.5934 0.5998 0.5998 1.6056 1.6056 1.6230 1.6230 1.9188 1.9188 1.9348 1.9348 3.6371 3.6371 3.6810 3.6810 3.7136 3.7136 3.7744 3.7744 3.9327 3.9327 3.9761 3.9761 5.0714 5.0714 5.0973 5.0973 5.6231 5.6231 5.6380 5.6380 10.7820 10.7820 10.7882 10.7882 13.5245 13.5245 13.5330 13.5330 k = 0.1625 0.5842 0.5229 ( 3016 PWs) bands (ev): -14.1730 -14.1730 -14.1715 -14.1715 -13.4686 -13.4686 -13.4669 -13.4669 -2.4231 -2.4231 -2.4222 -2.4222 -1.1743 -1.1743 -1.1697 -1.1697 0.0982 0.0982 0.0999 0.0999 0.5898 0.5898 0.5963 0.5963 1.6063 1.6063 1.6244 1.6244 1.9225 1.9225 1.9389 1.9389 3.6403 3.6403 3.6849 3.6849 3.7189 3.7189 3.7856 3.7856 3.9264 3.9264 3.9736 3.9736 5.0687 5.0687 5.0949 5.0949 5.6309 5.6309 5.6461 5.6461 10.7462 10.7462 10.7524 10.7524 13.5012 13.5012 13.5107 13.5107 k = 0.1579 0.5675 0.5229 ( 3016 PWs) bands (ev): -14.1874 -14.1874 -14.1858 -14.1858 -13.4707 -13.4707 -13.4690 -13.4690 -2.4547 -2.4547 -2.4539 -2.4539 -1.1612 -1.1612 -1.1566 -1.1566 0.1565 0.1565 0.1584 0.1584 0.5867 0.5867 0.5934 0.5934 1.6070 1.6070 1.6255 1.6255 1.9273 1.9273 1.9440 1.9440 3.6431 3.6431 3.6875 3.6875 3.7248 3.7248 3.7967 3.7967 3.9207 3.9207 3.9715 3.9715 5.0659 5.0659 5.0923 5.0923 5.6386 5.6386 5.6539 5.6539 10.7086 10.7086 10.7148 10.7148 13.4729 13.4729 13.4833 13.4833 k = 0.1533 0.5508 0.5229 ( 3016 PWs) bands (ev): -14.2020 -14.2020 -14.2005 -14.2005 -13.4730 -13.4730 -13.4712 -13.4712 -2.4867 -2.4867 -2.4860 -2.4860 -1.1485 -1.1485 -1.1438 -1.1438 0.2167 0.2167 0.2187 0.2187 0.5841 0.5841 0.5912 0.5912 1.6077 1.6077 1.6265 1.6265 1.9333 1.9333 1.9500 1.9500 3.6454 3.6454 3.6889 3.6889 3.7312 3.7312 3.8074 3.8074 3.9158 3.9158 3.9701 3.9701 5.0630 5.0630 5.0896 5.0896 5.6462 5.6462 5.6617 5.6617 10.6692 10.6692 10.6754 10.6754 13.4388 13.4388 13.4500 13.4500 k = 0.1486 0.5342 0.5229 ( 3016 PWs) bands (ev): -14.2169 -14.2169 -14.2153 -14.2153 -13.4753 -13.4753 -13.4735 -13.4735 -2.5190 -2.5190 -2.5184 -2.5184 -1.1362 -1.1362 -1.1314 -1.1314 0.2782 0.2782 0.2807 0.2807 0.5821 0.5821 0.5896 0.5896 1.6083 1.6083 1.6273 1.6273 1.9404 1.9404 1.9569 1.9569 3.6471 3.6471 3.6892 3.6892 3.7377 3.7377 3.8175 3.8175 3.9120 3.9120 3.9693 3.9693 5.0599 5.0599 5.0869 5.0869 5.6539 5.6539 5.6695 5.6695 10.6281 10.6281 10.6343 10.6343 13.3989 13.3989 13.4107 13.4107 k = 0.1440 0.5175 0.5229 ( 3020 PWs) bands (ev): -14.2318 -14.2318 -14.2303 -14.2303 -13.4777 -13.4777 -13.4760 -13.4760 -2.5515 -2.5515 -2.5509 -2.5509 -1.1242 -1.1242 -1.1195 -1.1195 0.3405 0.3405 0.3439 0.3439 0.5807 0.5807 0.5891 0.5891 1.6090 1.6090 1.6281 1.6281 1.9485 1.9485 1.9647 1.9647 3.6481 3.6481 3.6886 3.6886 3.7441 3.7441 3.8265 3.8265 3.9097 3.9097 3.9692 3.9692 5.0568 5.0568 5.0840 5.0840 5.6616 5.6616 5.6775 5.6775 10.5852 10.5852 10.5914 10.5914 13.3533 13.3533 13.3655 13.3655 k = 0.1393 0.5008 0.5229 ( 3020 PWs) bands (ev): -14.2469 -14.2469 -14.2454 -14.2454 -13.4802 -13.4802 -13.4785 -13.4785 -2.5840 -2.5840 -2.5835 -2.5835 -1.1127 -1.1127 -1.1079 -1.1079 0.4025 0.4025 0.4078 0.4078 0.5801 0.5801 0.5903 0.5903 1.6101 1.6101 1.6290 1.6290 1.9575 1.9575 1.9731 1.9731 3.6486 3.6486 3.6871 3.6871 3.7500 3.7500 3.8340 3.8340 3.9095 3.9095 3.9699 3.9699 5.0537 5.0537 5.0811 5.0811 5.6697 5.6697 5.6857 5.6857 10.5407 10.5407 10.5469 10.5469 13.3026 13.3026 13.3151 13.3151 k = 0.1347 0.4841 0.5229 ( 3016 PWs) bands (ev): -14.2620 -14.2620 -14.2605 -14.2605 -13.4828 -13.4828 -13.4811 -13.4811 -2.6165 -2.6165 -2.6160 -2.6160 -1.1016 -1.1016 -1.0967 -1.0967 0.4620 0.4620 0.4716 0.4716 0.5810 0.5810 0.5951 0.5951 1.6116 1.6116 1.6304 1.6304 1.9672 1.9672 1.9822 1.9822 3.6483 3.6483 3.6850 3.6850 3.7554 3.7554 3.8396 3.8396 3.9116 3.9116 3.9713 3.9713 5.0505 5.0505 5.0782 5.0782 5.6782 5.6782 5.6942 5.6942 10.4947 10.4947 10.5009 10.5009 13.2477 13.2477 13.2601 13.2601 k = 0.1300 0.4674 0.5229 ( 3016 PWs) bands (ev): -14.2771 -14.2771 -14.2756 -14.2756 -13.4855 -13.4855 -13.4837 -13.4837 -2.6488 -2.6488 -2.6484 -2.6484 -1.0909 -1.0909 -1.0860 -1.0860 0.5127 0.5127 0.5311 0.5311 0.5870 0.5870 0.6095 0.6095 1.6138 1.6138 1.6324 1.6324 1.9775 1.9775 1.9918 1.9918 3.6472 3.6472 3.6821 3.6821 3.7599 3.7599 3.8431 3.8431 3.9163 3.9163 3.9736 3.9736 5.0474 5.0474 5.0753 5.0753 5.6872 5.6872 5.7033 5.7033 10.4472 10.4472 10.4533 10.4533 13.1893 13.1893 13.2015 13.2015 k = 0.1254 0.4507 0.5229 ( 3020 PWs) bands (ev): -14.2922 -14.2922 -14.2907 -14.2907 -13.4881 -13.4881 -13.4864 -13.4864 -2.6809 -2.6809 -2.6805 -2.6805 -1.0806 -1.0806 -1.0757 -1.0757 0.5433 0.5433 0.5641 0.5641 0.6197 0.6197 0.6442 0.6442 1.6172 1.6172 1.6354 1.6354 1.9882 1.9882 2.0017 2.0017 3.6453 3.6453 3.6786 3.6786 3.7635 3.7635 3.8449 3.8449 3.9230 3.9230 3.9767 3.9767 5.0443 5.0443 5.0723 5.0723 5.6968 5.6968 5.7129 5.7129 10.3984 10.3984 10.4045 10.4045 13.1283 13.1283 13.1403 13.1403 k = 0.1207 0.4340 0.5229 ( 3026 PWs) bands (ev): -14.3072 -14.3072 -14.3057 -14.3057 -13.4909 -13.4909 -13.4892 -13.4892 -2.7126 -2.7126 -2.7122 -2.7122 -1.0707 -1.0707 -1.0658 -1.0658 0.5560 0.5560 0.5709 0.5709 0.6784 0.6784 0.6967 0.6967 1.6221 1.6221 1.6398 1.6398 1.9991 1.9991 2.0118 2.0118 3.6425 3.6425 3.6744 3.6744 3.7661 3.7661 3.8455 3.8455 3.9313 3.9313 3.9806 3.9806 5.0412 5.0412 5.0694 5.0694 5.7071 5.7071 5.7231 5.7231 10.3484 10.3484 10.3544 10.3544 13.0655 13.0655 13.0772 13.0772 k = 0.1161 0.4173 0.5229 ( 3026 PWs) bands (ev): -14.3220 -14.3220 -14.3205 -14.3205 -13.4936 -13.4936 -13.4920 -13.4920 -2.7438 -2.7438 -2.7435 -2.7435 -1.0612 -1.0612 -1.0563 -1.0563 0.5615 0.5615 0.5732 0.5732 0.7406 0.7406 0.7555 0.7555 1.6291 1.6291 1.6462 1.6462 2.0101 2.0101 2.0220 2.0220 3.6387 3.6387 3.6696 3.6696 3.7678 3.7678 3.8455 3.8455 3.9406 3.9406 3.9854 3.9854 5.0382 5.0382 5.0665 5.0665 5.7183 5.7183 5.7341 5.7341 10.2974 10.2974 10.3034 10.3034 13.0016 13.0016 13.0129 13.0129 k = 0.1115 0.4006 0.5229 ( 3036 PWs) bands (ev): -14.3366 -14.3366 -14.3352 -14.3352 -13.4964 -13.4964 -13.4948 -13.4948 -2.7744 -2.7744 -2.7742 -2.7742 -1.0522 -1.0522 -1.0472 -1.0472 0.5648 0.5648 0.5749 0.5749 0.8018 0.8018 0.8150 0.8150 1.6386 1.6386 1.6551 1.6551 2.0210 2.0210 2.0321 2.0321 3.6339 3.6339 3.6640 3.6640 3.7687 3.7687 3.8452 3.8452 3.9503 3.9503 3.9908 3.9908 5.0352 5.0352 5.0635 5.0635 5.7303 5.7303 5.7459 5.7459 10.2456 10.2456 10.2514 10.2514 12.9372 12.9372 12.9480 12.9480 k = 0.1068 0.3839 0.5229 ( 3028 PWs) bands (ev): -14.3510 -14.3510 -14.3496 -14.3496 -13.4991 -13.4991 -13.4976 -13.4976 -2.8044 -2.8044 -2.8042 -2.8042 -1.0435 -1.0435 -1.0386 -1.0386 0.5673 0.5673 0.5767 0.5767 0.8607 0.8607 0.8729 0.8729 1.6514 1.6514 1.6672 1.6672 2.0316 2.0316 2.0421 2.0421 3.6282 3.6282 3.6577 3.6577 3.7691 3.7691 3.8447 3.8447 3.9603 3.9603 3.9969 3.9969 5.0324 5.0324 5.0606 5.0606 5.7433 5.7433 5.7587 5.7587 10.1931 10.1931 10.1988 10.1988 12.8727 12.8727 12.8830 12.8830 k = 0.1022 0.3672 0.5229 ( 3024 PWs) bands (ev): -14.3651 -14.3651 -14.3637 -14.3637 -13.5019 -13.5019 -13.5003 -13.5003 -2.8337 -2.8337 -2.8335 -2.8335 -1.0352 -1.0352 -1.0303 -1.0303 0.5696 0.5696 0.5785 0.5785 0.9162 0.9162 0.9278 0.9278 1.6683 1.6683 1.6832 1.6832 2.0419 2.0419 2.0519 2.0519 3.6214 3.6214 3.6506 3.6506 3.7691 3.7691 3.8442 3.8442 3.9701 3.9701 4.0035 4.0035 5.0295 5.0295 5.0576 5.0576 5.7573 5.7573 5.7723 5.7723 10.1401 10.1401 10.1457 10.1457 12.8085 12.8085 12.8184 12.8184 k = 0.0975 0.3505 0.5229 ( 3020 PWs) bands (ev): -14.3788 -14.3788 -14.3775 -14.3775 -13.5046 -13.5046 -13.5031 -13.5031 -2.8622 -2.8622 -2.8620 -2.8620 -1.0273 -1.0273 -1.0224 -1.0224 0.5720 0.5720 0.5806 0.5806 0.9672 0.9672 0.9785 0.9785 1.6898 1.6898 1.7038 1.7038 2.0516 2.0516 2.0613 2.0613 3.6135 3.6135 3.6425 3.6425 3.7688 3.7688 3.8437 3.8437 3.9798 3.9798 4.0105 4.0105 5.0267 5.0267 5.0545 5.0545 5.7722 5.7722 5.7869 5.7869 10.0869 10.0869 10.0924 10.0924 12.7451 12.7451 12.7544 12.7544 k = 0.0929 0.3338 0.5229 ( 3012 PWs) bands (ev): -14.3922 -14.3922 -14.3910 -14.3910 -13.5073 -13.5073 -13.5059 -13.5059 -2.8898 -2.8898 -2.8896 -2.8896 -1.0197 -1.0197 -1.0150 -1.0150 0.5746 0.5746 0.5830 0.5830 1.0131 1.0131 1.0241 1.0241 1.7166 1.7166 1.7296 1.7296 2.0608 2.0608 2.0705 2.0705 3.6047 3.6047 3.6334 3.6334 3.7685 3.7685 3.8431 3.8431 3.9892 3.9892 4.0177 4.0177 5.0239 5.0239 5.0514 5.0514 5.7882 5.7882 5.8024 5.8024 10.0336 10.0336 10.0390 10.0390 12.6827 12.6827 12.6915 12.6915 k = 0.0882 0.3172 0.5229 ( 3016 PWs) bands (ev): -14.4052 -14.4052 -14.4040 -14.4040 -13.5099 -13.5099 -13.5085 -13.5085 -2.9165 -2.9165 -2.9163 -2.9163 -1.0126 -1.0126 -1.0080 -1.0080 0.5774 0.5774 0.5857 0.5857 1.0533 1.0533 1.0639 1.0639 1.7490 1.7490 1.7610 1.7610 2.0693 2.0693 2.0793 2.0793 3.5948 3.5948 3.6232 3.6232 3.7682 3.7682 3.8424 3.8424 3.9983 3.9983 4.0250 4.0250 5.0211 5.0211 5.0481 5.0481 5.8051 5.8051 5.8187 5.8187 9.9805 9.9805 9.9858 9.9858 12.6215 12.6215 12.6299 12.6299 k = 0.0836 0.3005 0.5229 ( 3024 PWs) bands (ev): -14.4178 -14.4178 -14.4166 -14.4166 -13.5125 -13.5125 -13.5112 -13.5112 -2.9422 -2.9422 -2.9420 -2.9420 -1.0059 -1.0059 -1.0014 -1.0014 0.5805 0.5805 0.5886 0.5886 1.0874 1.0874 1.0977 1.0977 1.7869 1.7869 1.7979 1.7979 2.0773 2.0773 2.0879 2.0879 3.5839 3.5839 3.6119 3.6119 3.7681 3.7681 3.8415 3.8415 4.0069 4.0069 4.0323 4.0323 5.0182 5.0182 5.0447 5.0447 5.8228 5.8228 5.8359 5.8359 9.9279 9.9279 9.9330 9.9330 12.5619 12.5619 12.5698 12.5698 k = 0.0789 0.2838 0.5229 ( 3024 PWs) bands (ev): -14.4299 -14.4299 -14.4288 -14.4288 -13.5150 -13.5150 -13.5138 -13.5138 -2.9668 -2.9668 -2.9666 -2.9666 -0.9996 -0.9996 -0.9951 -0.9951 0.5837 0.5837 0.5917 0.5917 1.1156 1.1156 1.1255 1.1255 1.8297 1.8297 1.8401 1.8401 2.0848 2.0848 2.0963 2.0963 3.5721 3.5721 3.5995 3.5995 3.7683 3.7683 3.8406 3.8406 4.0151 4.0151 4.0395 4.0395 5.0154 5.0154 5.0412 5.0412 5.8415 5.8415 5.8539 5.8539 9.8759 9.8759 9.8809 9.8809 12.5040 12.5040 12.5115 12.5115 k = 0.0743 0.2671 0.5229 ( 3024 PWs) bands (ev): -14.4414 -14.4414 -14.4404 -14.4404 -13.5175 -13.5175 -13.5162 -13.5162 -2.9903 -2.9903 -2.9901 -2.9901 -0.9936 -0.9936 -0.9893 -0.9893 0.5873 0.5873 0.5951 0.5951 1.1383 1.1383 1.1478 1.1478 1.8764 1.8764 1.8869 1.8869 2.0919 2.0919 2.1050 2.1050 3.5592 3.5592 3.5859 3.5859 3.7688 3.7688 3.8397 3.8397 4.0229 4.0229 4.0464 4.0464 5.0125 5.0125 5.0375 5.0375 5.8607 5.8607 5.8724 5.8724 9.8250 9.8250 9.8297 9.8297 12.4481 12.4481 12.4551 12.4551 k = 0.0697 0.2504 0.5229 ( 3020 PWs) bands (ev): -14.4525 -14.4525 -14.4515 -14.4515 -13.5198 -13.5198 -13.5186 -13.5186 -3.0126 -3.0126 -3.0124 -3.0124 -0.9880 -0.9880 -0.9839 -0.9839 0.5910 0.5910 0.5986 0.5986 1.1562 1.1562 1.1653 1.1653 1.9253 1.9253 1.9369 1.9369 2.0992 2.0992 2.1146 2.1146 3.5455 3.5455 3.5712 3.5712 3.7697 3.7697 3.8387 3.8387 4.0302 4.0302 4.0529 4.0529 5.0096 5.0096 5.0336 5.0336 5.8805 5.8805 5.8915 5.8915 9.7752 9.7752 9.7798 9.7798 12.3944 12.3944 12.4009 12.4009 k = 0.0650 0.2337 0.5229 ( 3012 PWs) bands (ev): -14.4629 -14.4629 -14.4620 -14.4620 -13.5220 -13.5220 -13.5209 -13.5209 -3.0337 -3.0337 -3.0335 -3.0335 -0.9828 -0.9828 -0.9788 -0.9788 0.5949 0.5949 0.6023 0.6023 1.1699 1.1699 1.1786 1.1786 1.9738 1.9738 1.9881 1.9881 2.1078 2.1078 2.1267 2.1267 3.5307 3.5307 3.5554 3.5554 3.7710 3.7710 3.8377 3.8377 4.0371 4.0371 4.0591 4.0591 5.0067 5.0067 5.0297 5.0297 5.9007 5.9007 5.9109 5.9109 9.7270 9.7270 9.7313 9.7313 12.3431 12.3431 12.3491 12.3491 k = 0.0604 0.2170 0.5229 ( 3012 PWs) bands (ev): -14.4728 -14.4728 -14.4719 -14.4719 -13.5241 -13.5241 -13.5231 -13.5231 -3.0535 -3.0535 -3.0534 -3.0534 -0.9780 -0.9780 -0.9742 -0.9742 0.5990 0.5990 0.6062 0.6062 1.1803 1.1803 1.1884 1.1884 2.0177 2.0177 2.0361 2.0361 2.1213 2.1213 2.1444 2.1444 3.5151 3.5151 3.5386 3.5386 3.7725 3.7725 3.8365 3.8365 4.0435 4.0435 4.0648 4.0648 5.0038 5.0038 5.0256 5.0256 5.9210 5.9210 5.9305 5.9305 9.6805 9.6805 9.6845 9.6845 12.2942 12.2942 12.2999 12.2999 k = 0.0557 0.2003 0.5229 ( 3008 PWs) bands (ev): -14.4820 -14.4820 -14.4812 -14.4812 -13.5261 -13.5261 -13.5252 -13.5252 -3.0720 -3.0720 -3.0719 -3.0719 -0.9735 -0.9735 -0.9699 -0.9699 0.6032 0.6032 0.6100 0.6100 1.1879 1.1879 1.1956 1.1956 2.0515 2.0515 2.0709 2.0709 2.1486 2.1486 2.1726 2.1726 3.4986 3.4986 3.5208 3.5208 3.7743 3.7743 3.8352 3.8352 4.0496 4.0496 4.0700 4.0700 5.0009 5.0009 5.0215 5.0215 5.9412 5.9412 5.9499 5.9499 9.6360 9.6360 9.6398 9.6398 12.2481 12.2481 12.2533 12.2533 k = 0.0511 0.1836 0.5229 ( 3000 PWs) bands (ev): -14.4906 -14.4906 -14.4899 -14.4899 -13.5280 -13.5280 -13.5271 -13.5271 -3.0892 -3.0892 -3.0891 -3.0891 -0.9694 -0.9694 -0.9661 -0.9661 0.6073 0.6073 0.6138 0.6138 1.1934 1.1934 1.2006 1.2006 2.0726 2.0726 2.0879 2.0879 2.1934 2.1934 2.2128 2.2128 3.4813 3.4813 3.5021 3.5021 3.7764 3.7764 3.8338 3.8338 4.0552 4.0552 4.0746 4.0746 4.9981 4.9981 5.0173 5.0173 5.9611 5.9611 5.9690 5.9690 9.5939 9.5939 9.5975 9.5975 12.2050 12.2050 12.2097 12.2097 k = 0.0464 0.1669 0.5229 ( 3000 PWs) bands (ev): -14.4985 -14.4985 -14.4978 -14.4978 -13.5297 -13.5297 -13.5289 -13.5289 -3.1050 -3.1050 -3.1049 -3.1049 -0.9657 -0.9657 -0.9626 -0.9626 0.6115 0.6115 0.6176 0.6176 1.1973 1.1973 1.2039 1.2039 2.0848 2.0848 2.0958 2.0958 2.2461 2.2461 2.2608 2.2608 3.4633 3.4633 3.4826 3.4826 3.7788 3.7788 3.8323 3.8323 4.0603 4.0603 4.0787 4.0787 4.9953 4.9953 5.0130 5.0130 5.9804 5.9804 5.9876 5.9876 9.5543 9.5543 9.5576 9.5576 12.1649 12.1649 12.1692 12.1692 k = 0.0418 0.1502 0.5229 ( 2986 PWs) bands (ev): -14.5057 -14.5057 -14.5051 -14.5051 -13.5313 -13.5313 -13.5306 -13.5306 -3.1194 -3.1194 -3.1192 -3.1192 -0.9622 -0.9622 -0.9594 -0.9594 0.6155 0.6155 0.6212 0.6212 1.1999 1.1999 1.2059 1.2059 2.0920 2.0920 2.1003 2.1003 2.3004 2.3004 2.3118 2.3118 3.4450 3.4450 3.4626 3.4626 3.7815 3.7815 3.8308 3.8308 4.0651 4.0651 4.0823 4.0823 4.9926 4.9926 5.0088 5.0088 5.9989 5.9989 6.0053 6.0053 9.5176 9.5176 9.5206 9.5206 12.1280 12.1280 12.1319 12.1319 k = 0.0372 0.1335 0.5229 ( 2982 PWs) bands (ev): -14.5122 -14.5122 -14.5117 -14.5117 -13.5327 -13.5327 -13.5321 -13.5321 -3.1323 -3.1323 -3.1322 -3.1322 -0.9592 -0.9592 -0.9566 -0.9566 0.6194 0.6194 0.6246 0.6246 1.2016 1.2016 1.2070 1.2070 2.0965 2.0965 2.1031 2.1031 2.3537 2.3537 2.3628 2.3628 3.4262 3.4262 3.4422 3.4422 3.7843 3.7843 3.8291 3.8291 4.0694 4.0694 4.0853 4.0853 4.9902 4.9902 5.0047 5.0047 6.0164 6.0164 6.0220 6.0220 9.4840 9.4840 9.4867 9.4867 12.0946 12.0946 12.0980 12.0980 k = 0.0325 0.1168 0.5229 ( 2980 PWs) bands (ev): -14.5180 -14.5180 -14.5175 -14.5175 -13.5340 -13.5340 -13.5335 -13.5335 -3.1438 -3.1438 -3.1437 -3.1437 -0.9565 -0.9565 -0.9542 -0.9542 0.6231 0.6231 0.6277 0.6277 1.2026 1.2026 1.2074 1.2074 2.0996 2.0996 2.1049 2.1049 2.4046 2.4046 2.4119 2.4119 3.4075 3.4075 3.4217 3.4217 3.7873 3.7873 3.8272 3.8272 4.0734 4.0734 4.0877 4.0877 4.9879 4.9879 5.0008 5.0008 6.0325 6.0325 6.0374 6.0374 9.4537 9.4537 9.4562 9.4562 12.0647 12.0647 12.0677 12.0677 k = 0.0279 0.1002 0.5229 ( 2992 PWs) bands (ev): -14.5230 -14.5230 -14.5226 -14.5226 -13.5351 -13.5351 -13.5346 -13.5346 -3.1538 -3.1538 -3.1537 -3.1537 -0.9542 -0.9542 -0.9522 -0.9522 0.6264 0.6264 0.6305 0.6305 1.2031 1.2031 1.2073 1.2073 2.1017 2.1017 2.1061 2.1061 2.4519 2.4519 2.4579 2.4579 3.3892 3.3892 3.4016 3.4016 3.7903 3.7903 3.8251 3.8251 4.0768 4.0768 4.0895 4.0895 4.9859 4.9859 4.9971 4.9971 6.0470 6.0470 6.0511 6.0511 9.4270 9.4270 9.4291 9.4291 12.0385 12.0385 12.0411 12.0411 k = 0.0232 0.0835 0.5229 ( 3000 PWs) bands (ev): -14.5273 -14.5273 -14.5270 -14.5270 -13.5361 -13.5361 -13.5357 -13.5357 -3.1623 -3.1623 -3.1622 -3.1622 -0.9522 -0.9522 -0.9505 -0.9505 0.6294 0.6294 0.6328 0.6328 1.2034 1.2034 1.2069 1.2069 2.1031 2.1031 2.1068 2.1068 2.4947 2.4947 2.4996 2.4996 3.3719 3.3719 3.3825 3.3825 3.7934 3.7934 3.8228 3.8228 4.0800 4.0800 4.0908 4.0908 4.9842 4.9842 4.9936 4.9936 6.0597 6.0597 6.0632 6.0632 9.4041 9.4041 9.4059 9.4059 12.0161 12.0161 12.0183 12.0183 k = 0.0186 0.0668 0.5229 ( 3000 PWs) bands (ev): -14.5308 -14.5308 -14.5305 -14.5305 -13.5369 -13.5369 -13.5365 -13.5365 -3.1693 -3.1693 -3.1692 -3.1692 -0.9505 -0.9505 -0.9492 -0.9492 0.6320 0.6320 0.6348 0.6348 1.2035 1.2035 1.2063 1.2063 2.1043 2.1043 2.1072 2.1072 2.5319 2.5319 2.5358 2.5358 3.3563 3.3563 3.3649 3.3649 3.7967 3.7967 3.8205 3.8205 4.0829 4.0829 4.0917 4.0917 4.9830 4.9830 4.9906 4.9906 6.0705 6.0705 6.0732 6.0732 9.3851 9.3851 9.3866 9.3866 11.9977 11.9977 11.9994 11.9994 k = 0.0139 0.0501 0.5229 ( 3000 PWs) bands (ev): -14.5335 -14.5335 -14.5333 -14.5333 -13.5374 -13.5374 -13.5372 -13.5372 -3.1747 -3.1747 -3.1746 -3.1746 -0.9492 -0.9492 -0.9482 -0.9482 0.6342 0.6342 0.6363 0.6363 1.2036 1.2036 1.2057 1.2057 2.1051 2.1051 2.1073 2.1073 2.5626 2.5626 2.5655 2.5655 3.3432 3.3432 3.3498 3.3498 3.7999 3.7999 3.8179 3.8179 4.0853 4.0853 4.0920 4.0920 4.9822 4.9822 4.9879 4.9879 6.0791 6.0791 6.0812 6.0812 9.3702 9.3702 9.3713 9.3713 11.9833 11.9833 11.9846 11.9846 k = 0.0093 0.0334 0.5229 ( 3000 PWs) bands (ev): -14.5355 -14.5355 -14.5353 -14.5353 -13.5379 -13.5379 -13.5377 -13.5377 -3.1786 -3.1786 -3.1785 -3.1785 -0.9482 -0.9482 -0.9475 -0.9475 0.6359 0.6359 0.6373 0.6373 1.2037 1.2037 1.2051 1.2051 2.1057 2.1057 2.1072 2.1072 2.5855 2.5855 2.5875 2.5875 3.3334 3.3334 3.3378 3.3378 3.8031 3.8031 3.8152 3.8152 4.0874 4.0874 4.0920 4.0920 4.9819 4.9819 4.9857 4.9857 6.0855 6.0855 6.0868 6.0868 9.3596 9.3596 9.3603 9.3603 11.9731 11.9731 11.9739 11.9739 k = 0.0046 0.0167 0.5229 ( 2998 PWs) bands (ev): -14.5366 -14.5366 -14.5366 -14.5366 -13.5381 -13.5381 -13.5380 -13.5380 -3.1809 -3.1809 -3.1809 -3.1809 -0.9475 -0.9475 -0.9472 -0.9472 0.6371 0.6371 0.6378 0.6378 1.2038 1.2038 1.2046 1.2046 2.1063 2.1063 2.1070 2.1070 2.5999 2.5999 2.6009 2.6009 3.3275 3.3275 3.3298 3.3298 3.8063 3.8063 3.8124 3.8124 4.0891 4.0891 4.0914 4.0914 4.9820 4.9820 4.9840 4.9840 6.0895 6.0895 6.0902 6.0902 9.3532 9.3532 9.3535 9.3535 11.9670 11.9670 11.9674 11.9674 k = 0.0000 0.0000 0.5229 ( 2990 PWs) bands (ev): -14.5370 -14.5370 -14.5370 -14.5370 -13.5381 -13.5381 -13.5381 -13.5381 -3.1817 -3.1817 -3.1817 -3.1817 -0.9472 -0.9472 -0.9472 -0.9472 0.6378 0.6378 0.6378 0.6378 1.2041 1.2041 1.2041 1.2041 2.1067 2.1067 2.1067 2.1067 2.6052 2.6052 2.6052 2.6052 3.3264 3.3264 3.3264 3.3264 3.8094 3.8094 3.8094 3.8094 4.0905 4.0905 4.0905 4.0905 4.9827 4.9827 4.9827 4.9827 6.0911 6.0911 6.0911 6.0911 9.3512 9.3512 9.3512 9.3512 11.9651 11.9651 11.9651 11.9651 k = 0.0000 0.0000 0.5229 ( 2990 PWs) bands (ev): -14.5370 -14.5370 -14.5370 -14.5370 -13.5381 -13.5381 -13.5381 -13.5381 -3.1817 -3.1817 -3.1817 -3.1817 -0.9472 -0.9472 -0.9472 -0.9472 0.6378 0.6378 0.6378 0.6378 1.2041 1.2041 1.2041 1.2041 2.1067 2.1067 2.1067 2.1067 2.6052 2.6052 2.6052 2.6052 3.3264 3.3264 3.3264 3.3264 3.8094 3.8094 3.8094 3.8094 4.0905 4.0905 4.0905 4.0905 4.9827 4.9827 4.9827 4.9827 6.0911 6.0911 6.0911 6.0911 9.3512 9.3512 9.3512 9.3512 11.9651 11.9651 11.9651 11.9651 k = 0.0000 0.0000 0.5055 ( 2990 PWs) bands (ev): -14.5572 -14.5572 -14.5166 -14.5166 -13.5412 -13.5412 -13.5352 -13.5352 -3.1859 -3.1859 -3.1769 -3.1769 -1.0020 -1.0020 -0.8927 -0.8927 0.6352 0.6352 0.6402 0.6402 1.1710 1.1710 1.2385 1.2385 2.1000 2.1000 2.1138 2.1138 2.6021 2.6021 2.6083 2.6083 3.3244 3.3244 3.3282 3.3282 3.8087 3.8087 3.8100 3.8100 4.0868 4.0868 4.0941 4.0941 4.9675 4.9675 4.9957 4.9957 6.0891 6.0891 6.0932 6.0932 9.2588 9.2588 9.4432 9.4432 11.9474 11.9474 11.9878 11.9878 k = 0.0000 0.0000 0.4881 ( 2990 PWs) bands (ev): -14.5772 -14.5772 -14.4961 -14.4961 -13.5444 -13.5444 -13.5323 -13.5323 -3.1897 -3.1897 -3.1717 -3.1717 -1.0568 -1.0568 -0.8387 -0.8387 0.6327 0.6327 0.6427 0.6427 1.1389 1.1389 1.2738 1.2738 2.0938 2.0938 2.1214 2.1214 2.5991 2.5991 2.6115 2.6115 3.3223 3.3223 3.3300 3.3300 3.8079 3.8079 3.8103 3.8103 4.0831 4.0831 4.0977 4.0977 4.9500 4.9500 5.0062 5.0062 6.0870 6.0870 6.0952 6.0952 9.1663 9.1663 9.5346 9.5346 11.9350 11.9350 12.0155 12.0155 k = 0.0000 0.0000 0.4707 ( 2994 PWs) bands (ev): -14.5970 -14.5970 -14.4755 -14.4755 -13.5476 -13.5476 -13.5296 -13.5296 -3.1929 -3.1929 -3.1661 -3.1661 -1.1117 -1.1117 -0.7854 -0.7854 0.6303 0.6303 0.6452 0.6452 1.1081 1.1081 1.3102 1.3102 2.0882 2.0882 2.1292 2.1292 2.5962 2.5962 2.6148 2.6148 3.3202 3.3202 3.3316 3.3316 3.8069 3.8069 3.8106 3.8106 4.0792 4.0792 4.1012 4.1012 4.9304 4.9304 5.0141 5.0141 6.0850 6.0850 6.0973 6.0973 9.0736 9.0736 9.6254 9.6254 11.9279 11.9279 12.0479 12.0479 k = 0.0000 0.0000 0.4532 ( 2994 PWs) bands (ev): -14.6164 -14.6164 -14.4549 -14.4549 -13.5509 -13.5509 -13.5270 -13.5270 -3.1956 -3.1956 -3.1600 -3.1600 -1.1663 -1.1663 -0.7328 -0.7328 0.6279 0.6279 0.6477 0.6477 1.0784 1.0784 1.3475 1.3475 2.0833 2.0833 2.1373 2.1373 2.5933 2.5933 2.6181 2.6181 3.3181 3.3181 3.3332 3.3332 3.8058 3.8058 3.8107 3.8107 4.0753 4.0753 4.1045 4.1045 4.9089 4.9089 5.0195 5.0195 6.0829 6.0829 6.0993 6.0993 8.9812 8.9812 9.7153 9.7153 11.9263 11.9263 12.0848 12.0848 k = 0.0000 0.0000 0.4358 ( 2992 PWs) bands (ev): -14.6354 -14.6354 -14.4344 -14.4344 -13.5542 -13.5542 -13.5245 -13.5245 -3.1978 -3.1978 -3.1536 -3.1536 -1.2204 -1.2204 -0.6812 -0.6812 0.6255 0.6255 0.6501 0.6501 1.0498 1.0498 1.3855 1.3855 2.0793 2.0793 2.1456 2.1456 2.5906 2.5906 2.6215 2.6215 3.3159 3.3159 3.3347 3.3347 3.8046 3.8046 3.8107 3.8107 4.0713 4.0713 4.1078 4.1078 4.8856 4.8856 5.0223 5.0223 6.0810 6.0810 6.1013 6.1013 8.8890 8.8890 9.8043 9.8043 11.9301 11.9301 12.1259 12.1259 k = 0.0000 0.0000 0.4184 ( 2988 PWs) bands (ev): -14.6541 -14.6541 -14.4139 -14.4139 -13.5576 -13.5576 -13.5222 -13.5222 -3.1995 -3.1995 -3.1468 -3.1468 -1.2741 -1.2741 -0.6308 -0.6308 0.6231 0.6231 0.6526 0.6526 1.0225 1.0225 1.4240 1.4240 2.0764 2.0764 2.1542 2.1542 2.5880 2.5880 2.6249 2.6249 3.3137 3.3137 3.3360 3.3360 3.8033 3.8033 3.8106 3.8106 4.0674 4.0674 4.1108 4.1108 4.8609 4.8609 5.0226 5.0226 6.0790 6.0790 6.1033 6.1033 8.7974 8.7974 9.8922 9.8922 11.9394 11.9394 12.1708 12.1708 k = 0.0000 0.0000 0.4009 ( 3000 PWs) bands (ev): -14.6723 -14.6723 -14.3936 -14.3936 -13.5610 -13.5610 -13.5201 -13.5201 -3.2007 -3.2007 -3.1397 -3.1397 -1.3270 -1.3270 -0.5817 -0.5817 0.6208 0.6208 0.6550 0.6550 0.9963 0.9963 1.4628 1.4628 2.0748 2.0748 2.1628 2.1628 2.5855 2.5855 2.6283 2.6283 3.3113 3.3113 3.3371 3.3371 3.8018 3.8018 3.8102 3.8102 4.0634 4.0634 4.1137 4.1137 4.8348 4.8348 5.0202 5.0202 6.0770 6.0770 6.1052 6.1052 8.7064 8.7064 9.9788 9.9788 11.9540 11.9540 12.2194 12.2194 k = 0.0000 0.0000 0.3835 ( 3002 PWs) bands (ev): -14.6901 -14.6901 -14.3735 -14.3735 -13.5643 -13.5643 -13.5181 -13.5181 -3.2014 -3.2014 -3.1324 -3.1324 -1.3789 -1.3789 -0.5340 -0.5340 0.6185 0.6185 0.6573 0.6573 0.9713 0.9713 1.5015 1.5015 2.0747 2.0747 2.1716 2.1716 2.5830 2.5830 2.6317 2.6317 3.3090 3.3090 3.3381 3.3381 3.8003 3.8003 3.8098 3.8098 4.0595 4.0595 4.1164 4.1164 4.8075 4.8075 5.0155 5.0155 6.0751 6.0751 6.1071 6.1071 8.6165 8.6165 10.0640 10.0640 11.9739 11.9739 12.2712 12.2712 k = 0.0000 0.0000 0.3661 ( 2998 PWs) bands (ev): -14.7073 -14.7073 -14.3537 -14.3537 -13.5677 -13.5677 -13.5163 -13.5163 -3.2017 -3.2017 -3.1248 -3.1248 -1.4298 -1.4298 -0.4878 -0.4878 0.6163 0.6163 0.6596 0.6596 0.9473 0.9473 1.5397 1.5397 2.0767 2.0767 2.1804 2.1804 2.5807 2.5807 2.6351 2.6351 3.3067 3.3067 3.3390 3.3390 3.7988 3.7988 3.8092 3.8092 4.0556 4.0556 4.1190 4.1190 4.7795 4.7795 5.0084 5.0084 6.0733 6.0733 6.1090 6.1090 8.5277 8.5277 10.1477 10.1477 11.9990 11.9990 12.3259 12.3259 k = 0.0000 0.0000 0.3486 ( 2996 PWs) bands (ev): -14.7240 -14.7240 -14.3342 -14.3342 -13.5710 -13.5710 -13.5146 -13.5146 -3.2015 -3.2015 -3.1170 -3.1170 -1.4795 -1.4795 -0.4432 -0.4432 0.6142 0.6142 0.6619 0.6619 0.9246 0.9246 1.5768 1.5768 2.0810 2.0810 2.1893 2.1893 2.5785 2.5785 2.6385 2.6385 3.3044 3.3044 3.3397 3.3397 3.7971 3.7971 3.8084 3.8084 4.0517 4.0517 4.1213 4.1213 4.7507 4.7507 4.9992 4.9992 6.0715 6.0715 6.1108 6.1108 8.4403 8.4403 10.2297 10.2297 12.0291 12.0291 12.3831 12.3831 k = 0.0000 0.0000 0.3312 ( 2994 PWs) bands (ev): -14.7401 -14.7401 -14.3151 -14.3151 -13.5743 -13.5743 -13.5132 -13.5132 -3.2009 -3.2009 -3.1092 -3.1092 -1.5278 -1.5278 -0.4005 -0.4005 0.6121 0.6121 0.6640 0.6640 0.9029 0.9029 1.6122 1.6122 2.0883 2.0883 2.1982 2.1982 2.5764 2.5764 2.6418 2.6418 3.3022 3.3022 3.3402 3.3402 3.7954 3.7954 3.8075 3.8075 4.0479 4.0479 4.1235 4.1235 4.7215 4.7215 4.9880 4.9880 6.0697 6.0697 6.1125 6.1125 8.3546 8.3546 10.3098 10.3098 12.0640 12.0640 12.4425 12.4425 k = 0.0000 0.0000 0.3138 ( 2998 PWs) bands (ev): -14.7555 -14.7555 -14.2965 -14.2965 -13.5775 -13.5775 -13.5119 -13.5119 -3.1999 -3.1999 -3.1012 -3.1012 -1.5746 -1.5746 -0.3596 -0.3596 0.6101 0.6101 0.6662 0.6662 0.8823 0.8823 1.6450 1.6450 2.0992 2.0992 2.2071 2.2071 2.5744 2.5744 2.6452 2.6452 3.3000 3.3000 3.3406 3.3406 3.7936 3.7936 3.8064 3.8064 4.0441 4.0441 4.1254 4.1254 4.6920 4.6920 4.9748 4.9748 6.0680 6.0680 6.1142 6.1142 8.2708 8.2708 10.3879 10.3879 12.1033 12.1033 12.5036 12.5036 k = 0.0000 0.0000 0.2963 ( 2992 PWs) bands (ev): -14.7703 -14.7703 -14.2784 -14.2784 -13.5806 -13.5806 -13.5108 -13.5108 -3.1985 -3.1985 -3.0933 -3.0933 -1.6197 -1.6197 -0.3206 -0.3206 0.6082 0.6082 0.6682 0.6682 0.8628 0.8628 1.6748 1.6748 2.1141 2.1141 2.2160 2.2160 2.5726 2.5726 2.6484 2.6484 3.2978 3.2978 3.3408 3.3408 3.7919 3.7919 3.8052 3.8052 4.0405 4.0405 4.1270 4.1270 4.6626 4.6626 4.9600 4.9600 6.0663 6.0663 6.1159 6.1159 8.1892 8.1892 10.4638 10.4638 12.1469 12.1469 12.5661 12.5661 k = 0.0000 0.0000 0.2789 ( 2996 PWs) bands (ev): -14.7845 -14.7845 -14.2608 -14.2608 -13.5836 -13.5836 -13.5099 -13.5099 -3.1969 -3.1969 -3.0854 -3.0854 -1.6630 -1.6630 -0.2837 -0.2837 0.6063 0.6063 0.6701 0.6701 0.8444 0.8444 1.7008 1.7008 2.1333 2.1333 2.2248 2.2248 2.5708 2.5708 2.6516 2.6516 3.2957 3.2957 3.3407 3.3407 3.7900 3.7900 3.8040 3.8040 4.0369 4.0369 4.1283 4.1283 4.6335 4.6335 4.9437 4.9437 6.0647 6.0647 6.1174 6.1174 8.1101 8.1101 10.5372 10.5372 12.1945 12.1945 12.6294 12.6294 k = 0.0000 0.0000 0.2615 ( 2996 PWs) bands (ev): -14.7979 -14.7979 -14.2439 -14.2439 -13.5865 -13.5865 -13.5091 -13.5091 -3.1950 -3.1950 -3.0777 -3.0777 -1.7045 -1.7045 -0.2488 -0.2488 0.6046 0.6046 0.6719 0.6719 0.8270 0.8270 1.7227 1.7227 2.1570 2.1570 2.2335 2.2335 2.5692 2.5692 2.6547 2.6547 3.2936 3.2936 3.3404 3.3404 3.7882 3.7882 3.8026 3.8026 4.0334 4.0334 4.1293 4.1293 4.6047 4.6047 4.9262 4.9262 6.0632 6.0632 6.1189 6.1189 8.0337 8.0337 10.6081 10.6081 12.2456 12.2456 12.6931 12.6931 k = 0.0000 0.0000 0.2440 ( 2998 PWs) bands (ev): -14.8105 -14.8105 -14.2277 -14.2277 -13.5893 -13.5893 -13.5085 -13.5085 -3.1928 -3.1928 -3.0701 -3.0701 -1.7439 -1.7439 -0.2160 -0.2160 0.6029 0.6029 0.6737 0.6737 0.8108 0.8108 1.7405 1.7405 2.1847 2.1847 2.2422 2.2422 2.5676 2.5676 2.6577 2.6577 3.2916 3.2916 3.3399 3.3399 3.7864 3.7864 3.8012 3.8012 4.0301 4.0301 4.1300 4.1300 4.5766 4.5766 4.9079 4.9079 6.0617 6.0617 6.1203 6.1203 7.9605 7.9605 10.6760 10.6760 12.2999 12.2999 12.7567 12.7567 k = 0.0000 0.0000 0.2266 ( 2994 PWs) bands (ev): -14.8224 -14.8224 -14.2123 -14.2123 -13.5920 -13.5920 -13.5081 -13.5081 -3.1905 -3.1905 -3.0627 -3.0627 -1.7811 -1.7811 -0.1854 -0.1854 0.6014 0.6014 0.6754 0.6754 0.7957 0.7957 1.7544 1.7544 2.2155 2.2155 2.2514 2.2514 2.5662 2.5662 2.6605 2.6605 3.2898 3.2898 3.3391 3.3391 3.7845 3.7845 3.7998 3.7998 4.0269 4.0269 4.1304 4.1304 4.5494 4.5494 4.8890 4.8890 6.0604 6.0604 6.1217 6.1217 7.8905 7.8905 10.7410 10.7410 12.3570 12.3570 12.8197 12.8197 k = 0.0000 0.0000 0.2092 ( 2992 PWs) bands (ev): -14.8335 -14.8335 -14.1976 -14.1976 -13.5945 -13.5945 -13.5078 -13.5078 -3.1881 -3.1881 -3.0556 -3.0556 -1.8161 -1.8161 -0.1569 -0.1569 0.5999 0.5999 0.6769 0.6769 0.7816 0.7816 1.7650 1.7650 2.2448 2.2448 2.2646 2.2646 2.5649 2.5649 2.6633 2.6633 3.2880 3.2880 3.3382 3.3382 3.7827 3.7827 3.7984 3.7984 4.0238 4.0238 4.1305 4.1305 4.5232 4.5232 4.8698 4.8698 6.0591 6.0591 6.1229 6.1229 7.8243 7.8243 10.8026 10.8026 12.4164 12.4164 12.8815 12.8815 k = 0.0000 0.0000 0.1917 ( 3000 PWs) bands (ev): -14.8438 -14.8438 -14.1839 -14.1839 -13.5969 -13.5969 -13.5076 -13.5076 -3.1856 -3.1856 -3.0489 -3.0489 -1.8487 -1.8487 -0.1307 -0.1307 0.5985 0.5985 0.6783 0.6783 0.7687 0.7687 1.7727 1.7727 2.2603 2.2603 2.2932 2.2932 2.5637 2.5637 2.6659 2.6659 3.2863 3.2863 3.3369 3.3369 3.7808 3.7808 3.7969 3.7969 4.0208 4.0208 4.1302 4.1302 4.4982 4.4982 4.8505 4.8505 6.0579 6.0579 6.1241 6.1241 7.7619 7.7619 10.8606 10.8606 12.4775 12.4775 12.9415 12.9415 k = 0.0000 0.0000 0.1743 ( 3000 PWs) bands (ev): -14.8533 -14.8533 -14.1711 -14.1711 -13.5991 -13.5991 -13.5075 -13.5075 -3.1831 -3.1831 -3.0425 -3.0425 -1.8789 -1.8789 -0.1066 -0.1066 0.5973 0.5973 0.6796 0.6796 0.7568 0.7568 1.7782 1.7782 2.2689 2.2689 2.3294 2.3294 2.5626 2.5626 2.6683 2.6683 3.2847 3.2847 3.3355 3.3355 3.7790 3.7790 3.7955 3.7955 4.0180 4.0180 4.1296 4.1296 4.4745 4.4745 4.8316 4.8316 6.0568 6.0568 6.1252 6.1252 7.7038 7.7038 10.9149 10.9149 12.5400 12.5400 12.9990 12.9990 k = 0.0000 0.0000 0.1569 ( 3001 PWs) bands (ev): -14.8619 -14.8619 -14.1594 -14.1594 -13.6011 -13.6011 -13.5075 -13.5075 -3.1806 -3.1806 -3.0366 -3.0366 -1.9065 -1.9065 -0.0849 -0.0849 0.5961 0.5961 0.6807 0.6807 0.7461 0.7461 1.7820 1.7820 2.2759 2.2759 2.3666 2.3666 2.5616 2.5616 2.6706 2.6706 3.2832 3.2832 3.3338 3.3338 3.7772 3.7772 3.7942 3.7942 4.0154 4.0154 4.1288 4.1288 4.4524 4.4524 4.8134 4.8134 6.0558 6.0558 6.1262 6.1262 7.6503 7.6503 10.9651 10.9651 12.6030 12.6030 13.0533 13.0533 k = 0.0000 0.0000 0.1395 ( 3003 PWs) bands (ev): -14.8697 -14.8697 -14.1487 -14.1487 -13.6030 -13.6030 -13.5075 -13.5075 -3.1783 -3.1783 -3.0312 -3.0312 -1.9314 -1.9314 -0.0654 -0.0654 0.5951 0.5951 0.6818 0.6818 0.7366 0.7366 1.7845 1.7845 2.2821 2.2821 2.4031 2.4031 2.5608 2.5608 2.6727 2.6727 3.2818 3.2818 3.3320 3.3320 3.7754 3.7754 3.7929 3.7929 4.0130 4.0130 4.1278 4.1278 4.4320 4.4320 4.7962 4.7962 6.0550 6.0550 6.1271 6.1271 7.6015 7.6015 11.0109 11.0109 12.6659 12.6659 13.1039 13.1039 k = 0.0000 0.0000 0.1220 ( 2999 PWs) bands (ev): -14.8766 -14.8766 -14.1391 -14.1391 -13.6046 -13.6046 -13.5076 -13.5076 -3.1760 -3.1760 -3.0263 -3.0263 -1.9536 -1.9536 -0.0481 -0.0481 0.5942 0.5942 0.6827 0.6827 0.7282 0.7282 1.7860 1.7860 2.2877 2.2877 2.4380 2.4380 2.5601 2.5601 2.6747 2.6747 3.2807 3.2807 3.3300 3.3300 3.7737 3.7737 3.7918 3.7918 4.0108 4.0108 4.1267 4.1267 4.4134 4.4134 4.7802 4.7802 6.0542 6.0542 6.1279 6.1279 7.5578 7.5578 11.0522 11.0522 12.7278 12.7278 13.1499 13.1499 k = 0.0000 0.0000 0.1046 ( 3003 PWs) bands (ev): -14.8825 -14.8825 -14.1307 -14.1307 -13.6060 -13.6060 -13.5078 -13.5078 -3.1740 -3.1740 -3.0220 -3.0220 -1.9730 -1.9730 -0.0332 -0.0332 0.5934 0.5934 0.6833 0.6833 0.7209 0.7209 1.7869 1.7869 2.2926 2.2926 2.4703 2.4703 2.5594 2.5594 2.6765 2.6765 3.2796 3.2796 3.3280 3.3280 3.7721 3.7721 3.7908 3.7908 4.0088 4.0088 4.1255 4.1255 4.3968 4.3968 4.7658 4.7658 6.0535 6.0535 6.1286 6.1286 7.5194 7.5194 11.0885 11.0885 12.7876 12.7876 13.1907 13.1907 k = 0.0000 0.0000 0.0872 ( 3013 PWs) bands (ev): -14.8876 -14.8876 -14.1235 -14.1235 -13.6073 -13.6073 -13.5079 -13.5079 -3.1722 -3.1722 -3.0182 -3.0182 -1.9896 -1.9896 -0.0205 -0.0205 0.5927 0.5927 0.6838 0.6838 0.7149 0.7149 1.7873 1.7873 2.2967 2.2967 2.4990 2.4990 2.5589 2.5589 2.6780 2.6780 3.2787 3.2787 3.3259 3.3259 3.7705 3.7705 3.7900 3.7900 4.0070 4.0070 4.1243 4.1243 4.3824 4.3824 4.7532 4.7532 6.0529 6.0529 6.1292 6.1292 7.4865 7.4865 11.1198 11.1198 12.8440 12.8440 13.2258 13.2258 k = 0.0000 0.0000 0.0697 ( 3013 PWs) bands (ev): -14.8918 -14.8918 -14.1175 -14.1175 -13.6083 -13.6083 -13.5081 -13.5081 -3.1706 -3.1706 -3.0151 -3.0151 -2.0032 -2.0032 -0.0101 -0.0101 0.5922 0.5922 0.6841 0.6841 0.7100 0.7100 1.7874 1.7874 2.3002 2.3002 2.5236 2.5236 2.5587 2.5587 2.6794 2.6794 3.2780 3.2780 3.3240 3.3240 3.7692 3.7692 3.7894 3.7894 4.0055 4.0055 4.1232 4.1232 4.3703 4.3703 4.7426 4.7426 6.0524 6.0524 6.1297 6.1297 7.4593 7.4593 11.1457 11.1457 12.8954 12.8954 13.2548 13.2548 k = 0.0000 0.0000 0.0523 ( 3015 PWs) bands (ev): -14.8951 -14.8951 -14.1128 -14.1128 -13.6091 -13.6091 -13.5082 -13.5082 -3.1694 -3.1694 -3.0127 -3.0127 -2.0138 -2.0138 -0.0020 -0.0020 0.5917 0.5917 0.6842 0.6842 0.7063 0.7063 1.7874 1.7874 2.3030 2.3030 2.5430 2.5430 2.5589 2.5589 2.6806 2.6806 3.2775 3.2775 3.3224 3.3224 3.7681 3.7681 3.7889 3.7889 4.0043 4.0043 4.1223 4.1223 4.3607 4.3607 4.7342 4.7342 6.0520 6.0520 6.1301 6.1301 7.4380 7.4380 11.1661 11.1661 12.9397 12.9397 13.2774 13.2774 k = 0.0000 0.0000 0.0349 ( 3019 PWs) bands (ev): -14.8974 -14.8974 -14.1095 -14.1095 -13.6096 -13.6096 -13.5083 -13.5083 -3.1685 -3.1685 -3.0110 -3.0110 -2.0215 -2.0215 0.0037 0.0037 0.5914 0.5914 0.6842 0.6842 0.7038 0.7038 1.7873 1.7873 2.3049 2.3049 2.5542 2.5542 2.5621 2.5621 2.6815 2.6815 3.2770 3.2770 3.3210 3.3210 3.7673 3.7673 3.7885 3.7885 4.0034 4.0034 4.1216 4.1216 4.3537 4.3537 4.7281 4.7281 6.0518 6.0518 6.1304 6.1304 7.4226 7.4226 11.1808 11.1808 12.9742 12.9742 13.2935 13.2935 k = 0.0000 0.0000 0.0174 ( 3015 PWs) bands (ev): -14.8988 -14.8988 -14.1075 -14.1075 -13.6100 -13.6100 -13.5084 -13.5084 -3.1679 -3.1679 -3.0099 -3.0099 -2.0260 -2.0260 0.0072 0.0072 0.5912 0.5912 0.6842 0.6842 0.7024 0.7024 1.7872 1.7872 2.3061 2.3061 2.5561 2.5561 2.5689 2.5689 2.6822 2.6822 3.2768 3.2768 3.3203 3.3203 3.7669 3.7669 3.7884 3.7884 4.0029 4.0029 4.1211 4.1211 4.3495 4.3495 4.7244 4.7244 6.0516 6.0516 6.1305 6.1305 7.4134 7.4134 11.1897 11.1897 12.9964 12.9964 13.3032 13.3032 k = 0.0000 0.0000 0.0000 ( 3011 PWs) bands (ev): -14.8993 -14.8993 -14.1068 -14.1068 -13.6101 -13.6101 -13.5084 -13.5084 -3.1678 -3.1678 -3.0095 -3.0095 -2.0276 -2.0276 0.0084 0.0084 0.5912 0.5912 0.6842 0.6842 0.7019 0.7019 1.7872 1.7872 2.3065 2.3065 2.5563 2.5563 2.5716 2.5716 2.6824 2.6824 3.2767 3.2767 3.3200 3.3200 3.7667 3.7667 3.7883 3.7883 4.0028 4.0028 4.1210 4.1210 4.3481 4.3481 4.7231 4.7231 6.0515 6.0515 6.1306 6.1306 7.4103 7.4103 11.1926 11.1926 13.0041 13.0041 13.3064 13.3064 k = 0.0000 0.0000 0.0000 ( 3011 PWs) bands (ev): -14.8993 -14.8993 -14.1068 -14.1068 -13.6101 -13.6101 -13.5084 -13.5084 -3.1678 -3.1678 -3.0095 -3.0095 -2.0276 -2.0276 0.0084 0.0084 0.5912 0.5912 0.6842 0.6842 0.7019 0.7019 1.7872 1.7872 2.3065 2.3065 2.5563 2.5563 2.5716 2.5716 2.6824 2.6824 3.2767 3.2767 3.3200 3.3200 3.7667 3.7667 3.7883 3.7883 4.0028 4.0028 4.1210 4.1210 4.3481 4.3481 4.7231 4.7231 6.0515 6.0515 6.1306 6.1306 7.4103 7.4103 11.1926 11.1926 13.0041 13.0041 13.3064 13.3064 k =-0.0167 0.0046 0.0000 ( 3017 PWs) bands (ev): -14.8988 -14.8987 -14.1066 -14.1066 -13.6115 -13.6113 -13.5082 -13.5079 -3.1677 -3.1675 -3.0079 -3.0077 -2.0263 -2.0263 0.0069 0.0070 0.5913 0.5915 0.6840 0.6841 0.7011 0.7011 1.7863 1.7873 2.3029 2.3036 2.5547 2.5555 2.5703 2.5719 2.6825 2.6827 3.2761 3.2762 3.3201 3.3219 3.7660 3.7673 3.7882 3.7884 4.0012 4.0043 4.1161 4.1235 4.3484 4.3515 4.7227 4.7232 6.0514 6.0524 6.1304 6.1315 7.4142 7.4142 11.1947 11.1952 12.9790 12.9813 13.3225 13.3270 k =-0.0333 0.0093 0.0000 ( 3017 PWs) bands (ev): -14.8973 -14.8972 -14.1061 -14.1060 -13.6155 -13.6151 -13.5073 -13.5068 -3.1675 -3.1670 -3.0026 -3.0023 -2.0226 -2.0224 0.0027 0.0027 0.5920 0.5924 0.6838 0.6838 0.6990 0.6990 1.7849 1.7867 2.2929 2.2941 2.5510 2.5523 2.5677 2.5712 2.6830 2.6833 3.2745 3.2749 3.3222 3.3256 3.7650 3.7676 3.7881 3.7886 3.9997 4.0058 4.1092 4.1237 4.3523 4.3583 4.7221 4.7231 6.0520 6.0539 6.1311 6.1332 7.4258 7.4259 11.2016 11.2026 12.9193 12.9225 13.3634 13.3709 k =-0.0500 0.0139 0.0000 ( 3017 PWs) bands (ev): -14.8948 -14.8947 -14.1052 -14.1051 -13.6218 -13.6211 -13.5060 -13.5053 -3.1669 -3.1662 -2.9939 -2.9934 -2.0162 -2.0159 -0.0043 -0.0043 0.5932 0.5937 0.6827 0.6829 0.6959 0.6961 1.7826 1.7853 2.2768 2.2786 2.5454 2.5468 2.5637 2.5695 2.6838 2.6842 3.2723 3.2730 3.3258 3.3305 3.7639 3.7678 3.7880 3.7888 3.9982 4.0075 4.1007 4.1218 4.3597 4.3680 4.7212 4.7227 6.0533 6.0561 6.1327 6.1358 7.4451 7.4452 11.2132 11.2147 12.8418 12.8450 13.4114 13.4206 k =-0.0667 0.0185 0.0000 ( 3021 PWs) bands (ev): -14.8913 -14.8913 -14.1039 -14.1039 -13.6299 -13.6292 -13.5045 -13.5037 -3.1659 -3.1651 -2.9818 -2.9811 -2.0074 -2.0070 -0.0142 -0.0141 0.5948 0.5955 0.6797 0.6802 0.6932 0.6938 1.7793 1.7829 2.2552 2.2574 2.5382 2.5394 2.5585 2.5665 2.6848 2.6852 3.2698 3.2710 3.3304 3.3363 3.7626 3.7677 3.7880 3.7890 3.9965 4.0091 4.0910 4.1183 4.3700 4.3801 4.7200 4.7220 6.0553 6.0590 6.1351 6.1391 7.4719 7.4720 11.2295 11.2315 12.7550 12.7578 13.4573 13.4673 k =-0.0833 0.0232 0.0000 ( 3022 PWs) bands (ev): -14.8868 -14.8868 -14.1024 -14.1023 -13.6397 -13.6388 -13.5032 -13.5023 -3.1646 -3.1636 -2.9664 -2.9656 -1.9960 -1.9956 -0.0269 -0.0268 0.5969 0.5978 0.6738 0.6746 0.6921 0.6930 1.7748 1.7790 2.2288 2.2314 2.5295 2.5304 2.5520 2.5623 2.6857 2.6862 3.2677 3.2693 3.3355 3.3424 3.7612 3.7674 3.7879 3.7892 3.9948 4.0108 4.0808 4.1137 4.3826 4.3939 4.7186 4.7211 6.0579 6.0624 6.1382 6.1431 7.5059 7.5061 11.2503 11.2528 12.6627 12.6652 13.4969 13.5072 k =-0.1000 0.0278 0.0000 ( 3022 PWs) bands (ev): -14.8814 -14.8814 -14.1007 -14.1006 -13.6507 -13.6498 -13.5022 -13.5012 -3.1627 -3.1617 -2.9479 -2.9470 -1.9822 -1.9817 -0.0424 -0.0423 0.5995 0.6006 0.6654 0.6664 0.6923 0.6935 1.7686 1.7734 2.1984 2.2014 2.5194 2.5199 2.5444 2.5569 2.6866 2.6869 3.2657 3.2678 3.3409 3.3486 3.7596 3.7670 3.7877 3.7895 3.9929 4.0126 4.0702 4.1086 4.3970 4.4091 4.7171 4.7200 6.0614 6.0666 6.1421 6.1478 7.5469 7.5471 11.2757 11.2786 12.5668 12.5689 13.5289 13.5389 k =-0.1167 0.0325 0.0000 ( 3018 PWs) bands (ev): -14.8751 -14.8750 -14.0988 -14.0987 -13.6627 -13.6617 -13.5018 -13.5008 -3.1605 -3.1593 -2.9264 -2.9254 -1.9661 -1.9655 -0.0608 -0.0607 0.6026 0.6038 0.6553 0.6564 0.6933 0.6946 1.7601 1.7653 2.1653 2.1688 2.5082 2.5083 2.5359 2.5503 2.6872 2.6874 3.2641 3.2665 3.3464 3.3549 3.7579 3.7664 3.7877 3.7897 3.9909 4.0143 4.0598 4.1032 4.4127 4.4253 4.7153 4.7186 6.0655 6.0714 6.1465 6.1530 7.5945 7.5947 11.3054 11.3088 12.4684 12.4702 13.5533 13.5626 k =-0.1333 0.0371 0.0000 ( 3016 PWs) bands (ev): -14.8678 -14.8677 -14.0968 -14.0967 -13.6754 -13.6743 -13.5021 -13.5010 -3.1578 -3.1566 -2.9019 -2.9009 -1.9476 -1.9470 -0.0820 -0.0819 0.6059 0.6073 0.6439 0.6452 0.6947 0.6962 1.7484 1.7538 2.1308 2.1349 2.4957 2.4960 2.5267 2.5427 2.6876 2.6876 3.2628 3.2655 3.3517 3.3608 3.7562 3.7656 3.7877 3.7899 3.9887 4.0158 4.0498 4.0980 4.4291 4.4420 4.7134 4.7171 6.0703 6.0768 6.1516 6.1587 7.6484 7.6487 11.3392 11.3432 12.3681 12.3697 13.5704 13.5789 k =-0.1500 0.0417 0.0000 ( 3022 PWs) bands (ev): -14.8596 -14.8596 -14.0949 -14.0948 -13.6885 -13.6875 -13.5031 -13.5019 -3.1547 -3.1534 -2.8747 -2.8737 -1.9270 -1.9263 -0.1060 -0.1059 0.6095 0.6108 0.6316 0.6332 0.6963 0.6980 1.7326 1.7379 2.0965 2.1013 2.4824 2.4829 2.5168 2.5342 2.6873 2.6875 3.2619 3.2649 3.3568 3.3664 3.7544 3.7645 3.7876 3.7902 3.9863 4.0169 4.0407 4.0931 4.4460 4.4590 4.7114 4.7154 6.0757 6.0826 6.1571 6.1647 7.7082 7.7085 11.3770 11.3815 12.2666 12.2680 13.5807 13.5888 k =-0.1667 0.0464 0.0000 ( 3018 PWs) bands (ev): -14.8506 -14.8505 -14.0931 -14.0930 -13.7019 -13.7008 -13.5049 -13.5037 -3.1512 -3.1499 -2.8449 -2.8438 -1.9043 -1.9035 -0.1328 -0.1327 0.6123 0.6124 0.6200 0.6229 0.6982 0.7000 1.7113 1.7163 2.0641 2.0698 2.4684 2.4692 2.5064 2.5249 2.6867 2.6871 3.2613 3.2643 3.3615 3.3716 3.7526 3.7634 3.7876 3.7904 3.9837 4.0164 4.0337 4.0888 4.4630 4.4761 4.7093 4.7137 6.0817 6.0890 6.1631 6.1712 7.7735 7.7739 11.4184 11.4234 12.1644 12.1656 13.5840 13.5928 k =-0.1833 0.0510 0.0000 ( 3022 PWs) bands (ev): -14.8408 -14.8407 -14.0917 -14.0915 -13.7152 -13.7141 -13.5075 -13.5063 -3.1474 -3.1461 -2.8125 -2.8114 -1.8796 -1.8788 -0.1623 -0.1622 0.6034 0.6035 0.6197 0.6227 0.7002 0.7022 1.6836 1.6879 2.0353 2.0421 2.4540 2.4549 2.4957 2.5150 2.6857 2.6862 3.2611 3.2641 3.3660 3.3764 3.7507 3.7620 3.7875 3.7905 3.9809 4.0126 4.0306 4.0850 4.4800 4.4929 4.7072 4.7118 6.0881 6.0958 6.1694 6.1779 7.8439 7.8443 11.4628 11.4683 12.0621 12.0632 13.5802 13.5884 k =-0.2000 0.0556 0.0000 ( 3018 PWs) bands (ev): -14.8301 -14.8301 -14.0907 -14.0906 -13.7281 -13.7270 -13.5109 -13.5097 -3.1434 -3.1421 -2.7778 -2.7767 -1.8532 -1.8524 -0.1944 -0.1943 0.5899 0.5903 0.6241 0.6270 0.7023 0.7045 1.6488 1.6524 2.0112 2.0190 2.4392 2.4403 2.4848 2.5047 2.6843 2.6849 3.2611 3.2641 3.3701 3.3808 3.7488 3.7606 3.7875 3.7908 3.9780 4.0063 4.0309 4.0819 4.4966 4.5093 4.7051 4.7100 6.0950 6.1029 6.1759 6.1847 7.9190 7.9194 11.5090 11.5150 11.9609 11.9620 13.5727 13.5781 k =-0.2167 0.0603 0.0000 ( 3016 PWs) bands (ev): -14.8188 -14.8187 -14.0905 -14.0903 -13.7405 -13.7394 -13.5151 -13.5139 -3.1391 -3.1378 -2.7409 -2.7398 -1.8252 -1.8244 -0.2290 -0.2289 0.5761 0.5766 0.6291 0.6320 0.7045 0.7069 1.6071 1.6100 1.9921 2.0009 2.4242 2.4254 2.4739 2.4941 2.6825 2.6833 3.2613 3.2642 3.3739 3.3847 3.7470 3.7590 3.7875 3.7909 3.9750 3.9992 4.0325 4.0793 4.5126 4.5252 4.7032 4.7083 6.1022 6.1104 6.1825 6.1916 7.9983 7.9987 11.5536 11.5601 11.8643 11.8652 13.5645 13.5677 k =-0.2333 0.0649 0.0000 ( 3006 PWs) bands (ev): -14.8068 -14.8067 -14.0911 -14.0910 -13.7519 -13.7508 -13.5201 -13.5189 -3.1347 -3.1334 -2.7020 -2.7009 -1.7958 -1.7950 -0.2659 -0.2657 0.5624 0.5629 0.6343 0.6373 0.7068 0.7093 1.5592 1.5614 1.9778 1.9874 2.4093 2.4105 2.4631 2.4833 2.6805 2.6814 3.2617 3.2645 3.3775 3.3883 3.7452 3.7573 3.7875 3.7911 3.9719 3.9923 4.0347 4.0774 4.5280 4.5403 4.7015 4.7067 6.1098 6.1181 6.1892 6.1984 8.0814 8.0819 11.5844 11.5906 11.7850 11.7851 13.5567 13.5574 k =-0.2500 0.0696 0.0000 ( 3006 PWs) bands (ev): -14.7942 -14.7941 -14.0929 -14.0927 -13.7621 -13.7610 -13.5259 -13.5247 -3.1303 -3.1290 -2.6614 -2.6603 -1.7654 -1.7645 -0.3048 -0.3047 0.5492 0.5497 0.6397 0.6428 0.7091 0.7118 1.5065 1.5082 1.9675 1.9777 2.3943 2.3956 2.4524 2.4725 2.6782 2.6791 3.2622 3.2648 3.3805 3.3913 3.7434 3.7555 3.7876 3.7912 3.9688 3.9858 4.0370 4.0758 4.5424 4.5543 4.7000 4.7053 6.1175 6.1260 6.1959 6.2052 8.1680 8.1685 11.5633 11.5666 11.7597 11.7630 13.5460 13.5496 k =-0.2667 0.0742 0.0000 ( 3002 PWs) bands (ev): -14.7811 -14.7810 -14.0959 -14.0957 -13.7709 -13.7698 -13.5323 -13.5311 -3.1258 -3.1245 -2.6192 -2.6181 -1.7341 -1.7333 -0.3455 -0.3454 0.5367 0.5370 0.6451 0.6484 0.7115 0.7143 1.4502 1.4515 1.9605 1.9710 2.3796 2.3809 2.4421 2.4619 2.6756 2.6766 3.2629 3.2653 3.3833 3.3939 3.7417 3.7536 3.7876 3.7913 3.9657 3.9797 4.0396 4.0747 4.5559 4.5673 4.6990 4.7042 6.1254 6.1339 6.2025 6.2118 8.2576 8.2582 11.4850 11.4863 11.7941 11.7999 13.5311 13.5424 k =-0.2833 0.0788 0.0000 ( 3004 PWs) bands (ev): -14.7675 -14.7674 -14.1003 -14.1001 -13.7779 -13.7769 -13.5394 -13.5382 -3.1213 -3.1202 -2.5757 -2.5747 -1.7025 -1.7016 -0.3876 -0.3875 0.5250 0.5252 0.6506 0.6540 0.7137 0.7167 1.3916 1.3926 1.9558 1.9665 2.3652 2.3664 2.4321 2.4514 2.6730 2.6740 3.2636 3.2657 3.3857 3.3961 3.7401 3.7517 3.7876 3.7913 3.9628 3.9742 4.0422 4.0739 4.5681 4.5790 4.6984 4.7035 6.1333 6.1418 6.2089 6.2182 8.3497 8.3504 11.3875 11.3881 11.8502 11.8573 13.5115 13.5252 k =-0.3000 0.0835 0.0000 ( 3006 PWs) bands (ev): -14.7536 -14.7535 -14.1062 -14.1061 -13.7832 -13.7821 -13.5471 -13.5459 -3.1170 -3.1159 -2.5314 -2.5303 -1.6707 -1.6699 -0.4307 -0.4307 0.5143 0.5144 0.6560 0.6595 0.7160 0.7190 1.3319 1.3325 1.9530 1.9637 2.3513 2.3525 2.4227 2.4413 2.6702 2.6712 3.2643 3.2662 3.3880 3.3979 3.7387 3.7497 3.7877 3.7913 3.9599 3.9692 4.0448 4.0733 4.5791 4.5893 4.6985 4.7033 6.1412 6.1496 6.2150 6.2242 8.4441 8.4447 11.2844 11.2847 11.9143 11.9221 13.4877 13.5019 k =-0.3167 0.0881 0.0000 ( 2998 PWs) bands (ev): -14.7396 -14.7394 -14.1136 -14.1134 -13.7865 -13.7854 -13.5553 -13.5541 -3.1128 -3.1117 -2.4865 -2.4854 -1.6392 -1.6385 -0.4744 -0.4743 0.5048 0.5048 0.6614 0.6650 0.7181 0.7212 1.2720 1.2724 1.9515 1.9620 2.3380 2.3391 2.4138 2.4315 2.6673 2.6684 3.2649 3.2666 3.3900 3.3995 3.7373 3.7478 3.7878 3.7912 3.9573 3.9648 4.0475 4.0732 4.5887 4.5981 4.6993 4.7037 6.1490 6.1572 6.2209 6.2298 8.5401 8.5408 11.1795 11.1796 11.9826 11.9910 13.4601 13.4750 k =-0.3333 0.0927 0.0000 ( 2994 PWs) bands (ev): -14.7254 -14.7253 -14.1222 -14.1220 -13.7879 -13.7869 -13.5639 -13.5627 -3.1088 -3.1078 -2.4414 -2.4405 -1.6086 -1.6080 -0.5180 -0.5179 0.4966 0.4966 0.6666 0.6703 0.7201 0.7233 1.2127 1.2130 1.9511 1.9612 2.3254 2.3264 2.4056 2.4223 2.6645 2.6655 3.2656 3.2670 3.3918 3.4008 3.7361 3.7460 3.7879 3.7912 3.9548 3.9608 4.0500 4.0730 4.5969 4.6053 4.7008 4.7047 6.1566 6.1645 6.2264 6.2350 8.6374 8.6381 11.0741 11.0741 12.0535 12.0626 13.4289 13.4445 k =-0.3500 0.0974 0.0000 ( 2992 PWs) bands (ev): -14.7114 -14.7113 -14.1319 -14.1317 -13.7876 -13.7866 -13.5727 -13.5716 -3.1050 -3.1041 -2.3968 -2.3959 -1.5793 -1.5787 -0.5609 -0.5609 0.4897 0.4899 0.6717 0.6753 0.7220 0.7252 1.1550 1.1552 1.9513 1.9610 2.3136 2.3146 2.3980 2.4136 2.6618 2.6628 3.2662 3.2674 3.3934 3.4017 3.7350 3.7441 3.7880 3.7912 3.9525 3.9573 4.0525 4.0729 4.6036 4.6110 4.7029 4.7062 6.1639 6.1715 6.2315 6.2398 8.7353 8.7360 10.9688 10.9689 12.1264 12.1360 13.3940 13.4103 k =-0.3667 0.1020 0.0000 ( 3000 PWs) bands (ev): -14.6977 -14.6976 -14.1422 -14.1421 -13.7858 -13.7849 -13.5818 -13.5807 -3.1015 -3.1007 -2.3532 -2.3523 -1.5519 -1.5514 -0.6024 -0.6024 0.4844 0.4847 0.6764 0.6799 0.7237 0.7269 1.0997 1.0997 1.9521 1.9611 2.3027 2.3036 2.3912 2.4054 2.6592 2.6601 3.2668 3.2678 3.3948 3.4024 3.7340 3.7423 3.7882 3.7910 3.9504 3.9541 4.0550 4.0728 4.6089 4.6153 4.7055 4.7083 6.1708 6.1779 6.2361 6.2439 8.8333 8.8339 10.8647 10.8648 12.2003 12.2105 13.3556 13.3723 k =-0.3833 0.1066 0.0000 ( 2998 PWs) bands (ev): -14.6845 -14.6844 -14.1530 -14.1528 -13.7828 -13.7818 -13.5908 -13.5898 -3.0983 -3.0976 -2.3113 -2.3105 -1.5268 -1.5264 -0.6418 -0.6418 0.4807 0.4811 0.6808 0.6842 0.7253 0.7284 1.0475 1.0476 1.9532 1.9614 2.2929 2.2937 2.3852 2.3980 2.6568 2.6576 3.2673 3.2682 3.3961 3.4030 3.7332 3.7406 3.7883 3.7909 3.9486 3.9515 4.0573 4.0727 4.6130 4.6184 4.7085 4.7106 6.1772 6.1839 6.2403 6.2476 8.9303 8.9310 10.7623 10.7625 12.2748 12.2854 13.3138 13.3308 k =-0.4000 0.1113 0.0000 ( 3002 PWs) bands (ev): -14.6722 -14.6721 -14.1636 -14.1634 -13.7787 -13.7779 -13.5997 -13.5988 -3.0955 -3.0949 -2.2719 -2.2712 -1.5046 -1.5042 -0.6782 -0.6781 0.4785 0.4789 0.6847 0.6880 0.7267 0.7296 0.9993 0.9994 1.9545 1.9618 2.2842 2.2848 2.3801 2.3913 2.6546 2.6553 3.2678 3.2684 3.3973 3.4033 3.7326 3.7390 3.7884 3.7906 3.9470 3.9492 4.0594 4.0725 4.6161 4.6205 4.7116 4.7132 6.1831 6.1891 6.2441 6.2506 9.0254 9.0261 10.6629 10.6631 12.3489 12.3600 13.2690 13.2859 k =-0.4167 0.1159 0.0000 ( 2994 PWs) bands (ev): -14.6609 -14.6608 -14.1737 -14.1735 -13.7741 -13.7733 -13.6082 -13.6073 -3.0930 -3.0925 -2.2360 -2.2353 -1.4856 -1.4853 -0.7107 -0.7106 0.4778 0.4782 0.6883 0.6913 0.7280 0.7306 0.9560 0.9562 1.9560 1.9622 2.2767 2.2772 2.3758 2.3854 2.6527 2.6533 3.2682 3.2687 3.3984 3.4035 3.7322 3.7376 3.7886 3.7905 3.9456 3.9473 4.0615 4.0724 4.6184 4.6219 4.7146 4.7157 6.1883 6.1936 6.2474 6.2531 9.1170 9.1176 10.5678 10.5681 12.4219 12.4331 13.2217 13.2383 k =-0.4333 0.1206 0.0000 ( 2994 PWs) bands (ev): -14.6510 -14.6509 -14.1827 -14.1826 -13.7693 -13.7686 -13.6160 -13.6152 -3.0910 -3.0906 -2.2044 -2.2038 -1.4701 -1.4700 -0.7385 -0.7384 0.4782 0.4786 0.6912 0.6938 0.7291 0.7314 0.9185 0.9187 1.9574 1.9625 2.2704 2.2709 2.3725 2.3803 2.6511 2.6516 3.2686 3.2690 3.3993 3.4035 3.7319 3.7363 3.7887 3.7903 3.9445 3.9458 4.0634 4.0721 4.6201 4.6227 4.7173 4.7180 6.1929 6.1973 6.2502 6.2550 9.2027 9.2033 10.4793 10.4796 12.4921 12.5033 13.1732 13.1889 k =-0.4500 0.1252 0.0000 ( 2998 PWs) bands (ev): -14.6429 -14.6428 -14.1904 -14.1903 -13.7648 -13.7642 -13.6227 -13.6221 -3.0894 -3.0891 -2.1783 -2.1779 -1.4583 -1.4582 -0.7610 -0.7609 0.4794 0.4798 0.6936 0.6956 0.7301 0.7319 0.8879 0.8880 1.9586 1.9626 2.2655 2.2658 2.3701 2.3760 2.6498 2.6502 3.2689 3.2691 3.4001 3.4033 3.7318 3.7351 3.7889 3.7901 3.9437 3.9445 4.0651 4.0716 4.6213 4.6231 4.7195 4.7200 6.1966 6.2000 6.2526 6.2563 9.2792 9.2797 10.4008 10.4011 12.5576 12.5682 13.1255 13.1397 k =-0.4667 0.1298 0.0000 ( 2998 PWs) bands (ev): -14.6368 -14.6368 -14.1962 -14.1961 -13.7610 -13.7606 -13.6279 -13.6275 -3.0882 -3.0880 -2.1588 -2.1585 -1.4501 -1.4501 -0.7774 -0.7773 0.4809 0.4812 0.6953 0.6968 0.7309 0.7322 0.8651 0.8652 1.9598 1.9625 2.2620 2.2622 2.3687 2.3727 2.6489 2.6492 3.2691 3.2692 3.4009 3.4030 3.7319 3.7341 3.7891 3.7899 3.9431 3.9436 4.0666 4.0710 4.6221 4.6233 4.7212 4.7214 6.1995 6.2018 6.2545 6.2570 9.3415 9.3419 10.3371 10.3374 12.6146 12.6235 13.0828 13.0942 k =-0.4833 0.1345 0.0000 ( 3006 PWs) bands (ev): -14.6330 -14.6330 -14.1998 -14.1997 -13.7584 -13.7582 -13.6312 -13.6310 -3.0875 -3.0874 -2.1466 -2.1465 -1.4453 -1.4453 -0.7874 -0.7873 0.4821 0.4823 0.6965 0.6973 0.7316 0.7322 0.8509 0.8510 1.9608 1.9621 2.2599 2.2600 2.3682 2.3702 2.6484 2.6485 3.2692 3.2693 3.4015 3.4026 3.7321 3.7333 3.7892 3.7896 3.9427 3.9430 4.0680 4.0701 4.6226 4.6232 4.7222 4.7223 6.2015 6.2027 6.2559 6.2571 9.3832 9.3834 10.2947 10.2948 12.6567 12.6621 13.0521 13.0588 k =-0.5000 0.1391 0.0000 ( 2996 PWs) bands (ev): -14.6317 -14.6317 -14.2010 -14.2010 -13.7575 -13.7575 -13.6323 -13.6323 -3.0872 -3.0872 -2.1424 -2.1424 -1.4437 -1.4437 -0.7907 -0.7907 0.4827 0.4827 0.6972 0.6972 0.7320 0.7320 0.8462 0.8462 1.9616 1.9616 2.2592 2.2592 2.3688 2.3688 2.6483 2.6483 3.2694 3.2694 3.4022 3.4022 3.7326 3.7326 3.7894 3.7894 3.9428 3.9428 4.0692 4.0692 4.6230 4.6230 4.7226 4.7226 6.2026 6.2026 6.2567 6.2567 9.3981 9.3981 10.2797 10.2797 12.6746 12.6746 13.0427 13.0427 k =-0.5000 0.1391 0.0000 ( 2996 PWs) bands (ev): -14.6317 -14.6317 -14.2010 -14.2010 -13.7575 -13.7575 -13.6323 -13.6323 -3.0872 -3.0872 -2.1424 -2.1424 -1.4437 -1.4437 -0.7907 -0.7907 0.4827 0.4827 0.6972 0.6972 0.7320 0.7320 0.8462 0.8462 1.9616 1.9616 2.2592 2.2592 2.3688 2.3688 2.6483 2.6483 3.2694 3.2694 3.4022 3.4022 3.7326 3.7326 3.7894 3.7894 3.9428 3.9428 4.0692 4.0692 4.6230 4.6230 4.7226 4.7226 6.2026 6.2026 6.2567 6.2567 9.3981 9.3981 10.2797 10.2797 12.6746 12.6746 13.0427 13.0427 k =-0.4954 0.1557-0.0000 ( 3000 PWs) bands (ev): -14.6314 -14.6314 -14.2006 -14.2006 -13.7573 -13.7573 -13.6321 -13.6321 -3.0868 -3.0867 -2.1422 -2.1422 -1.4439 -1.4439 -0.7919 -0.7915 0.4829 0.4831 0.6968 0.6987 0.7239 0.7251 0.8554 0.8554 1.9616 1.9626 2.2546 2.2550 2.3668 2.3703 2.6423 2.6447 3.2717 3.2724 3.4038 3.4047 3.7318 3.7341 3.7853 3.7941 3.9424 3.9434 4.0683 4.0699 4.6201 4.6255 4.7222 4.7223 6.1991 6.1999 6.2541 6.2550 9.4011 9.4011 10.2814 10.2815 12.6749 12.6754 13.0443 13.0447 k =-0.4908 0.1723-0.0000 ( 2996 PWs) bands (ev): -14.6306 -14.6305 -14.1995 -14.1995 -13.7567 -13.7567 -13.6316 -13.6315 -3.0853 -3.0852 -2.1414 -2.1414 -1.4445 -1.4444 -0.7951 -0.7944 0.4839 0.4842 0.6936 0.6982 0.7093 0.7122 0.8779 0.8780 1.9626 1.9646 2.2416 2.2422 2.3645 2.3714 2.6271 2.6319 3.2792 3.2807 3.4095 3.4108 3.7316 3.7365 3.7818 3.7993 3.9423 3.9444 4.0673 4.0705 4.6168 4.6276 4.7213 4.7214 6.1895 6.1911 6.2469 6.2489 9.4100 9.4102 10.2865 10.2867 12.6762 12.6772 13.0496 13.0504 k =-0.4862 0.1888-0.0000 ( 2990 PWs) bands (ev): -14.6291 -14.6290 -14.1976 -14.1976 -13.7558 -13.7558 -13.6307 -13.6305 -3.0829 -3.0827 -2.1401 -2.1400 -1.4454 -1.4453 -0.8003 -0.7992 0.4855 0.4860 0.6760 0.6784 0.7117 0.7118 0.9072 0.9073 1.9643 1.9672 2.2209 2.2219 2.3616 2.3720 2.6035 2.6103 3.2916 3.2937 3.4188 3.4198 3.7319 3.7398 3.7788 3.8050 3.9425 3.9458 4.0661 4.0710 4.6133 4.6292 4.7198 4.7199 6.1738 6.1763 6.2353 6.2383 9.4249 9.4251 10.2950 10.2953 12.6785 12.6801 13.0584 13.0596 k =-0.4815 0.2054-0.0000 ( 2990 PWs) bands (ev): -14.6270 -14.6270 -14.1951 -14.1950 -13.7546 -13.7546 -13.6294 -13.6291 -3.0796 -3.0792 -2.1384 -2.1383 -1.4467 -1.4465 -0.8073 -0.8059 0.4879 0.4886 0.6522 0.6537 0.7183 0.7201 0.9398 0.9399 1.9659 1.9697 2.1938 2.1953 2.3582 2.3718 2.5724 2.5809 3.3079 3.3107 3.4306 3.4309 3.7326 3.7442 3.7765 3.8111 3.9429 3.9474 4.0648 4.0713 4.6094 4.6300 4.7175 4.7180 6.1525 6.1557 6.2196 6.2235 9.4454 9.4456 10.3068 10.3072 12.6818 12.6838 13.0707 13.0723 k =-0.4769 0.2220-0.0000 ( 2982 PWs) bands (ev): -14.6244 -14.6243 -14.1917 -14.1917 -13.7529 -13.7529 -13.6277 -13.6274 -3.0752 -3.0748 -2.1361 -2.1360 -1.4483 -1.4481 -0.8161 -0.8144 0.4910 0.4918 0.6276 0.6287 0.7279 0.7308 0.9745 0.9746 1.9663 1.9710 2.1627 2.1645 2.3539 2.3708 2.5351 2.5450 3.3275 3.3311 3.4424 3.4453 3.7336 3.7496 3.7749 3.8175 3.9435 3.9494 4.0634 4.0715 4.6052 4.6300 4.7146 4.7160 6.1257 6.1298 6.1997 6.2046 9.4713 9.4716 10.3219 10.3223 12.6860 12.6885 13.0865 13.0884 k =-0.4723 0.2386-0.0000 ( 2986 PWs) bands (ev): -14.6212 -14.6211 -14.1877 -14.1876 -13.7510 -13.7510 -13.6257 -13.6253 -3.0699 -3.0694 -2.1334 -2.1333 -1.4503 -1.4500 -0.8264 -0.8244 0.4950 0.4958 0.6033 0.6043 0.7396 0.7433 1.0105 1.0107 1.9627 1.9679 2.1313 2.1332 2.3483 2.3684 2.4930 2.5040 3.3495 3.3538 3.4542 3.4610 3.7348 3.7555 3.7746 3.8242 3.9443 3.9517 4.0618 4.0716 4.6006 4.6289 4.7110 4.7138 6.0939 6.0988 6.1759 6.1818 9.5022 9.5025 10.3400 10.3406 12.6910 12.6939 13.1056 13.1078 k =-0.4677 0.2552-0.0000 ( 2988 PWs) bands (ev): -14.6175 -14.6174 -14.1830 -14.1828 -13.7487 -13.7487 -13.6234 -13.6229 -3.0637 -3.0631 -2.1303 -2.1302 -1.4526 -1.4523 -0.8381 -0.8359 0.4998 0.5006 0.5798 0.5808 0.7531 0.7577 1.0475 1.0476 1.9502 1.9553 2.1057 2.1070 2.3404 2.3630 2.4487 2.4599 3.3731 3.3782 3.4654 3.4772 3.7361 3.7606 3.7769 3.8313 3.9454 3.9543 4.0601 4.0716 4.5956 4.6266 4.7068 4.7116 6.0575 6.0634 6.1485 6.1554 9.5378 9.5382 10.3611 10.3617 12.6966 12.7000 13.1278 13.1304 k =-0.4631 0.2718-0.0000 ( 2990 PWs) bands (ev): -14.6131 -14.6130 -14.1775 -14.1774 -13.7460 -13.7460 -13.6207 -13.6202 -3.0566 -3.0559 -2.1268 -2.1267 -1.4553 -1.4549 -0.8510 -0.8486 0.5054 0.5061 0.5574 0.5584 0.7683 0.7735 1.0852 1.0852 1.9236 1.9275 2.0919 2.0921 2.3273 2.3483 2.4093 2.4166 3.3975 3.4036 3.4756 3.4936 3.7375 3.7632 3.7834 3.8386 3.9467 3.9572 4.0582 4.0715 4.5902 4.6227 4.7020 4.7098 6.0171 6.0239 6.1176 6.1255 9.5777 9.5781 10.3849 10.3856 12.7028 12.7066 13.1530 13.1560 k =-0.4585 0.2883-0.0000 ( 2988 PWs) bands (ev): -14.6083 -14.6081 -14.1714 -14.1712 -13.7430 -13.7430 -13.6177 -13.6171 -3.0485 -3.0477 -2.1230 -2.1228 -1.4582 -1.4578 -0.8649 -0.8624 0.5118 0.5121 0.5361 0.5375 0.7849 0.7907 1.1232 1.1232 1.8824 1.8849 2.0887 2.0908 2.3020 2.3127 2.3818 2.3874 3.4221 3.4293 3.4846 3.5098 3.7389 3.7640 3.7931 3.8461 3.9481 3.9603 4.0564 4.0714 4.5842 4.6173 4.6968 4.7083 5.9732 5.9810 6.0836 6.0924 9.6214 9.6219 10.4114 10.4122 12.7095 12.7137 13.1812 13.1843 k =-0.4539 0.3049-0.0000 ( 2994 PWs) bands (ev): -14.6029 -14.6028 -14.1646 -14.1644 -13.7397 -13.7397 -13.6144 -13.6137 -3.0396 -3.0387 -2.1189 -2.1187 -1.4614 -1.4610 -0.8796 -0.8770 0.5133 0.5158 0.5193 0.5236 0.8026 0.8089 1.1612 1.1614 1.8306 1.8321 2.0939 2.0976 2.2598 2.2616 2.3613 2.3783 3.4460 3.4548 3.4928 3.5253 3.7402 3.7641 3.8045 3.8539 3.9497 3.9635 4.0544 4.0713 4.5776 4.6101 4.6912 4.7072 5.9261 5.9349 6.0468 6.0566 9.6687 9.6693 10.4403 10.4411 12.7164 12.7210 13.2119 13.2153 k =-0.4493 0.3215-0.0000 ( 2998 PWs) bands (ev): -14.5970 -14.5968 -14.1572 -14.1570 -13.7361 -13.7360 -13.6107 -13.6100 -3.0298 -3.0288 -2.1146 -2.1144 -1.4649 -1.4645 -0.8949 -0.8922 0.4968 0.4969 0.5274 0.5293 0.8213 0.8280 1.1990 1.1995 1.7721 1.7728 2.1033 2.1088 2.2057 2.2072 2.3493 2.3728 3.4679 3.4798 3.5011 3.5402 3.7414 3.7639 3.8169 3.8617 3.9514 3.9667 4.0524 4.0713 4.5702 4.6012 4.6852 4.7066 5.8767 5.8866 6.0074 6.0183 9.7192 9.7197 10.4713 10.4722 12.7234 12.7284 13.2451 13.2486 k =-0.4446 0.3381-0.0000 ( 2998 PWs) bands (ev): -14.5906 -14.5904 -14.1491 -14.1489 -13.7321 -13.7321 -13.6068 -13.6060 -3.0192 -3.0181 -2.1101 -2.1099 -1.4686 -1.4682 -0.9106 -0.9078 0.4792 0.4794 0.5365 0.5380 0.8407 0.8477 1.2363 1.2371 1.7091 1.7093 2.1083 2.1183 2.1546 2.1550 2.3405 2.3681 3.4847 3.5037 3.5125 3.5545 3.7424 3.7637 3.8297 3.8699 3.9533 3.9699 4.0505 4.0714 4.5620 4.5906 4.6791 4.7063 5.8254 5.8365 5.9659 5.9778 9.7723 9.7729 10.5043 10.5053 12.7305 12.7358 13.2804 13.2839 k =-0.4400 0.3547-0.0000 ( 3006 PWs) bands (ev): -14.5837 -14.5836 -14.1405 -14.1403 -13.7278 -13.7278 -13.6026 -13.6018 -3.0077 -3.0066 -2.1054 -2.1052 -1.4726 -1.4722 -0.9264 -0.9237 0.4626 0.4629 0.5464 0.5477 0.8608 0.8680 1.2724 1.2737 1.6428 1.6429 2.0717 2.0825 2.1471 2.1475 2.3330 2.3635 3.4940 3.5261 3.5293 3.5684 3.7432 3.7634 3.8426 3.8781 3.9552 3.9727 4.0485 4.0715 4.5528 4.5783 4.6729 4.7063 5.7726 5.7850 5.9226 5.9355 9.8279 9.8285 10.5392 10.5401 12.7373 12.7429 13.3172 13.3205 k =-0.4354 0.3712-0.0000 ( 3002 PWs) bands (ev): -14.5764 -14.5762 -14.1312 -14.1310 -13.7233 -13.7233 -13.5982 -13.5973 -2.9954 -2.9942 -2.1007 -2.1005 -1.4767 -1.4763 -0.9422 -0.9395 0.4472 0.4476 0.5573 0.5584 0.8813 0.8886 1.3066 1.3088 1.5744 1.5746 2.0136 2.0238 2.1626 2.1643 2.3259 2.3586 3.4987 3.5463 3.5487 3.5823 3.7436 3.7630 3.8552 3.8867 3.9571 3.9754 4.0467 4.0720 4.5424 4.5644 4.6667 4.7065 5.7190 5.7327 5.8778 5.8918 9.8856 9.8862 10.5755 10.5765 12.7438 12.7497 13.3543 13.3566 k =-0.4308 0.3878-0.0000 ( 2998 PWs) bands (ev): -14.5686 -14.5684 -14.1215 -14.1212 -13.7184 -13.7184 -13.5936 -13.5926 -2.9824 -2.9812 -2.0960 -2.0958 -1.4810 -1.4807 -0.9579 -0.9552 0.4328 0.4333 0.5689 0.5700 0.9020 0.9093 1.3376 1.3411 1.5050 1.5052 1.9542 1.9648 2.1819 2.1835 2.3191 2.3534 3.5014 3.5636 3.5680 3.5966 3.7438 3.7625 3.8674 3.8956 3.9590 3.9775 4.0449 4.0727 4.5310 4.5491 4.6606 4.7067 5.6651 5.6802 5.8320 5.8470 9.9451 9.9457 10.6132 10.6142 12.7497 12.7559 13.3856 13.3858 k =-0.4262 0.4044-0.0000 ( 3002 PWs) bands (ev): -14.5604 -14.5602 -14.1112 -14.1109 -13.7133 -13.7133 -13.5887 -13.5877 -2.9687 -2.9674 -2.0913 -2.0912 -1.4855 -1.4851 -0.9731 -0.9706 0.4194 0.4200 0.5815 0.5824 0.9228 0.9300 1.3609 1.3676 1.4364 1.4384 1.8969 1.9083 2.2028 2.2034 2.3126 2.3478 3.5031 3.5779 3.5864 3.6117 3.7435 3.7617 3.8789 3.9047 3.9608 3.9790 4.0433 4.0737 4.5182 4.5324 4.6546 4.7070 5.6112 5.6279 5.7854 5.8015 10.0061 10.0067 10.6520 10.6531 12.7550 12.7614 13.3936 13.3938 k =-0.4216 0.4210-0.0000 ( 3002 PWs) bands (ev): -14.5518 -14.5516 -14.1004 -14.1001 -13.7079 -13.7079 -13.5837 -13.5826 -2.9543 -2.9529 -2.0868 -2.0867 -1.4901 -1.4897 -0.9879 -0.9854 0.4070 0.4076 0.5948 0.5956 0.9435 0.9504 1.3443 1.3527 1.4026 1.4048 1.8446 1.8568 2.2231 2.2246 2.3069 2.3417 3.5042 3.5894 3.6033 3.6271 3.7428 3.7607 3.8896 3.9141 3.9624 3.9798 4.0418 4.0751 4.5043 4.5144 4.6488 4.7071 5.5580 5.5762 5.7384 5.7555 10.0684 10.0690 10.6918 10.6928 12.7594 12.7661 13.3845 13.3862 k =-0.4170 0.4376-0.0000 ( 3002 PWs) bands (ev): -14.5428 -14.5426 -14.0891 -14.0888 -13.7023 -13.7022 -13.5785 -13.5774 -2.9393 -2.9378 -2.0825 -2.0824 -1.4947 -1.4944 -1.0020 -0.9997 0.3953 0.3960 0.6090 0.6097 0.9638 0.9702 1.2792 1.2849 1.4101 1.4123 1.8006 1.8140 2.2410 2.2469 2.3030 2.3352 3.5049 3.5988 3.6187 3.6420 3.7417 3.7595 3.8993 3.9238 3.9638 3.9800 4.0404 4.0770 4.4891 4.4954 4.6433 4.7071 5.5058 5.5256 5.6914 5.7095 10.1318 10.1324 10.7322 10.7333 12.7628 12.7697 13.3707 13.3734 k =-0.4124 0.4541-0.0000 ( 3006 PWs) bands (ev): -14.5335 -14.5333 -14.0775 -14.0771 -13.6964 -13.6963 -13.5731 -13.5720 -2.9237 -2.9221 -2.0784 -2.0784 -1.4994 -1.4991 -1.0154 -1.0131 0.3844 0.3851 0.6240 0.6246 0.9834 0.9888 1.2083 1.2140 1.4083 1.4123 1.7695 1.7837 2.2538 2.2693 2.3040 2.3282 3.5055 3.6067 3.6322 3.6559 3.7402 3.7580 3.9078 3.9337 3.9650 3.9795 4.0391 4.0794 4.4727 4.4753 4.6379 4.7069 5.4550 5.4764 5.6447 5.6638 10.1960 10.1967 10.7732 10.7743 12.7650 12.7721 13.3549 13.3582 k =-0.4077 0.4707-0.0000 ( 3006 PWs) bands (ev): -14.5239 -14.5236 -14.0654 -14.0651 -13.6902 -13.6902 -13.5677 -13.5665 -2.9074 -2.9058 -2.0747 -2.0746 -1.5041 -1.5039 -1.0278 -1.0257 0.3739 0.3747 0.6398 0.6403 1.0010 1.0045 1.1379 1.1452 1.3920 1.3966 1.7545 1.7688 2.2576 2.2912 2.3134 2.3213 3.5060 3.6134 3.6440 3.6685 3.7384 3.7563 3.9148 3.9433 3.9663 3.9786 4.0380 4.0823 4.4546 4.4553 4.6328 4.7065 5.4060 5.4291 5.5986 5.6187 10.2610 10.2616 10.8145 10.8156 12.7659 12.7731 13.3377 13.3416 k =-0.4031 0.4873-0.0000 ( 3004 PWs) bands (ev): -14.5140 -14.5137 -14.0530 -14.0527 -13.6839 -13.6839 -13.5622 -13.5610 -2.8907 -2.8890 -2.0713 -2.0712 -1.5087 -1.5086 -1.0392 -1.0373 0.3639 0.3646 0.6564 0.6568 1.0080 1.0095 1.0760 1.0880 1.3610 1.3654 1.7548 1.7686 2.2543 2.3068 2.3199 2.3292 3.5065 3.6189 3.6539 3.6794 3.7366 3.7544 3.9200 3.9518 3.9677 3.9782 4.0372 4.0858 4.4334 4.4371 4.6278 4.7058 5.3592 5.3839 5.5536 5.5746 10.3266 10.3272 10.8559 10.8571 12.7653 12.7727 13.3193 13.3236 k =-0.3985 0.5039-0.0000 ( 3008 PWs) bands (ev): -14.5038 -14.5035 -14.0403 -14.0399 -13.6773 -13.6773 -13.5566 -13.5554 -2.8735 -2.8717 -2.0683 -2.0682 -1.5133 -1.5132 -1.0496 -1.0478 0.3540 0.3548 0.6738 0.6741 0.9704 0.9729 1.0589 1.0716 1.3192 1.3228 1.7667 1.7797 2.2477 2.3020 2.3377 2.3473 3.5070 3.6235 3.6618 3.6883 3.7349 3.7523 3.9231 3.9567 3.9696 3.9804 4.0369 4.0897 4.4121 4.4182 4.6230 4.7049 5.3147 5.3410 5.5098 5.5317 10.3925 10.3931 10.8974 10.8985 12.7630 12.7706 13.2999 13.3046 k =-0.3939 0.5205-0.0000 ( 3008 PWs) bands (ev): -14.4934 -14.4931 -14.0274 -14.0270 -13.6706 -13.6706 -13.5510 -13.5497 -2.8559 -2.8541 -2.0658 -2.0657 -1.5178 -1.5178 -1.0589 -1.0573 0.3441 0.3449 0.6919 0.6922 0.9064 0.9067 1.0710 1.0814 1.2706 1.2734 1.7856 1.7978 2.2395 2.2935 2.3579 2.3657 3.5077 3.6272 3.6679 3.6949 3.7340 3.7500 3.9237 3.9565 3.9721 3.9859 4.0376 4.0940 4.3910 4.3989 4.6184 4.7037 5.2729 5.3008 5.4677 5.4903 10.4588 10.4594 10.9386 10.9398 12.7590 12.7667 13.2795 13.2846 k =-0.3893 0.5370-0.0000 ( 3008 PWs) bands (ev): -14.4827 -14.4825 -14.0142 -14.0138 -13.6637 -13.6637 -13.5454 -13.5441 -2.8378 -2.8360 -2.0637 -2.0635 -1.5223 -1.5222 -1.0669 -1.0655 0.3340 0.3348 0.7108 0.7111 0.8368 0.8376 1.0862 1.0957 1.2191 1.2208 1.8083 1.8199 2.2304 2.2843 2.3773 2.3834 3.5084 3.6298 3.6721 3.6985 3.7346 3.7476 3.9218 3.9527 3.9751 3.9920 4.0404 4.0985 4.3706 4.3794 4.6139 4.7022 5.2341 5.2634 5.4274 5.4507 10.5254 10.5259 10.9796 10.9808 12.7531 12.7609 13.2581 13.2635 k =-0.3847 0.5536-0.0000 ( 3016 PWs) bands (ev): -14.4720 -14.4717 -14.0008 -14.0004 -13.6566 -13.6566 -13.5399 -13.5385 -2.8195 -2.8176 -2.0621 -2.0619 -1.5266 -1.5265 -1.0738 -1.0726 0.3234 0.3241 0.7304 0.7306 0.7669 0.7683 1.0990 1.1095 1.1682 1.1688 1.8327 1.8438 2.2207 2.2745 2.3955 2.3999 3.5092 3.6314 3.6744 3.6990 3.7369 3.7450 3.9178 3.9470 3.9783 3.9957 4.0466 4.1031 4.3516 4.3601 4.6096 4.7005 5.1983 5.2288 5.3893 5.4131 10.5920 10.5926 11.0201 11.0213 12.7452 12.7530 13.2358 13.2416 k =-0.3801 0.5702-0.0000 ( 3012 PWs) bands (ev): -14.4611 -14.4608 -13.9873 -13.9868 -13.6493 -13.6493 -13.5343 -13.5329 -2.8009 -2.7989 -2.0609 -2.0606 -1.5307 -1.5305 -1.0795 -1.0784 0.3121 0.3126 0.6975 0.6994 0.7509 0.7510 1.0922 1.1036 1.1351 1.1376 1.8574 1.8683 2.2106 2.2645 2.4121 2.4151 3.5101 3.6319 3.6750 3.6969 3.7408 3.7422 3.9119 3.9400 3.9814 3.9960 4.0565 4.1074 4.3345 4.3412 4.6056 4.6987 5.1657 5.1973 5.3535 5.3777 10.6588 10.6593 11.0601 11.0613 12.7351 12.7431 13.2127 13.2188 k =-0.3754 0.5868-0.0000 ( 3014 PWs) bands (ev): -14.4501 -14.4498 -13.9737 -13.9732 -13.6419 -13.6419 -13.5289 -13.5275 -2.7820 -2.7800 -2.0602 -2.0599 -1.5346 -1.5343 -1.0839 -1.0830 0.2997 0.3000 0.6293 0.6315 0.7719 0.7720 1.0494 1.0561 1.1429 1.1443 1.8816 1.8924 2.2002 2.2540 2.4270 2.4285 3.5111 3.6313 3.6740 3.6932 3.7391 3.7455 3.9043 3.9319 3.9841 3.9935 4.0692 4.1110 4.3201 4.3231 4.6018 4.6967 5.1364 5.1687 5.3201 5.3446 10.7257 10.7261 11.0994 11.1007 12.7229 12.7309 13.1887 13.1952 k =-0.3708 0.6034-0.0000 ( 3010 PWs) bands (ev): -14.4390 -14.4387 -13.9601 -13.9596 -13.6344 -13.6344 -13.5236 -13.5221 -2.7630 -2.7610 -2.0599 -2.0595 -1.5383 -1.5380 -1.0871 -1.0864 0.2859 0.2860 0.5624 0.5648 0.7935 0.7937 1.0008 1.0064 1.1550 1.1569 1.9047 1.9154 2.1895 2.2434 2.4400 2.4400 3.5122 3.6296 3.6717 3.6884 3.7356 3.7505 3.8954 3.9230 3.9862 3.9889 4.0839 4.1136 4.3059 4.3090 4.5983 4.6947 5.1105 5.1434 5.2894 5.3139 10.7925 10.7930 11.1380 11.1393 12.7084 12.7164 13.1641 13.1709 k =-0.3662 0.6200-0.0000 ( 3014 PWs) bands (ev): -14.4279 -14.4276 -13.9465 -13.9460 -13.6267 -13.6267 -13.5184 -13.5169 -2.7439 -2.7418 -2.0600 -2.0595 -1.5417 -1.5413 -1.0892 -1.0886 0.2703 0.2704 0.4969 0.4996 0.8158 0.8160 0.9536 0.9589 1.1672 1.1688 1.9260 1.9369 2.1785 2.2325 2.4497 2.4510 3.5132 3.6267 3.6682 3.6829 3.7316 3.7557 3.8853 3.9132 3.9826 3.9874 4.0998 4.1147 4.2899 4.3018 4.5952 4.6928 5.0879 5.1210 5.2614 5.2858 10.8593 10.8597 11.1758 11.1771 12.6916 12.6996 13.1387 13.1458 k =-0.3616 0.6365-0.0000 ( 3014 PWs) bands (ev): -14.4168 -14.4166 -13.9329 -13.9324 -13.6190 -13.6190 -13.5134 -13.5119 -2.7247 -2.7226 -2.0604 -2.0599 -1.5449 -1.5444 -1.0901 -1.0897 0.2525 0.2530 0.4330 0.4359 0.8386 0.8389 0.9094 0.9148 1.1785 1.1795 1.9454 1.9565 2.1674 2.2215 2.4573 2.4600 3.5143 3.6228 3.6636 3.6770 3.7271 3.7608 3.8744 3.9029 3.9751 3.9878 4.1143 4.1166 4.2753 4.2989 4.5925 4.6910 5.0688 5.1017 5.2360 5.2603 10.9261 10.9265 11.2126 11.2140 12.6724 12.6805 13.1128 13.1202 k =-0.3570 0.6531-0.0000 ( 3002 PWs) bands (ev): -14.4058 -14.4056 -13.9194 -13.9189 -13.6112 -13.6112 -13.5085 -13.5070 -2.7056 -2.7034 -2.0611 -2.0605 -1.5478 -1.5472 -1.0900 -1.0897 0.2326 0.2335 0.3708 0.3739 0.8593 0.8607 0.8713 0.8760 1.1886 1.1889 1.9624 1.9739 2.1562 2.2104 2.4631 2.4671 3.5152 3.6179 3.6584 3.6710 3.7221 3.7659 3.8628 3.8920 3.9666 3.9873 4.1123 4.1339 4.2623 4.3003 4.5903 4.6894 5.0531 5.0856 5.2135 5.2374 10.9928 10.9932 11.2486 11.2500 12.6509 12.6590 13.0864 13.0941 k =-0.3524 0.6697-0.0000 ( 3002 PWs) bands (ev): -14.3949 -14.3946 -13.9061 -13.9056 -13.6033 -13.6032 -13.5039 -13.5024 -2.6865 -2.6843 -2.0620 -2.0614 -1.5504 -1.5497 -1.0889 -1.0887 0.2103 0.2117 0.3104 0.3138 0.8306 0.8363 0.8870 0.8878 1.1968 1.1971 1.9769 1.9889 2.1448 2.1992 2.4670 2.4723 3.5161 3.6122 3.6524 3.6647 3.7164 3.7704 3.8508 3.8809 3.9573 3.9857 4.1092 4.1514 4.2509 4.3056 4.5885 4.6882 5.0407 5.0724 5.1937 5.2172 11.0594 11.0598 11.2836 11.2850 12.6271 12.6352 13.0595 13.0675 k =-0.3478 0.6863-0.0000 ( 3002 PWs) bands (ev): -14.3841 -14.3839 -13.8931 -13.8925 -13.5953 -13.5953 -13.4995 -13.4980 -2.6675 -2.6653 -2.0631 -2.0624 -1.5527 -1.5520 -1.0868 -1.0867 0.1857 0.1876 0.2519 0.2558 0.7978 0.8039 0.9113 0.9122 1.2031 1.2041 1.9887 2.0013 2.1333 2.1880 2.4692 2.4756 3.5168 3.6057 3.6458 3.6583 3.7100 3.7743 3.8385 3.8698 3.9474 3.9832 4.1054 4.1687 4.2414 4.3142 4.5872 4.6872 5.0316 5.0622 5.1766 5.1996 11.1261 11.1264 11.3177 11.3191 12.6010 12.6090 13.0323 13.0406 k =-0.3432 0.7029-0.0000 ( 2998 PWs) bands (ev): -14.3735 -14.3733 -13.8802 -13.8796 -13.5873 -13.5872 -13.4954 -13.4939 -2.6487 -2.6465 -2.0643 -2.0636 -1.5547 -1.5539 -1.0838 -1.0838 0.1584 0.1612 0.1955 0.2001 0.7689 0.7753 0.9361 0.9372 1.2076 1.2093 1.9976 2.0108 2.1218 2.1768 2.4701 2.4775 3.5173 3.5988 3.6389 3.6519 3.7031 3.7770 3.8263 3.8591 3.9373 3.9799 4.1014 4.1844 4.2350 4.3255 4.5864 4.6867 5.0258 5.0549 5.1622 5.1846 11.1927 11.1930 11.3508 11.3522 12.5726 12.5805 13.0050 13.0135 k =-0.3385 0.7194-0.0000 ( 2998 PWs) bands (ev): -14.3632 -14.3629 -13.8677 -13.8671 -13.5792 -13.5792 -13.4915 -13.4900 -2.6302 -2.6280 -2.0655 -2.0647 -1.5565 -1.5556 -1.0801 -1.0800 0.1276 0.1324 0.1418 0.1482 0.7438 0.7505 0.9613 0.9627 1.2104 1.2127 2.0036 2.0174 2.1103 2.1655 2.4697 2.4780 3.5176 3.5915 3.6316 3.6455 3.6956 3.7779 3.8141 3.8492 3.9275 3.9760 4.0974 4.1951 4.2347 4.3389 4.5859 4.6865 5.0232 5.0505 5.1504 5.1721 11.2592 11.2595 11.3829 11.3843 12.5420 12.5499 12.9775 12.9862 k =-0.3339 0.7360-0.0000 ( 3000 PWs) bands (ev): -14.3531 -14.3528 -13.8555 -13.8549 -13.5712 -13.5711 -13.4880 -13.4865 -2.6120 -2.6098 -2.0666 -2.0659 -1.5579 -1.5570 -1.0757 -1.0754 0.0870 0.0879 0.1043 0.1068 0.7223 0.7292 0.9866 0.9883 1.2114 1.2143 2.0066 2.0210 2.0988 2.1541 2.4683 2.4773 3.5177 3.5841 3.6241 3.6391 3.6877 3.7763 3.8021 3.8404 3.9184 3.9716 4.0935 4.1973 4.2440 4.3539 4.5858 4.6866 5.0237 5.0490 5.1411 5.1623 11.3259 11.3261 11.4140 11.4154 12.5094 12.5171 12.9501 12.9590 k =-0.3293 0.7526-0.0000 ( 2994 PWs) bands (ev): -14.3432 -14.3430 -13.8437 -13.8430 -13.5631 -13.5630 -13.4847 -13.4832 -2.5941 -2.5920 -2.0677 -2.0669 -1.5591 -1.5581 -1.0705 -1.0702 0.0380 0.0393 0.0734 0.0735 0.7042 0.7113 1.0119 1.0140 1.2108 1.2141 2.0067 2.0216 2.0872 2.1425 2.4663 2.4759 3.5175 3.5767 3.6165 3.6327 3.6795 3.7718 3.7904 3.8326 3.9110 3.9670 4.0898 4.1939 4.2596 4.3701 4.5859 4.6870 5.0273 5.0502 5.1345 5.1550 11.3925 11.3928 11.4442 11.4457 12.4747 12.4823 12.9229 12.9319 k =-0.3247 0.7692-0.0000 ( 2994 PWs) bands (ev): -14.3338 -14.3336 -13.8323 -13.8317 -13.5551 -13.5550 -13.4818 -13.4803 -2.5767 -2.5746 -2.0686 -2.0677 -1.5601 -1.5590 -1.0647 -1.0642 -0.0100 -0.0080 0.0414 0.0421 0.6890 0.6962 1.0369 1.0393 1.2088 1.2125 2.0040 2.0192 2.0755 2.1305 2.4639 2.4739 3.5172 3.5695 3.6089 3.6265 3.6712 3.7646 3.7789 3.8250 3.9058 3.9625 4.0863 4.1887 4.2774 4.3872 4.5861 4.6875 5.0337 5.0541 5.1302 5.1501 11.4592 11.4594 11.4736 11.4751 12.4380 12.4455 12.8959 12.9051 k =-0.3201 0.7858-0.0000 ( 3006 PWs) bands (ev): -14.3248 -14.3246 -13.8214 -13.8208 -13.5471 -13.5470 -13.4792 -13.4777 -2.5598 -2.5577 -2.0693 -2.0684 -1.5608 -1.5597 -1.0583 -1.0578 -0.0557 -0.0534 0.0096 0.0106 0.6764 0.6836 1.0609 1.0636 1.2060 1.2099 1.9988 2.0139 2.0636 2.1181 2.4613 2.4715 3.5165 3.5627 3.6013 3.6205 3.6629 3.7553 3.7676 3.8166 3.9035 3.9583 4.0828 4.1828 4.2960 4.4048 4.5862 4.6878 5.0427 5.0604 5.1284 5.1477 11.5020 11.5033 11.5261 11.5264 12.3994 12.4069 12.8694 12.8787 k =-0.3155 0.8023-0.0000 ( 3004 PWs) bands (ev): -14.3162 -14.3160 -13.8110 -13.8104 -13.5392 -13.5390 -13.4770 -13.4755 -2.5435 -2.5414 -2.0696 -2.0688 -1.5613 -1.5601 -1.0513 -1.0508 -0.0991 -0.0966 -0.0218 -0.0206 0.6661 0.6733 1.0829 1.0855 1.2038 1.2074 1.9910 2.0057 2.0516 2.1050 2.4588 2.4691 3.5156 3.5563 3.5940 3.6147 3.6548 3.7450 3.7564 3.8068 3.9040 3.9544 4.0794 4.1768 4.3149 4.4228 4.5861 4.6881 5.0543 5.0692 5.1291 5.1478 11.5297 11.5311 11.5931 11.5934 12.3591 12.3664 12.8434 12.8528 k =-0.3109 0.8189-0.0000 ( 3004 PWs) bands (ev): -14.3081 -14.3079 -13.8012 -13.8005 -13.5313 -13.5311 -13.4751 -13.4736 -2.5277 -2.5257 -2.0698 -2.0689 -1.5616 -1.5603 -1.0439 -1.0433 -0.1402 -0.1376 -0.0524 -0.0511 0.6578 0.6649 1.1008 1.1026 1.2047 1.2071 1.9808 1.9948 2.0393 2.0915 2.4565 2.4666 3.5147 3.5505 3.5871 3.6092 3.6471 3.7342 3.7453 3.7957 3.9069 3.9512 4.0759 4.1706 4.3336 4.4408 4.5856 4.6879 5.0681 5.0802 5.1323 5.1504 11.5568 11.5581 11.6603 11.6606 12.3170 12.3241 12.8182 12.8277 k =-0.3063 0.8355-0.0000 ( 3002 PWs) bands (ev): -14.3005 -14.3003 -13.7919 -13.7913 -13.5235 -13.5233 -13.4735 -13.4721 -2.5127 -2.5107 -2.0695 -2.0686 -1.5616 -1.5603 -1.0361 -1.0354 -0.1789 -0.1762 -0.0820 -0.0807 0.6513 0.6583 1.1113 1.1114 1.2121 1.2123 1.9684 1.9812 2.0270 2.0774 2.4546 2.4644 3.5135 3.5453 3.5806 3.6040 3.6399 3.7232 3.7342 3.7836 3.9117 3.9486 4.0723 4.1643 4.3522 4.4589 4.5847 4.6873 5.0840 5.0932 5.1377 5.1552 11.5831 11.5844 11.7277 11.7281 12.2732 12.2802 12.7938 12.8033 k =-0.3016 0.8521-0.0000 ( 3004 PWs) bands (ev): -14.2935 -14.2933 -13.7832 -13.7826 -13.5159 -13.5156 -13.4723 -13.4709 -2.4984 -2.4965 -2.0689 -2.0680 -1.5616 -1.5603 -1.0279 -1.0270 -0.2151 -0.2124 -0.1102 -0.1089 0.6464 0.6532 1.1104 1.1122 1.2252 1.2277 1.9535 1.9649 2.0146 2.0629 2.4531 2.4624 3.5123 3.5408 3.5746 3.5990 3.6332 3.7125 3.7233 3.7708 3.9176 3.9466 4.0685 4.1579 4.3704 4.4767 4.5830 4.6860 5.1016 5.1081 5.1456 5.1623 11.6089 11.6101 11.7953 11.7958 12.2278 12.2346 12.7703 12.7798 k =-0.2970 0.8687-0.0000 ( 2994 PWs) bands (ev): -14.2871 -14.2870 -13.7752 -13.7746 -13.5084 -13.5081 -13.4715 -13.4701 -2.4849 -2.4831 -2.0680 -2.0670 -1.5614 -1.5601 -1.0193 -1.0184 -0.2488 -0.2461 -0.1368 -0.1355 0.6429 0.6495 1.1018 1.1051 1.2447 1.2493 1.9362 1.9458 2.0024 2.0484 2.4521 2.4607 3.5110 3.5370 3.5693 3.5945 3.6272 3.7023 3.7124 3.7578 3.9245 3.9454 4.0645 4.1512 4.3882 4.4942 4.5806 4.6840 5.1210 5.1248 5.1555 5.1715 11.6342 11.6354 11.8630 11.8637 12.1810 12.1877 12.7480 12.7575 k =-0.2924 0.8852-0.0000 ( 2998 PWs) bands (ev): -14.2814 -14.2813 -13.7678 -13.7672 -13.5011 -13.5008 -13.4710 -13.4696 -2.4723 -2.4705 -2.0667 -2.0657 -1.5612 -1.5598 -1.0105 -1.0095 -0.2800 -0.2772 -0.1616 -0.1604 0.6408 0.6472 1.0883 1.0924 1.2680 1.2744 1.9164 1.9242 1.9902 2.0338 2.4514 2.4593 3.5096 3.5340 3.5646 3.5902 3.6219 3.6926 3.7016 3.7448 3.9319 3.9449 4.0601 4.1443 4.4056 4.5113 4.5773 4.6811 5.1416 5.1428 5.1675 5.1826 11.6592 11.6602 11.9303 11.9314 12.1329 12.1398 12.7269 12.7363 k =-0.2878 0.9018-0.0000 ( 2996 PWs) bands (ev): -14.2763 -14.2763 -13.7611 -13.7605 -13.4939 -13.4936 -13.4708 -13.4695 -2.4607 -2.4589 -2.0650 -2.0641 -1.5609 -1.5595 -1.0015 -1.0004 -0.3084 -0.3057 -0.1844 -0.1833 0.6400 0.6460 1.0716 1.0762 1.2935 1.3015 1.8941 1.9001 1.9782 2.0194 2.4512 2.4580 3.5081 3.5317 3.5608 3.5864 3.6174 3.6837 3.6912 3.7323 3.9398 3.9450 4.0555 4.1372 4.4224 4.5280 4.5732 4.6774 5.1620 5.1632 5.1813 5.1955 11.6838 11.6847 11.9941 11.9964 12.0863 12.0940 12.7072 12.7165 k =-0.2832 0.9184-0.0000 ( 2996 PWs) bands (ev): -14.2720 -14.2720 -13.7551 -13.7545 -13.4870 -13.4866 -13.4709 -13.4697 -2.4500 -2.4483 -2.0631 -2.0622 -1.5607 -1.5593 -0.9924 -0.9912 -0.3341 -0.3315 -0.2050 -0.2041 0.6404 0.6461 1.0528 1.0577 1.3201 1.3296 1.8693 1.8738 1.9663 2.0053 2.4512 2.4570 3.5067 3.5301 3.5577 3.5829 3.6137 3.6757 3.6811 3.7203 3.9457 3.9479 4.0505 4.1298 4.4387 4.5441 4.5682 4.6729 5.1820 5.1856 5.1969 5.2101 11.7081 11.7090 12.0158 12.0159 12.0840 12.0890 12.6889 12.6980 k =-0.2786 0.9350-0.0000 ( 2994 PWs) bands (ev): -14.2685 -14.2685 -13.7498 -13.7492 -13.4803 -13.4799 -13.4714 -13.4702 -2.4404 -2.4388 -2.0610 -2.0600 -1.5604 -1.5590 -0.9832 -0.9819 -0.3569 -0.3543 -0.2234 -0.2225 0.6420 0.6474 1.0325 1.0376 1.3474 1.3583 1.8423 1.8455 1.9545 1.9916 2.4513 2.4559 3.5054 3.5292 3.5555 3.5798 3.6109 3.6688 3.6715 3.7091 3.9469 3.9560 4.0452 4.1221 4.4544 4.5596 4.5623 4.6675 5.2029 5.2088 5.2140 5.2261 11.7323 11.7330 11.9683 11.9712 12.1474 12.1493 12.6722 12.6811 k =-0.2740 0.9516-0.0000 ( 2998 PWs) bands (ev): -14.2659 -14.2659 -13.7452 -13.7446 -13.4740 -13.4735 -13.4720 -13.4709 -2.4318 -2.4304 -2.0587 -2.0578 -1.5603 -1.5589 -0.9740 -0.9726 -0.3766 -0.3742 -0.2394 -0.2386 0.6449 0.6498 1.0111 1.0163 1.3750 1.3874 1.8133 1.8154 1.9427 1.9783 2.4514 2.4547 3.5042 3.5289 3.5541 3.5770 3.6090 3.6624 3.6630 3.6989 3.9485 3.9642 4.0396 4.1141 4.4695 4.5555 4.5745 4.6612 5.2239 5.2320 5.2324 5.2433 11.7564 11.7569 11.9133 11.9165 12.2170 12.2182 12.6571 12.6658 k =-0.2694 0.9681-0.0000 ( 3006 PWs) bands (ev): -14.2641 -14.2640 -13.7413 -13.7407 -13.4732 -13.4720 -13.4677 -13.4673 -2.4244 -2.4231 -2.0564 -2.0554 -1.5603 -1.5589 -0.9649 -0.9633 -0.3931 -0.3909 -0.2528 -0.2522 0.6489 0.6534 0.9890 0.9941 1.4028 1.4167 1.7824 1.7837 1.9311 1.9653 2.4513 2.4533 3.5032 3.5291 3.5535 3.5745 3.6079 3.6541 3.6584 3.6899 3.9505 3.9722 4.0337 4.1058 4.4839 4.5479 4.5887 4.6543 5.2452 5.2519 5.2554 5.2616 11.7804 11.7807 11.8556 11.8586 12.2881 12.2890 12.6438 12.6522 k =-0.2694 0.9681-0.0000 ( 3006 PWs) bands (ev): -14.2641 -14.2640 -13.7413 -13.7407 -13.4732 -13.4720 -13.4677 -13.4673 -2.4244 -2.4231 -2.0564 -2.0554 -1.5603 -1.5589 -0.9649 -0.9633 -0.3931 -0.3909 -0.2528 -0.2522 0.6489 0.6534 0.9890 0.9941 1.4028 1.4167 1.7824 1.7837 1.9311 1.9653 2.4513 2.4533 3.5032 3.5291 3.5535 3.5745 3.6079 3.6541 3.6584 3.6899 3.9505 3.9722 4.0337 4.1058 4.4839 4.5479 4.5887 4.6543 5.2452 5.2519 5.2554 5.2616 11.7804 11.7807 11.8556 11.8586 12.2881 12.2890 12.6438 12.6522 k =-0.2694 0.9681 0.0174 ( 2998 PWs) bands (ev): -14.2637 -14.2637 -13.7416 -13.7410 -13.4732 -13.4720 -13.4678 -13.4673 -2.4238 -2.4224 -2.0563 -2.0553 -1.5604 -1.5590 -0.9659 -0.9642 -0.3933 -0.3911 -0.2530 -0.2524 0.6491 0.6536 0.9883 0.9934 1.4037 1.4176 1.7819 1.7830 1.9310 1.9650 2.4503 2.4523 3.5034 3.5292 3.5539 3.5747 3.6081 3.6541 3.6584 3.6899 3.9507 3.9725 4.0342 4.1063 4.4850 4.5495 4.5897 4.6555 5.2454 5.2521 5.2556 5.2617 11.7767 11.7769 11.8549 11.8579 12.2895 12.2903 12.6483 12.6567 k =-0.2694 0.9681 0.0349 ( 3002 PWs) bands (ev): -14.2627 -14.2626 -13.7426 -13.7420 -13.4732 -13.4720 -13.4679 -13.4675 -2.4218 -2.4205 -2.0559 -2.0549 -1.5606 -1.5592 -0.9686 -0.9670 -0.3939 -0.3916 -0.2537 -0.2531 0.6495 0.6541 0.9861 0.9913 1.4062 1.4200 1.7804 1.7810 1.9308 1.9638 2.4470 2.4491 3.5039 3.5293 3.5552 3.5750 3.6085 3.6541 3.6582 3.6901 3.9511 3.9732 4.0357 4.1075 4.4881 4.5541 4.5922 4.6592 5.2459 5.2526 5.2562 5.2619 11.7658 11.7659 11.8529 11.8559 12.2935 12.2944 12.6615 12.6697 k =-0.2694 0.9681 0.0523 ( 3000 PWs) bands (ev): -14.2609 -14.2609 -13.7442 -13.7436 -13.4732 -13.4720 -13.4682 -13.4677 -2.4186 -2.4172 -2.0554 -2.0544 -1.5610 -1.5596 -0.9732 -0.9716 -0.3948 -0.3925 -0.2548 -0.2541 0.6503 0.6549 0.9827 0.9878 1.4104 1.4240 1.7777 1.7779 1.9304 1.9620 2.4417 2.4438 3.5048 3.5295 3.5574 3.5756 3.6092 3.6541 3.6580 3.6903 3.9517 3.9743 4.0382 4.1095 4.4936 4.5617 4.5966 4.6654 5.2467 5.2534 5.2572 5.2624 11.7484 11.7485 11.8495 11.8525 12.3003 12.3013 12.6826 12.6905 k =-0.2694 0.9681 0.0697 ( 2996 PWs) bands (ev): -14.2585 -14.2585 -13.7465 -13.7459 -13.4732 -13.4720 -13.4685 -13.4681 -2.4141 -2.4127 -2.0546 -2.0536 -1.5616 -1.5601 -0.9795 -0.9779 -0.3961 -0.3938 -0.2563 -0.2556 0.6515 0.6561 0.9781 0.9832 1.4160 1.4294 1.7732 1.7746 1.9299 1.9595 2.4344 2.4365 3.5061 3.5299 3.5601 3.5765 3.6101 3.6542 3.6577 3.6906 3.9527 3.9759 4.0414 4.1120 4.5012 4.5722 4.6028 4.6740 5.2478 5.2546 5.2585 5.2631 11.7255 11.7258 11.8446 11.8475 12.3098 12.3110 12.7105 12.7181 k =-0.2694 0.9681 0.0872 ( 3002 PWs) bands (ev): -14.2554 -14.2553 -13.7494 -13.7489 -13.4732 -13.4721 -13.4690 -13.4686 -2.4083 -2.4069 -2.0536 -2.0526 -1.5622 -1.5608 -0.9877 -0.9861 -0.3977 -0.3954 -0.2582 -0.2575 0.6529 0.6576 0.9724 0.9775 1.4228 1.4360 1.7676 1.7704 1.9291 1.9564 2.4251 2.4272 3.5078 3.5304 3.5633 3.5775 3.6113 3.6542 3.6574 3.6908 3.9540 3.9778 4.0452 4.1147 4.5112 4.5855 4.6107 4.6848 5.2491 5.2561 5.2600 5.2641 11.6982 11.6987 11.8380 11.8408 12.3224 12.3237 12.7441 12.7514 k =-0.2694 0.9681 0.1046 ( 3005 PWs) bands (ev): -14.2516 -14.2515 -13.7530 -13.7525 -13.4732 -13.4721 -13.4695 -13.4691 -2.4013 -2.3999 -2.0524 -2.0514 -1.5630 -1.5615 -0.9976 -0.9959 -0.3995 -0.3971 -0.2606 -0.2599 0.6548 0.6595 0.9658 0.9710 1.4308 1.4436 1.7611 1.7654 1.9280 1.9528 2.4140 2.4162 3.5100 3.5311 3.5669 3.5787 3.6127 3.6542 3.6570 3.6910 3.9557 3.9802 4.0494 4.1175 4.5235 4.6014 4.6205 4.6979 5.2506 5.2581 5.2616 5.2654 11.6678 11.6685 11.8297 11.8324 12.3379 12.3394 12.7821 12.7890 k =-0.2694 0.9681 0.1220 ( 3009 PWs) bands (ev): -14.2471 -14.2471 -13.7572 -13.7567 -13.4732 -13.4721 -13.4701 -13.4697 -2.3931 -2.3917 -2.0510 -2.0500 -1.5639 -1.5623 -1.0091 -1.0075 -0.4016 -0.3991 -0.2634 -0.2627 0.6569 0.6617 0.9586 0.9638 1.4395 1.4519 1.7539 1.7597 1.9267 1.9486 2.4012 2.4035 3.5128 3.5322 3.5706 3.5801 3.6142 3.6543 3.6566 3.6912 3.9578 3.9829 4.0537 4.1200 4.5381 4.6197 4.6320 4.7129 5.2523 5.2605 5.2633 5.2673 11.6352 11.6361 11.8194 11.8220 12.3564 12.3582 12.8235 12.8300 k =-0.2694 0.9681 0.1395 ( 3009 PWs) bands (ev): -14.2420 -14.2419 -13.7621 -13.7616 -13.4733 -13.4722 -13.4707 -13.4703 -2.3838 -2.3823 -2.0495 -2.0484 -1.5648 -1.5632 -1.0223 -1.0207 -0.4037 -0.4012 -0.2667 -0.2659 0.6595 0.6644 0.9509 0.9561 1.4488 1.4609 1.7461 1.7535 1.9252 1.9442 2.3868 2.3893 3.5162 3.5335 3.5744 3.5817 3.6160 3.6544 3.6563 3.6913 3.9604 3.9859 4.0581 4.1222 4.5551 4.6402 4.6453 4.7299 5.2542 5.2633 5.2650 5.2697 11.6013 11.6024 11.8071 11.8096 12.3781 12.3801 12.8672 12.8733 k =-0.2694 0.9681 0.1569 ( 3009 PWs) bands (ev): -14.2362 -14.2362 -13.7676 -13.7672 -13.4733 -13.4722 -13.4714 -13.4710 -2.3733 -2.3718 -2.0478 -2.0467 -1.5658 -1.5642 -1.0371 -1.0355 -0.4059 -0.4034 -0.2704 -0.2695 0.6625 0.6675 0.9428 0.9481 1.4586 1.4701 1.7378 1.7468 1.9235 1.9394 2.3711 2.3737 3.5200 3.5352 3.5782 3.5834 3.6178 3.6545 3.6559 3.6912 3.9632 3.9892 4.0623 4.1239 4.5742 4.6603 4.6626 4.7484 5.2563 5.2664 5.2666 5.2725 11.5669 11.5681 11.7927 11.7952 12.4029 12.4051 12.9126 12.9183 k =-0.2694 0.9681 0.1743 ( 3018 PWs) bands (ev): -14.2298 -14.2297 -13.7738 -13.7734 -13.4734 -13.4723 -13.4720 -13.4716 -2.3618 -2.3603 -2.0460 -2.0449 -1.5669 -1.5652 -1.0534 -1.0517 -0.4081 -0.4055 -0.2745 -0.2736 0.6658 0.6709 0.9344 0.9398 1.4686 1.4796 1.7293 1.7397 1.9215 1.9345 2.3541 2.3569 3.5242 3.5372 3.5819 3.5852 3.6196 3.6547 3.6555 3.6911 3.9664 3.9926 4.0662 4.1249 4.5953 4.6769 4.6867 4.7684 5.2585 5.2683 5.2699 5.2757 11.5325 11.5339 11.7763 11.7787 12.4307 12.4331 12.9588 12.9641 k =-0.2694 0.9681 0.1917 ( 3020 PWs) bands (ev): -14.2227 -14.2227 -13.7807 -13.7803 -13.4735 -13.4726 -13.4726 -13.4721 -2.3494 -2.3478 -2.0441 -2.0430 -1.5679 -1.5661 -1.0710 -1.0694 -0.4103 -0.4076 -0.2790 -0.2780 0.6696 0.6748 0.9259 0.9315 1.4787 1.4891 1.7206 1.7323 1.9195 1.9295 2.3360 2.3391 3.5290 3.5395 3.5855 3.5872 3.6214 3.6550 3.6551 3.6908 3.9700 3.9962 4.0697 4.1253 4.6182 4.6950 4.7121 4.7896 5.2610 5.2702 5.2736 5.2792 11.4988 11.5002 11.7579 11.7602 12.4615 12.4642 13.0053 13.0101 k =-0.2694 0.9681 0.2092 ( 3016 PWs) bands (ev): -14.2151 -14.2151 -13.7882 -13.7878 -13.4738 -13.4731 -13.4730 -13.4723 -2.3360 -2.3343 -2.0422 -2.0410 -1.5688 -1.5670 -1.0900 -1.0883 -0.4123 -0.4096 -0.2839 -0.2828 0.6738 0.6791 0.9174 0.9231 1.4887 1.4986 1.7119 1.7249 1.9174 1.9245 2.3169 2.3203 3.5341 3.5422 3.5889 3.5893 3.6232 3.6548 3.6553 3.6905 3.9738 3.9998 4.0728 4.1251 4.6426 4.7145 4.7386 4.8116 5.2637 5.2722 5.2777 5.2829 11.4660 11.4675 11.7376 11.7398 12.4951 12.4980 13.0515 13.0559 k =-0.2694 0.9681 0.2266 ( 3022 PWs) bands (ev): -14.2069 -14.2069 -13.7963 -13.7959 -13.4742 -13.4737 -13.4732 -13.4724 -2.3218 -2.3201 -2.0403 -2.0390 -1.5697 -1.5678 -1.1101 -1.1083 -0.4142 -0.4115 -0.2891 -0.2880 0.6783 0.6838 0.9090 0.9147 1.4986 1.5078 1.7033 1.7174 1.9153 1.9197 2.2971 2.3008 3.5395 3.5451 3.5914 3.5922 3.6249 3.6545 3.6557 3.6900 3.9778 4.0035 4.0753 4.1241 4.6682 4.7349 4.7657 4.8342 5.2666 5.2745 5.2819 5.2868 11.4346 11.4361 11.7154 11.7176 12.5313 12.5345 13.0969 13.1008 k =-0.2694 0.9681 0.2440 ( 3018 PWs) bands (ev): -14.1981 -14.1981 -13.8050 -13.8046 -13.4747 -13.4742 -13.4734 -13.4726 -2.3068 -2.3050 -2.0384 -2.0371 -1.5703 -1.5684 -1.1312 -1.1295 -0.4159 -0.4131 -0.2947 -0.2935 0.6833 0.6889 0.9006 0.9065 1.5082 1.5167 1.6950 1.7099 1.9133 1.9152 2.2766 2.2807 3.5452 3.5484 3.5937 3.5953 3.6265 3.6542 3.6562 3.6895 3.9820 4.0072 4.0774 4.1227 4.6949 4.7564 4.7931 4.8570 5.2699 5.2769 5.2864 5.2909 11.4048 11.4064 11.6916 11.6937 12.5701 12.5736 13.1411 13.1445 k =-0.2694 0.9681 0.2615 ( 3017 PWs) bands (ev): -14.1887 -14.1887 -13.8143 -13.8139 -13.4752 -13.4748 -13.4735 -13.4727 -2.2911 -2.2893 -2.0365 -2.0352 -1.5708 -1.5687 -1.1533 -1.1515 -0.4173 -0.4145 -0.3006 -0.2993 0.6886 0.6943 0.8924 0.8985 1.5176 1.5253 1.6868 1.7026 1.9110 1.9115 2.2557 2.2601 3.5510 3.5518 3.5960 3.5982 3.6280 3.6539 3.6567 3.6888 3.9863 4.0108 4.0789 4.1206 4.7222 4.7785 4.8204 4.8796 5.2734 5.2796 5.2910 5.2951 11.3770 11.3785 11.6663 11.6684 12.6112 12.6149 13.1836 13.1865 k =-0.2694 0.9681 0.2789 ( 3017 PWs) bands (ev): -14.1789 -14.1789 -13.8241 -13.8238 -13.4756 -13.4752 -13.4736 -13.4728 -2.2749 -2.2731 -2.0348 -2.0334 -1.5709 -1.5688 -1.1761 -1.1743 -0.4185 -0.4157 -0.3067 -0.3054 0.6942 0.7001 0.8844 0.8906 1.5266 1.5335 1.6791 1.6954 1.9073 1.9100 2.2343 2.2392 3.5554 3.5569 3.5984 3.6009 3.6294 3.6537 3.6572 3.6880 3.9907 4.0144 4.0799 4.1181 4.7497 4.8010 4.8472 4.9018 5.2772 5.2826 5.2957 5.2994 11.3513 11.3528 11.6398 11.6418 12.6543 12.6584 13.2240 13.2264 k =-0.2694 0.9681 0.2963 ( 3009 PWs) bands (ev): -14.1685 -14.1685 -13.8345 -13.8342 -13.4760 -13.4756 -13.4737 -13.4730 -2.2583 -2.2564 -2.0332 -2.0318 -1.5706 -1.5684 -1.1996 -1.1977 -0.4193 -0.4165 -0.3131 -0.3117 0.7001 0.7062 0.8765 0.8828 1.5353 1.5413 1.6717 1.6885 1.9042 1.9089 2.2127 2.2180 3.5592 3.5628 3.6007 3.6034 3.6308 3.6535 3.6578 3.6872 3.9953 4.0180 4.0804 4.1151 4.7774 4.8237 4.8733 4.9232 5.2813 5.2858 5.3006 5.3038 11.3280 11.3294 11.6122 11.6142 12.6994 12.7038 13.2620 13.2638 k =-0.2694 0.9681 0.3138 ( 3017 PWs) bands (ev): -14.1577 -14.1577 -13.8454 -13.8452 -13.4764 -13.4760 -13.4738 -13.4731 -2.2414 -2.2394 -2.0320 -2.0305 -1.5699 -1.5677 -1.2235 -1.2215 -0.4198 -0.4170 -0.3196 -0.3181 0.7063 0.7125 0.8689 0.8753 1.5435 1.5486 1.6648 1.6819 1.9018 1.9083 2.1909 2.1968 3.5630 3.5685 3.6030 3.6055 3.6321 3.6533 3.6583 3.6861 3.9998 4.0214 4.0804 4.1118 4.8046 4.8461 4.8981 4.9435 5.2857 5.2892 5.3054 5.3083 11.3072 11.3085 11.5839 11.5859 12.7461 12.7507 13.2972 13.2984 k =-0.2694 0.9681 0.3312 ( 3019 PWs) bands (ev): -14.1464 -14.1464 -13.8568 -13.8566 -13.4766 -13.4763 -13.4740 -13.4733 -2.2243 -2.2222 -2.0310 -2.0294 -1.5686 -1.5663 -1.2477 -1.2457 -0.4199 -0.4171 -0.3263 -0.3247 0.7127 0.7191 0.8614 0.8680 1.5514 1.5555 1.6583 1.6756 1.9003 1.9083 2.1692 2.1756 3.5668 3.5742 3.6053 3.6074 3.6336 3.6531 3.6588 3.6850 4.0044 4.0247 4.0800 4.1081 4.8313 4.8681 4.9215 4.9624 5.2903 5.2929 5.3103 5.3127 11.2891 11.2903 11.5550 11.5570 12.7942 12.7992 13.3290 13.3295 k =-0.2694 0.9681 0.3486 ( 3017 PWs) bands (ev): -14.1347 -14.1347 -13.8686 -13.8684 -13.4768 -13.4765 -13.4741 -13.4735 -2.2071 -2.2050 -2.0304 -2.0288 -1.5667 -1.5642 -1.2720 -1.2699 -0.4197 -0.4168 -0.3330 -0.3313 0.7193 0.7258 0.8541 0.8608 1.5589 1.5620 1.6523 1.6695 1.8997 1.9091 2.1476 2.1546 3.5706 3.5795 3.6074 3.6090 3.6351 3.6531 3.6593 3.6837 4.0091 4.0281 4.0793 4.1042 4.8570 4.8894 4.9432 4.9796 5.2951 5.2968 5.3152 5.3171 11.2738 11.2749 11.5260 11.5278 12.8434 12.8487 13.3570 13.3571 k =-0.2694 0.9681 0.3661 ( 3015 PWs) bands (ev): -14.1227 -14.1226 -13.8808 -13.8806 -13.4770 -13.4767 -13.4743 -13.4737 -2.1900 -2.1878 -2.0303 -2.0286 -1.5639 -1.5614 -1.2963 -1.2941 -0.4190 -0.4162 -0.3398 -0.3380 0.7260 0.7326 0.8471 0.8539 1.5660 1.5680 1.6467 1.6637 1.9002 1.9108 2.1263 2.1338 3.5744 3.5846 3.6094 3.6102 3.6367 3.6530 3.6597 3.6823 4.0137 4.0313 4.0783 4.1001 4.8815 4.9097 4.9628 4.9950 5.3000 5.3010 5.3200 5.3215 11.2614 11.2623 11.4969 11.4988 12.8935 12.8992 13.3801 13.3810 k =-0.2694 0.9681 0.3835 ( 3019 PWs) bands (ev): -14.1102 -14.1102 -13.8934 -13.8932 -13.4770 -13.4768 -13.4745 -13.4739 -2.1733 -2.1710 -2.0308 -2.0290 -1.5602 -1.5576 -1.3204 -1.3181 -0.4179 -0.4151 -0.3465 -0.3447 0.7328 0.7396 0.8401 0.8470 1.5727 1.5737 1.6415 1.6582 1.9018 1.9133 2.1053 2.1134 3.5780 3.5893 3.6111 3.6113 3.6386 3.6530 3.6600 3.6808 4.0183 4.0344 4.0770 4.0958 4.9046 4.9287 4.9803 5.0083 5.3050 5.3052 5.3247 5.3258 11.2519 11.2527 11.4683 11.4700 12.9442 12.9502 13.3984 13.4001 k =-0.2694 0.9681 0.4009 ( 3017 PWs) bands (ev): -14.0975 -14.0975 -13.9063 -13.9062 -13.4771 -13.4769 -13.4746 -13.4742 -2.1569 -2.1546 -2.0319 -2.0301 -1.5555 -1.5528 -1.3441 -1.3417 -0.4164 -0.4136 -0.3531 -0.3512 0.7397 0.7466 0.8333 0.8403 1.5789 1.5792 1.6367 1.6529 1.9047 1.9170 2.0849 2.0935 3.5816 3.5935 3.6117 3.6129 3.6406 3.6531 3.6603 3.6791 4.0230 4.0374 4.0754 4.0915 4.9261 4.9464 4.9954 5.0196 5.3094 5.3097 5.3291 5.3298 11.2455 11.2462 11.4402 11.4419 12.9952 13.0015 13.4113 13.4139 k =-0.2694 0.9681 0.4184 ( 3013 PWs) bands (ev): -14.0844 -14.0844 -13.9195 -13.9194 -13.4770 -13.4769 -13.4748 -13.4744 -2.1411 -2.1387 -2.0338 -2.0319 -1.5496 -1.5468 -1.3672 -1.3647 -0.4144 -0.4117 -0.3597 -0.3576 0.7466 0.7536 0.8266 0.8337 1.5839 1.5853 1.6323 1.6477 1.9089 1.9217 2.0650 2.0743 3.5850 3.5971 3.6121 3.6143 3.6428 3.6532 3.6605 3.6773 4.0276 4.0404 4.0738 4.0871 4.9456 4.9623 5.0083 5.0286 5.3135 5.3142 5.3333 5.3337 11.2421 11.2426 11.4131 11.4146 13.0460 13.0526 13.4182 13.4217 k =-0.2694 0.9681 0.4358 ( 3021 PWs) bands (ev): -14.0712 -14.0711 -13.9330 -13.9328 -13.4770 -13.4769 -13.4750 -13.4747 -2.1261 -2.1237 -2.0366 -2.0345 -1.5424 -1.5396 -1.3895 -1.3870 -0.4121 -0.4094 -0.3660 -0.3639 0.7535 0.7605 0.8200 0.8271 1.5885 1.5911 1.6281 1.6427 1.9145 1.9277 2.0458 2.0557 3.5882 3.6000 3.6123 3.6153 3.6451 3.6533 3.6607 3.6753 4.0322 4.0432 4.0719 4.0825 4.9630 4.9764 5.0187 5.0355 5.3174 5.3183 5.3370 5.3372 11.2418 11.2421 11.3871 11.3885 13.0963 13.1032 13.4187 13.4230 k =-0.2694 0.9681 0.4532 ( 3021 PWs) bands (ev): -14.0577 -14.0576 -13.9466 -13.9465 -13.4768 -13.4768 -13.4752 -13.4749 -2.1119 -2.1095 -2.0403 -2.0382 -1.5338 -1.5310 -1.4109 -1.4083 -0.4092 -0.4066 -0.3721 -0.3699 0.7603 0.7675 0.8134 0.8206 1.5929 1.5967 1.6242 1.6378 1.9215 1.9348 2.0275 2.0380 3.5911 3.6019 3.6127 3.6162 3.6474 3.6536 3.6609 3.6733 4.0367 4.0459 4.0699 4.0781 4.9782 4.9883 5.0269 5.0403 5.3208 5.3217 5.3403 5.3403 11.2445 11.2446 11.3626 11.3639 13.1455 13.1526 13.4122 13.4174 k =-0.2694 0.9681 0.4707 ( 3025 PWs) bands (ev): -14.0440 -14.0439 -13.9604 -13.9603 -13.4767 -13.4767 -13.4754 -13.4752 -2.0988 -2.0964 -2.0450 -2.0428 -1.5238 -1.5209 -1.4312 -1.4286 -0.4060 -0.4034 -0.3780 -0.3757 0.7671 0.7743 0.8069 0.8141 1.5970 1.6021 1.6204 1.6329 1.9300 1.9432 2.0102 2.0212 3.5939 3.6028 3.6134 3.6166 3.6496 3.6537 3.6613 3.6711 4.0411 4.0483 4.0680 4.0737 4.9907 4.9980 5.0331 5.0432 5.3237 5.3245 5.3429 5.3430 11.2501 11.2501 11.3398 11.3409 13.1930 13.2004 13.3987 13.4046 k =-0.2694 0.9681 0.4881 ( 3029 PWs) bands (ev): -14.0302 -14.0301 -13.9743 -13.9742 -13.4766 -13.4766 -13.4756 -13.4754 -2.0868 -2.0844 -2.0509 -2.0487 -1.5122 -1.5093 -1.4503 -1.4476 -0.4023 -0.3998 -0.3835 -0.3812 0.7739 0.7811 0.8004 0.8077 1.6009 1.6070 1.6171 1.6281 1.9398 1.9528 1.9940 2.0054 3.5963 3.6027 3.6143 3.6167 3.6514 3.6539 3.6619 3.6688 4.0453 4.0504 4.0662 4.0697 5.0005 5.0051 5.0375 5.0443 5.3259 5.3265 5.3448 5.3449 11.2584 11.2587 11.3189 11.3199 13.2382 13.2457 13.3782 13.3848 k =-0.2694 0.9681 0.5055 ( 3030 PWs) bands (ev): -14.0162 -14.0162 -13.9883 -13.9882 -13.4765 -13.4765 -13.4757 -13.4756 -2.0760 -2.0736 -2.0580 -2.0557 -1.4990 -1.4962 -1.4680 -1.4653 -0.3982 -0.3958 -0.3887 -0.3864 0.7805 0.7877 0.7940 0.8011 1.6047 1.6100 1.6155 1.6233 1.9509 1.9630 1.9797 1.9909 3.5985 3.6018 3.6152 3.6165 3.6528 3.6538 3.6631 3.6667 4.0489 4.0516 4.0649 4.0664 5.0070 5.0092 5.0406 5.0440 5.3273 5.3276 5.3460 5.3461 11.2695 11.2699 11.3003 11.3011 13.2802 13.2877 13.3512 13.3582 k =-0.2694 0.9681 0.5229 ( 3026 PWs) bands (ev): -14.0025 -14.0025 -14.0019 -14.0019 -13.4764 -13.4764 -13.4757 -13.4757 -2.0668 -2.0668 -2.0636 -2.0636 -1.4843 -1.4843 -1.4814 -1.4814 -0.3939 -0.3939 -0.3910 -0.3910 0.7871 0.7871 0.7947 0.7947 1.6081 1.6081 1.6187 1.6187 1.9627 1.9627 1.9784 1.9784 3.6004 3.6004 3.6160 3.6160 3.6536 3.6536 3.6647 3.6647 4.0513 4.0513 4.0647 4.0647 5.0099 5.0099 5.0428 5.0428 5.3279 5.3279 5.3464 5.3464 11.2811 11.2811 11.2867 11.2867 13.3176 13.3176 13.3262 13.3262 k =-0.2694 0.9681 0.5229 ( 3026 PWs) bands (ev): -14.0025 -14.0025 -14.0019 -14.0019 -13.4764 -13.4764 -13.4757 -13.4757 -2.0668 -2.0668 -2.0636 -2.0636 -1.4843 -1.4843 -1.4814 -1.4814 -0.3939 -0.3939 -0.3910 -0.3910 0.7871 0.7871 0.7947 0.7947 1.6081 1.6081 1.6187 1.6187 1.9627 1.9627 1.9784 1.9784 3.6004 3.6004 3.6160 3.6160 3.6536 3.6536 3.6647 3.6647 4.0513 4.0513 4.0647 4.0647 5.0099 5.0099 5.0428 5.0428 5.3279 5.3279 5.3464 5.3464 11.2811 11.2811 11.2867 11.2867 13.3176 13.3176 13.3262 13.3262 k =-0.2740 0.9516 0.5229 ( 3030 PWs) bands (ev): -14.0043 -14.0043 -14.0036 -14.0036 -13.4803 -13.4803 -13.4795 -13.4795 -2.0708 -2.0708 -2.0675 -2.0675 -1.4924 -1.4924 -1.4896 -1.4896 -0.3755 -0.3755 -0.3724 -0.3724 0.7968 0.7968 0.8047 0.8047 1.6061 1.6061 1.6172 1.6172 1.9684 1.9684 1.9852 1.9852 3.6010 3.6010 3.6204 3.6204 3.6585 3.6585 3.6698 3.6698 4.0519 4.0519 4.0662 4.0662 4.9980 4.9980 5.0324 5.0324 5.3143 5.3143 5.3334 5.3334 11.2992 11.2992 11.3048 11.3048 13.2528 13.2528 13.2612 13.2612 k =-0.2786 0.9350 0.5229 ( 3026 PWs) bands (ev): -14.0068 -14.0068 -14.0059 -14.0059 -13.4845 -13.4845 -13.4836 -13.4836 -2.0759 -2.0759 -2.0726 -2.0726 -1.4997 -1.4997 -1.4969 -1.4969 -0.3543 -0.3543 -0.3510 -0.3510 0.8059 0.8059 0.8141 0.8141 1.6035 1.6035 1.6149 1.6149 1.9748 1.9748 1.9926 1.9926 3.6021 3.6021 3.6247 3.6247 3.6650 3.6650 3.6759 3.6759 4.0522 4.0522 4.0673 4.0673 4.9854 4.9854 5.0213 5.0213 5.3017 5.3017 5.3212 5.3212 11.3172 11.3172 11.3226 11.3226 13.1887 13.1887 13.1968 13.1968 k =-0.2832 0.9184 0.5229 ( 3026 PWs) bands (ev): -14.0100 -14.0100 -14.0090 -14.0090 -13.4891 -13.4891 -13.4880 -13.4880 -2.0820 -2.0820 -2.0787 -2.0787 -1.5060 -1.5060 -1.5034 -1.5034 -0.3306 -0.3306 -0.3269 -0.3269 0.8144 0.8144 0.8229 0.8229 1.6003 1.6003 1.6119 1.6119 1.9819 1.9819 2.0004 2.0004 3.6036 3.6036 3.6288 3.6288 3.6728 3.6728 3.6830 3.6830 4.0520 4.0520 4.0680 4.0680 4.9722 4.9722 5.0098 5.0098 5.2901 5.2901 5.3099 5.3099 11.3348 11.3348 11.3402 11.3402 13.1253 13.1253 13.1332 13.1332 k =-0.2878 0.9018 0.5229 ( 3026 PWs) bands (ev): -14.0139 -14.0139 -14.0128 -14.0128 -13.4940 -13.4940 -13.4928 -13.4928 -2.0891 -2.0891 -2.0857 -2.0857 -1.5116 -1.5116 -1.5090 -1.5090 -0.3043 -0.3043 -0.3004 -0.3004 0.8220 0.8220 0.8309 0.8309 1.5964 1.5964 1.6082 1.6082 1.9894 1.9894 2.0086 2.0086 3.6058 3.6058 3.6329 3.6329 3.6817 3.6817 3.6909 3.6909 4.0514 4.0514 4.0681 4.0681 4.9588 4.9588 4.9978 4.9978 5.2796 5.2796 5.2995 5.2995 11.3521 11.3521 11.3574 11.3574 13.0625 13.0625 13.0702 13.0702 k =-0.2924 0.8852 0.5229 ( 3018 PWs) bands (ev): -14.0185 -14.0185 -14.0172 -14.0172 -13.4993 -13.4993 -13.4979 -13.4979 -2.0969 -2.0969 -2.0936 -2.0936 -1.5162 -1.5162 -1.5137 -1.5137 -0.2756 -0.2756 -0.2714 -0.2714 0.8288 0.8288 0.8381 0.8381 1.5919 1.5919 1.6038 1.6038 1.9974 1.9974 2.0170 2.0170 3.6085 3.6085 3.6371 3.6371 3.6914 3.6914 3.6998 3.6998 4.0504 4.0504 4.0678 4.0678 4.9454 4.9454 4.9858 4.9858 5.2702 5.2702 5.2901 5.2901 11.3689 11.3689 11.3740 11.3740 13.0004 13.0004 13.0079 13.0079 k =-0.2970 0.8687 0.5229 ( 3022 PWs) bands (ev): -14.0236 -14.0236 -14.0223 -14.0223 -13.5049 -13.5049 -13.5034 -13.5034 -2.1055 -2.1055 -2.1022 -2.1022 -1.5200 -1.5200 -1.5176 -1.5176 -0.2445 -0.2445 -0.2400 -0.2400 0.8347 0.8347 0.8444 0.8444 1.5869 1.5869 1.5988 1.5988 2.0057 2.0057 2.0255 2.0255 3.6118 3.6118 3.6414 3.6414 3.7013 3.7013 3.7096 3.7096 4.0490 4.0490 4.0670 4.0670 4.9322 4.9322 4.9739 4.9739 5.2618 5.2618 5.2817 5.2817 11.3851 11.3851 11.3900 11.3900 12.9389 12.9389 12.9462 12.9462 k =-0.3016 0.8521 0.5229 ( 3022 PWs) bands (ev): -14.0294 -14.0294 -14.0279 -14.0279 -13.5109 -13.5109 -13.5093 -13.5093 -2.1148 -2.1148 -2.1115 -2.1115 -1.5230 -1.5230 -1.5206 -1.5206 -0.2112 -0.2112 -0.2064 -0.2064 0.8397 0.8397 0.8499 0.8499 1.5814 1.5814 1.5933 1.5933 2.0141 2.0141 2.0340 2.0340 3.6155 3.6155 3.6458 3.6458 3.7113 3.7113 3.7206 3.7206 4.0472 4.0472 4.0658 4.0658 4.9195 4.9195 4.9623 4.9623 5.2544 5.2544 5.2741 5.2741 11.4005 11.4005 11.4053 11.4053 12.8781 12.8781 12.8852 12.8852 k =-0.3063 0.8355 0.5229 ( 3030 PWs) bands (ev): -14.0357 -14.0357 -14.0342 -14.0342 -13.5172 -13.5172 -13.5154 -13.5154 -2.1247 -2.1247 -2.1214 -2.1214 -1.5251 -1.5251 -1.5227 -1.5227 -0.1757 -0.1757 -0.1706 -0.1706 0.8437 0.8437 0.8545 0.8545 1.5754 1.5754 1.5873 1.5873 2.0223 2.0223 2.0421 2.0421 3.6198 3.6198 3.6504 3.6504 3.7212 3.7212 3.7326 3.7326 4.0451 4.0451 4.0642 4.0642 4.9077 4.9077 4.9514 4.9514 5.2481 5.2481 5.2675 5.2675 11.4149 11.4149 11.4195 11.4195 12.8179 12.8179 12.8249 12.8249 k =-0.3109 0.8189 0.5229 ( 3030 PWs) bands (ev): -14.0426 -14.0426 -14.0409 -14.0409 -13.5238 -13.5238 -13.5219 -13.5219 -2.1351 -2.1351 -2.1318 -2.1318 -1.5265 -1.5265 -1.5240 -1.5240 -0.1382 -0.1382 -0.1326 -0.1326 0.8468 0.8468 0.8583 0.8583 1.5691 1.5691 1.5809 1.5809 2.0303 2.0303 2.0499 2.0499 3.6246 3.6246 3.6552 3.6552 3.7311 3.7311 3.7453 3.7453 4.0427 4.0427 4.0623 4.0623 4.8969 4.8969 4.9414 4.9414 5.2427 5.2427 5.2619 5.2619 11.4282 11.4282 11.4327 11.4327 12.7583 12.7583 12.7651 12.7651 k =-0.3155 0.8023 0.5229 ( 3030 PWs) bands (ev): -14.0499 -14.0499 -14.0481 -14.0481 -13.5307 -13.5307 -13.5287 -13.5287 -2.1460 -2.1460 -2.1427 -2.1427 -1.5270 -1.5270 -1.5245 -1.5245 -0.0986 -0.0986 -0.0926 -0.0926 0.8489 0.8489 0.8612 0.8612 1.5625 1.5625 1.5742 1.5742 2.0378 2.0378 2.0569 2.0569 3.6298 3.6298 3.6602 3.6602 3.7409 3.7409 3.7585 3.7585 4.0402 4.0402 4.0600 4.0600 4.8875 4.8875 4.9326 4.9326 5.2384 5.2384 5.2572 5.2572 11.4403 11.4403 11.4445 11.4445 12.6993 12.6993 12.7060 12.7060 k =-0.3201 0.7858 0.5229 ( 3030 PWs) bands (ev): -14.0577 -14.0577 -14.0558 -14.0558 -13.5379 -13.5379 -13.5358 -13.5358 -2.1573 -2.1573 -2.1540 -2.1540 -1.5268 -1.5268 -1.5242 -1.5242 -0.0572 -0.0572 -0.0507 -0.0507 0.8501 0.8501 0.8635 0.8635 1.5558 1.5558 1.5673 1.5673 2.0445 2.0445 2.0631 2.0631 3.6354 3.6354 3.6653 3.6653 3.7506 3.7506 3.7720 3.7720 4.0374 4.0374 4.0577 4.0577 4.8797 4.8797 4.9251 4.9251 5.2350 5.2350 5.2535 5.2535 11.4509 11.4509 11.4549 11.4549 12.6410 12.6410 12.6475 12.6475 k =-0.3247 0.7692 0.5229 ( 3026 PWs) bands (ev): -14.0659 -14.0659 -14.0639 -14.0639 -13.5453 -13.5453 -13.5432 -13.5432 -2.1690 -2.1690 -2.1657 -2.1657 -1.5258 -1.5258 -1.5231 -1.5231 -0.0141 -0.0141 -0.0070 -0.0070 0.8506 0.8506 0.8651 0.8651 1.5489 1.5489 1.5603 1.5603 2.0502 2.0502 2.0682 2.0682 3.6412 3.6412 3.6704 3.6704 3.7601 3.7601 3.7858 3.7858 4.0347 4.0347 4.0553 4.0553 4.8737 4.8737 4.9192 4.9192 5.2326 5.2326 5.2509 5.2509 11.4599 11.4599 11.4636 11.4636 12.5832 12.5832 12.5895 12.5895 k =-0.3293 0.7526 0.5229 ( 3022 PWs) bands (ev): -14.0744 -14.0744 -14.0724 -14.0724 -13.5530 -13.5530 -13.5508 -13.5508 -2.1809 -2.1809 -2.1777 -2.1777 -1.5241 -1.5241 -1.5214 -1.5214 0.0307 0.0307 0.0384 0.0384 0.8504 0.8504 0.8662 0.8662 1.5421 1.5421 1.5533 1.5533 2.0546 2.0546 2.0719 2.0719 3.6472 3.6472 3.6755 3.6755 3.7694 3.7694 3.7995 3.7995 4.0319 4.0319 4.0529 4.0529 4.8696 4.8696 4.9150 4.9150 5.2312 5.2312 5.2495 5.2495 11.4670 11.4670 11.4706 11.4706 12.5260 12.5260 12.5322 12.5322 k =-0.3339 0.7360 0.5229 ( 3034 PWs) bands (ev): -14.0834 -14.0834 -14.0813 -14.0813 -13.5610 -13.5610 -13.5587 -13.5587 -2.1932 -2.1932 -2.1900 -2.1900 -1.5219 -1.5219 -1.5190 -1.5190 0.0769 0.0769 0.0853 0.0853 0.8496 0.8496 0.8669 0.8669 1.5353 1.5353 1.5462 1.5462 2.0576 2.0576 2.0742 2.0742 3.6531 3.6531 3.6804 3.6804 3.7784 3.7784 3.8132 3.8132 4.0291 4.0291 4.0506 4.0506 4.8675 4.8675 4.9125 4.9125 5.2308 5.2308 5.2491 5.2491 11.4723 11.4723 11.4755 11.4755 12.4694 12.4694 12.4755 12.4755 k =-0.3385 0.7194 0.5229 ( 3030 PWs) bands (ev): -14.0926 -14.0926 -14.0904 -14.0904 -13.5691 -13.5691 -13.5668 -13.5668 -2.2057 -2.2057 -2.2025 -2.2025 -1.5189 -1.5189 -1.5159 -1.5159 0.1243 0.1243 0.1336 0.1336 0.8484 0.8484 0.8674 0.8674 1.5286 1.5286 1.5394 1.5394 2.0590 2.0590 2.0748 2.0748 3.6589 3.6589 3.6853 3.6853 3.7869 3.7869 3.8266 3.8266 4.0266 4.0266 4.0488 4.0488 4.8676 4.8676 4.9120 4.9120 5.2316 5.2316 5.2502 5.2502 11.4754 11.4754 11.4784 11.4784 12.4135 12.4135 12.4194 12.4194 k =-0.3432 0.7029 0.5229 ( 3026 PWs) bands (ev): -14.1021 -14.1021 -14.0999 -14.0999 -13.5774 -13.5774 -13.5750 -13.5750 -2.2183 -2.2183 -2.2152 -2.2152 -1.5153 -1.5153 -1.5121 -1.5121 0.1727 0.1727 0.1829 0.1829 0.8470 0.8470 0.8680 0.8680 1.5221 1.5221 1.5327 1.5327 2.0585 2.0585 2.0737 2.0737 3.6644 3.6644 3.6899 3.6899 3.7949 3.7949 3.8396 3.8396 4.0242 4.0242 4.0475 4.0475 4.8698 4.8698 4.9134 4.9134 5.2337 5.2337 5.2529 5.2529 11.4762 11.4762 11.4790 11.4790 12.3581 12.3581 12.3639 12.3639 k =-0.3478 0.6863 0.5229 ( 3022 PWs) bands (ev): -14.1118 -14.1118 -14.1095 -14.1095 -13.5859 -13.5859 -13.5835 -13.5835 -2.2312 -2.2312 -2.2281 -2.2281 -1.5111 -1.5111 -1.5078 -1.5078 0.2217 0.2217 0.2330 0.2330 0.8458 0.8458 0.8688 0.8688 1.5160 1.5160 1.5265 1.5265 2.0560 2.0560 2.0707 2.0707 3.6695 3.6695 3.6943 3.6943 3.8023 3.8023 3.8521 3.8521 4.0222 4.0222 4.0468 4.0468 4.8740 4.8740 4.9168 4.9168 5.2372 5.2372 5.2573 5.2573 11.4747 11.4747 11.4772 11.4772 12.3034 12.3034 12.3091 12.3091 k =-0.3524 0.6697 0.5229 ( 3026 PWs) bands (ev): -14.1217 -14.1217 -14.1194 -14.1194 -13.5945 -13.5945 -13.5920 -13.5920 -2.2441 -2.2441 -2.2411 -2.2411 -1.5064 -1.5064 -1.5029 -1.5029 0.2709 0.2709 0.2835 0.2835 0.8449 0.8449 0.8704 0.8704 1.5103 1.5103 1.5206 1.5206 2.0515 2.0515 2.0657 2.0657 3.6739 3.6739 3.6981 3.6981 3.8089 3.8089 3.8637 3.8637 4.0206 4.0206 4.0469 4.0469 4.8800 4.8800 4.9220 4.9220 5.2423 5.2423 5.2635 5.2635 11.4707 11.4707 11.4729 11.4729 12.2493 12.2493 12.2549 12.2549 k =-0.3570 0.6531 0.5229 ( 3022 PWs) bands (ev): -14.1317 -14.1317 -14.1294 -14.1294 -13.6033 -13.6033 -13.6007 -13.6007 -2.2572 -2.2572 -2.2542 -2.2542 -1.5011 -1.5011 -1.4974 -1.4974 0.3197 0.3197 0.3338 0.3338 0.8449 0.8449 0.8730 0.8730 1.5051 1.5051 1.5154 1.5154 2.0448 2.0448 2.0588 2.0588 3.6776 3.6776 3.7015 3.7015 3.8148 3.8148 3.8743 3.8743 4.0196 4.0196 4.0479 4.0479 4.8877 4.8877 4.9289 4.9289 5.2493 5.2493 5.2720 5.2720 11.4641 11.4641 11.4661 11.4661 12.1959 12.1959 12.2013 12.2013 k =-0.3616 0.6365 0.5229 ( 3022 PWs) bands (ev): -14.1419 -14.1419 -14.1396 -14.1396 -13.6121 -13.6121 -13.6095 -13.6095 -2.2703 -2.2703 -2.2673 -2.2673 -1.4953 -1.4953 -1.4914 -1.4914 0.3676 0.3676 0.3834 0.3834 0.8464 0.8464 0.8772 0.8772 1.5006 1.5006 1.5110 1.5110 2.0360 2.0360 2.0499 2.0499 3.6805 3.6805 3.7041 3.7041 3.8198 3.8198 3.8837 3.8837 4.0195 4.0195 4.0498 4.0498 4.8967 4.8967 4.9372 4.9372 5.2586 5.2586 5.2828 5.2828 11.4549 11.4549 11.4566 11.4566 12.1431 12.1431 12.1485 12.1485 k =-0.3662 0.6200 0.5229 ( 3026 PWs) bands (ev): -14.1522 -14.1522 -14.1498 -14.1498 -13.6209 -13.6209 -13.6183 -13.6183 -2.2834 -2.2834 -2.2805 -2.2805 -1.4890 -1.4890 -1.4850 -1.4850 0.4137 0.4137 0.4312 0.4312 0.8499 0.8499 0.8836 0.8836 1.4968 1.4968 1.5074 1.5074 2.0251 2.0251 2.0390 2.0390 3.6824 3.6824 3.7060 3.7060 3.8239 3.8239 3.8917 3.8917 4.0202 4.0202 4.0525 4.0525 4.9067 4.9067 4.9468 4.9468 5.2704 5.2704 5.2963 5.2963 11.4430 11.4430 11.4445 11.4445 12.0911 12.0911 12.0964 12.0964 k =-0.3708 0.6034 0.5229 ( 3022 PWs) bands (ev): -14.1625 -14.1625 -14.1601 -14.1601 -13.6298 -13.6298 -13.6272 -13.6272 -2.2965 -2.2965 -2.2937 -2.2937 -1.4822 -1.4822 -1.4780 -1.4780 0.4569 0.4569 0.4763 0.4763 0.8564 0.8564 0.8931 0.8931 1.4941 1.4941 1.5051 1.5051 2.0121 2.0121 2.0263 2.0263 3.6834 3.6834 3.7069 3.7069 3.8274 3.8274 3.8981 3.8981 4.0220 4.0220 4.0560 4.0560 4.9174 4.9174 4.9571 4.9571 5.2852 5.2852 5.3126 5.3126 11.4284 11.4284 11.4298 11.4298 12.0399 12.0399 12.0450 12.0450 k =-0.3754 0.5868 0.5229 ( 3010 PWs) bands (ev): -14.1727 -14.1727 -14.1704 -14.1704 -13.6386 -13.6386 -13.6360 -13.6360 -2.3096 -2.3096 -2.3069 -2.3069 -1.4750 -1.4750 -1.4707 -1.4707 0.4964 0.4964 0.5173 0.5173 0.8670 0.8670 0.9062 0.9062 1.4927 1.4927 1.5043 1.5043 1.9973 1.9973 2.0117 2.0117 3.6833 3.6833 3.7069 3.7069 3.8301 3.8301 3.9029 3.9029 4.0249 4.0249 4.0601 4.0601 4.9283 4.9283 4.9680 4.9680 5.3034 5.3034 5.3321 5.3321 11.4111 11.4111 11.4125 11.4125 11.9894 11.9894 11.9945 11.9945 k =-0.3801 0.5702 0.5229 ( 3010 PWs) bands (ev): -14.1830 -14.1830 -14.1807 -14.1807 -13.6474 -13.6474 -13.6449 -13.6449 -2.3226 -2.3226 -2.3200 -2.3200 -1.4674 -1.4674 -1.4629 -1.4629 0.5309 0.5309 0.5528 0.5528 0.8824 0.8824 0.9236 0.9236 1.4929 1.4929 1.5053 1.5053 1.9807 1.9807 1.9955 1.9955 3.6822 3.6822 3.7056 3.7056 3.8320 3.8320 3.9060 3.9060 4.0287 4.0287 4.0647 4.0647 4.9393 4.9393 4.9788 4.9788 5.3251 5.3251 5.3547 5.3547 11.3911 11.3911 11.3926 11.3926 11.9398 11.9398 11.9449 11.9449 k =-0.3847 0.5536 0.5229 ( 3012 PWs) bands (ev): -14.1932 -14.1932 -14.1909 -14.1909 -13.6562 -13.6562 -13.6536 -13.6536 -2.3356 -2.3356 -2.3330 -2.3330 -1.4594 -1.4594 -1.4548 -1.4548 0.5599 0.5599 0.5819 0.5819 0.9034 0.9034 0.9454 0.9454 1.4953 1.4953 1.5086 1.5086 1.9626 1.9626 1.9777 1.9777 3.6799 3.6799 3.7032 3.7032 3.8333 3.8333 3.9076 3.9076 4.0332 4.0332 4.0694 4.0694 4.9499 4.9499 4.9892 4.9892 5.3506 5.3506 5.3807 5.3807 11.3685 11.3685 11.3701 11.3701 11.8912 11.8912 11.8961 11.8961 k =-0.3893 0.5370 0.5229 ( 3008 PWs) bands (ev): -14.2033 -14.2033 -14.2011 -14.2011 -13.6649 -13.6649 -13.6623 -13.6623 -2.3484 -2.3484 -2.3459 -2.3459 -1.4510 -1.4510 -1.4464 -1.4464 0.5832 0.5832 0.6044 0.6044 0.9293 0.9293 0.9710 0.9710 1.5003 1.5003 1.5147 1.5147 1.9433 1.9433 1.9585 1.9585 3.6766 3.6766 3.6997 3.6997 3.8340 3.8340 3.9079 3.9079 4.0383 4.0383 4.0744 4.0744 4.9602 4.9602 4.9990 4.9990 5.3799 5.3799 5.4101 5.4101 11.3435 11.3435 11.3453 11.3453 11.8435 11.8435 11.8484 11.8484 k =-0.3939 0.5205 0.5229 ( 3004 PWs) bands (ev): -14.2133 -14.2133 -14.2111 -14.2111 -13.6734 -13.6734 -13.6709 -13.6709 -2.3610 -2.3610 -2.3586 -2.3586 -1.4424 -1.4424 -1.4377 -1.4377 0.6011 0.6011 0.6209 0.6209 0.9589 0.9589 0.9993 0.9993 1.5087 1.5087 1.5244 1.5244 1.9230 1.9230 1.9382 1.9382 3.6722 3.6722 3.6949 3.6949 3.8342 3.8342 3.9072 3.9072 4.0436 4.0436 4.0792 4.0792 4.9698 4.9698 5.0080 5.0080 5.4130 5.4130 5.4426 5.4426 11.3161 11.3161 11.3182 11.3182 11.7968 11.7968 11.8016 11.8016 k =-0.3985 0.5039 0.5229 ( 3008 PWs) bands (ev): -14.2231 -14.2231 -14.2209 -14.2209 -13.6818 -13.6818 -13.6793 -13.6793 -2.3734 -2.3734 -2.3711 -2.3711 -1.4335 -1.4335 -1.4287 -1.4287 0.6144 0.6144 0.6325 0.6325 0.9900 0.9900 1.0283 1.0283 1.5213 1.5213 1.5383 1.5383 1.9021 1.9021 1.9169 1.9169 3.6666 3.6666 3.6889 3.6889 3.8338 3.8338 3.9055 3.9055 4.0490 4.0490 4.0839 4.0839 4.9789 4.9789 5.0162 5.0162 5.4495 5.4495 5.4783 5.4783 11.2866 11.2866 11.2890 11.2890 11.7512 11.7512 11.7560 11.7560 k =-0.4031 0.4873 0.5229 ( 3008 PWs) bands (ev): -14.2327 -14.2327 -14.2306 -14.2306 -13.6900 -13.6900 -13.6876 -13.6876 -2.3856 -2.3856 -2.3834 -2.3834 -1.4244 -1.4244 -1.4195 -1.4195 0.6240 0.6240 0.6407 0.6407 1.0205 1.0205 1.0561 1.0561 1.5388 1.5388 1.5572 1.5572 1.8809 1.8809 1.8951 1.8951 3.6597 3.6597 3.6818 3.6818 3.8329 3.8329 3.9030 3.9030 4.0543 4.0543 4.0883 4.0883 4.9874 4.9874 5.0234 5.0234 5.4892 5.4892 5.5167 5.5167 11.2551 11.2551 11.2578 11.2578 11.7067 11.7067 11.7115 11.7115 k =-0.4077 0.4707 0.5229 ( 3012 PWs) bands (ev): -14.2421 -14.2421 -14.2400 -14.2400 -13.6980 -13.6980 -13.6957 -13.6957 -2.3976 -2.3976 -2.3955 -2.3955 -1.4151 -1.4151 -1.4103 -1.4103 0.6308 0.6308 0.6465 0.6465 1.0484 1.0484 1.0810 1.0810 1.5616 1.5616 1.5816 1.5816 1.8601 1.8601 1.8730 1.8730 3.6518 3.6518 3.6734 3.6734 3.8316 3.8316 3.8999 3.8999 4.0594 4.0594 4.0924 4.0924 4.9952 4.9952 5.0298 5.0298 5.5315 5.5315 5.5575 5.5575 11.2219 11.2219 11.2249 11.2249 11.6635 11.6635 11.6682 11.6682 k =-0.4124 0.4541 0.5229 ( 3020 PWs) bands (ev): -14.2512 -14.2512 -14.2492 -14.2492 -13.7058 -13.7058 -13.7035 -13.7035 -2.4092 -2.4092 -2.4072 -2.4072 -1.4057 -1.4057 -1.4009 -1.4009 0.6356 0.6356 0.6507 0.6507 1.0723 1.0723 1.1015 1.1015 1.5894 1.5894 1.6116 1.6116 1.8404 1.8404 1.8512 1.8512 3.6425 3.6425 3.6638 3.6638 3.8299 3.8299 3.8962 3.8962 4.0642 4.0642 4.0960 4.0960 5.0024 5.0024 5.0355 5.0355 5.5761 5.5761 5.6005 5.6005 11.1872 11.1872 11.1905 11.1905 11.6215 11.6215 11.6262 11.6262 k =-0.4170 0.4376 0.5229 ( 3016 PWs) bands (ev): -14.2601 -14.2601 -14.2581 -14.2581 -13.7133 -13.7133 -13.7111 -13.7111 -2.4205 -2.4205 -2.4186 -2.4186 -1.3963 -1.3963 -1.3915 -1.3915 0.6392 0.6392 0.6541 0.6541 1.0914 1.0914 1.1172 1.1172 1.6208 1.6208 1.6465 1.6465 1.8231 1.8231 1.8312 1.8312 3.6321 3.6321 3.6529 3.6529 3.8278 3.8278 3.8921 3.8921 4.0686 4.0686 4.0992 4.0992 5.0092 5.0092 5.0406 5.0406 5.6226 5.6226 5.6452 5.6452 11.1514 11.1514 11.1549 11.1549 11.5810 11.5810 11.5856 11.5856 k =-0.4216 0.4210 0.5229 ( 3020 PWs) bands (ev): -14.2686 -14.2686 -14.2667 -14.2667 -13.7206 -13.7206 -13.7185 -13.7185 -2.4314 -2.4314 -2.4296 -2.4296 -1.3868 -1.3868 -1.3821 -1.3821 0.6420 0.6420 0.6570 0.6570 1.1055 1.1055 1.1278 1.1278 1.6517 1.6517 1.6837 1.6837 1.8096 1.8096 1.8172 1.8172 3.6204 3.6204 3.6408 3.6408 3.8255 3.8255 3.8874 3.8874 4.0727 4.0727 4.1019 4.1019 5.0155 5.0155 5.0451 5.0451 5.6703 5.6703 5.6912 5.6912 11.1146 11.1146 11.1183 11.1183 11.5418 11.5418 11.5463 11.5463 k =-0.4262 0.4044 0.5229 ( 3016 PWs) bands (ev): -14.2768 -14.2768 -14.2749 -14.2749 -13.7276 -13.7276 -13.7255 -13.7255 -2.4419 -2.4419 -2.4402 -2.4402 -1.3774 -1.3774 -1.3727 -1.3727 0.6444 0.6444 0.6597 0.6597 1.1149 1.1149 1.1339 1.1339 1.6747 1.6747 1.7151 1.7151 1.8046 1.8046 1.8189 1.8189 3.6075 3.6075 3.6273 3.6273 3.8230 3.8230 3.8825 3.8825 4.0765 4.0765 4.1043 4.1043 5.0213 5.0213 5.0491 5.0491 5.7188 5.7188 5.7380 5.7380 11.0772 11.0772 11.0810 11.0810 11.5042 11.5042 11.5086 11.5086 k =-0.4308 0.3878 0.5229 ( 3012 PWs) bands (ev): -14.2846 -14.2846 -14.2828 -14.2828 -13.7342 -13.7342 -13.7323 -13.7323 -2.4519 -2.4519 -2.4503 -2.4503 -1.3682 -1.3682 -1.3636 -1.3636 0.6468 0.6468 0.6624 0.6624 1.1201 1.1201 1.1359 1.1359 1.6824 1.6824 1.7239 1.7239 1.8255 1.8255 1.8413 1.8413 3.5933 3.5933 3.6126 3.6126 3.8204 3.8204 3.8772 3.8772 4.0799 4.0799 4.1063 4.1063 5.0268 5.0268 5.0527 5.0527 5.7676 5.7676 5.7851 5.7851 11.0396 11.0396 11.0435 11.0435 11.4681 11.4681 11.4724 11.4724 k =-0.4354 0.3712 0.5229 ( 3010 PWs) bands (ev): -14.2920 -14.2920 -14.2903 -14.2903 -13.7405 -13.7405 -13.7387 -13.7387 -2.4615 -2.4615 -2.4600 -2.4600 -1.3591 -1.3591 -1.3546 -1.3546 0.6494 0.6494 0.6653 0.6653 1.1216 1.1216 1.1346 1.1346 1.6771 1.6771 1.7134 1.7134 1.8691 1.8691 1.8807 1.8807 3.5778 3.5778 3.5964 3.5964 3.8178 3.8178 3.8717 3.8717 4.0830 4.0830 4.1078 4.1078 5.0318 5.0318 5.0559 5.0559 5.8162 5.8162 5.8321 5.8321 11.0021 11.0021 11.0060 11.0060 11.4337 11.4337 11.4379 11.4379 k =-0.4400 0.3547 0.5229 ( 3002 PWs) bands (ev): -14.2990 -14.2990 -14.2974 -14.2974 -13.7464 -13.7464 -13.7447 -13.7447 -2.4706 -2.4706 -2.4692 -2.4692 -1.3502 -1.3502 -1.3459 -1.3459 0.6523 0.6523 0.6686 0.6686 1.1200 1.1200 1.1306 1.1306 1.6655 1.6655 1.6970 1.6970 1.9212 1.9212 1.9293 1.9293 3.5611 3.5611 3.5789 3.5789 3.8153 3.8153 3.8661 3.8661 4.0859 4.0859 4.1091 4.1091 5.0366 5.0366 5.0588 5.0588 5.8642 5.8642 5.8786 5.8786 10.9649 10.9649 10.9689 10.9689 11.4012 11.4012 11.4052 11.4052 k =-0.4446 0.3381 0.5229 ( 3006 PWs) bands (ev): -14.3055 -14.3055 -14.3041 -14.3041 -13.7520 -13.7520 -13.7504 -13.7504 -2.4791 -2.4791 -2.4778 -2.4778 -1.3417 -1.3417 -1.3376 -1.3376 0.6556 0.6556 0.6721 0.6721 1.1157 1.1157 1.1243 1.1243 1.6517 1.6517 1.6796 1.6796 1.9764 1.9764 1.9821 1.9821 3.5432 3.5432 3.5600 3.5600 3.8128 3.8128 3.8603 3.8603 4.0884 4.0884 4.1100 4.1100 5.0409 5.0409 5.0614 5.0614 5.9111 5.9111 5.9240 5.9240 10.9286 10.9286 10.9325 10.9325 11.3704 11.3704 11.3743 11.3743 k =-0.4493 0.3215 0.5229 ( 3006 PWs) bands (ev): -14.3117 -14.3117 -14.3103 -14.3103 -13.7572 -13.7572 -13.7557 -13.7557 -2.4870 -2.4870 -2.4859 -2.4859 -1.3336 -1.3336 -1.3296 -1.3296 0.6595 0.6595 0.6760 0.6760 1.1092 1.1092 1.1164 1.1164 1.6376 1.6376 1.6625 1.6625 2.0325 2.0325 2.0368 2.0368 3.5243 3.5243 3.5401 3.5401 3.8105 3.8105 3.8546 3.8546 4.0907 4.0907 4.1106 4.1106 5.0450 5.0450 5.0637 5.0637 5.9563 5.9563 5.9679 5.9679 10.8934 10.8934 10.8972 10.8972 11.3417 11.3417 11.3453 11.3453 k =-0.4539 0.3049 0.5229 ( 2998 PWs) bands (ev): -14.3173 -14.3173 -14.3161 -14.3161 -13.7620 -13.7620 -13.7606 -13.7606 -2.4944 -2.4944 -2.4933 -2.4933 -1.3259 -1.3259 -1.3222 -1.3222 0.6638 0.6638 0.6802 0.6802 1.1010 1.1010 1.1074 1.1074 1.6240 1.6240 1.6463 1.6463 2.0885 2.0885 2.0917 2.0917 3.5045 3.5045 3.5191 3.5191 3.8085 3.8085 3.8489 3.8489 4.0929 4.0929 4.1110 4.1110 5.0489 5.0489 5.0657 5.0657 5.9996 5.9996 6.0098 6.0098 10.8597 10.8597 10.8634 10.8634 11.3151 11.3151 11.3185 11.3185 k =-0.4585 0.2883 0.5229 ( 2990 PWs) bands (ev): -14.3224 -14.3224 -14.3213 -14.3213 -13.7663 -13.7663 -13.7651 -13.7651 -2.5011 -2.5011 -2.5001 -2.5001 -1.3186 -1.3186 -1.3152 -1.3152 0.6687 0.6687 0.6848 0.6848 1.0915 1.0915 1.0975 1.0975 1.6114 1.6114 1.6313 1.6313 2.1432 2.1432 2.1456 2.1456 3.4841 3.4841 3.4974 3.4974 3.8067 3.8067 3.8434 3.8434 4.0949 4.0949 4.1113 4.1113 5.0524 5.0524 5.0675 5.0675 6.0404 6.0404 6.0494 6.0494 10.8279 10.8279 10.8314 10.8314 11.2906 11.2906 11.2937 11.2937 k =-0.4631 0.2718 0.5229 ( 2988 PWs) bands (ev): -14.3271 -14.3271 -14.3261 -14.3261 -13.7703 -13.7703 -13.7692 -13.7692 -2.5072 -2.5072 -2.5063 -2.5063 -1.3120 -1.3120 -1.3089 -1.3089 0.6740 0.6740 0.6895 0.6895 1.0811 1.0811 1.0871 1.0871 1.6001 1.6001 1.6177 1.6177 2.1959 2.1959 2.1977 2.1977 3.4632 3.4632 3.4753 3.4753 3.8053 3.8053 3.8380 3.8380 4.0967 4.0967 4.1113 4.1113 5.0556 5.0556 5.0690 5.0690 6.0782 6.0782 6.0861 6.0861 10.7984 10.7984 10.8015 10.8015 11.2684 11.2684 11.2712 11.2712 k =-0.4677 0.2552 0.5229 ( 2988 PWs) bands (ev): -14.3312 -14.3312 -14.3303 -14.3303 -13.7738 -13.7738 -13.7728 -13.7728 -2.5126 -2.5126 -2.5118 -2.5118 -1.3060 -1.3060 -1.3032 -1.3032 0.6796 0.6796 0.6943 0.6943 1.0704 1.0704 1.0765 1.0765 1.5902 1.5902 1.6055 1.6055 2.2456 2.2456 2.2471 2.2471 3.4424 3.4424 3.4531 3.4531 3.8042 3.8042 3.8330 3.8330 4.0983 4.0983 4.1111 4.1111 5.0585 5.0585 5.0702 5.0702 6.1127 6.1127 6.1195 6.1195 10.7714 10.7714 10.7742 10.7742 11.2486 11.2486 11.2511 11.2511 k =-0.4723 0.2386 0.5229 ( 2996 PWs) bands (ev): -14.3348 -14.3348 -14.3340 -14.3340 -13.7768 -13.7768 -13.7760 -13.7760 -2.5173 -2.5173 -2.5167 -2.5167 -1.3006 -1.3006 -1.2982 -1.2982 0.6853 0.6853 0.6989 0.6989 1.0599 1.0599 1.0660 1.0660 1.5817 1.5817 1.5948 1.5948 2.2917 2.2917 2.2927 2.2927 3.4221 3.4221 3.4314 3.4314 3.8035 3.8035 3.8282 3.8282 4.0998 4.0998 4.1108 4.1108 5.0612 5.0612 5.0711 5.0711 6.1435 6.1435 6.1492 6.1492 10.7472 10.7472 10.7498 10.7498 11.2312 11.2312 11.2334 11.2334 k =-0.4769 0.2220 0.5229 ( 2996 PWs) bands (ev): -14.3378 -14.3378 -14.3372 -14.3372 -13.7794 -13.7794 -13.7787 -13.7787 -2.5213 -2.5213 -2.5208 -2.5208 -1.2960 -1.2960 -1.2939 -1.2939 0.6911 0.6911 0.7032 0.7032 1.0501 1.0501 1.0559 1.0559 1.5747 1.5747 1.5856 1.5856 2.3330 2.3330 2.3339 2.3339 3.4031 3.4031 3.4109 3.4109 3.8031 3.8031 3.8238 3.8238 4.1012 4.1012 4.1104 4.1104 5.0635 5.0635 5.0718 5.0718 6.1703 6.1703 6.1750 6.1750 10.7263 10.7263 10.7284 10.7284 11.2164 11.2164 11.2183 11.2183 k =-0.4815 0.2054 0.5229 ( 2988 PWs) bands (ev): -14.3403 -14.3403 -14.3398 -14.3398 -13.7814 -13.7814 -13.7809 -13.7809 -2.5246 -2.5246 -2.5242 -2.5242 -1.2920 -1.2920 -1.2903 -1.2903 0.6967 0.6967 0.7070 0.7070 1.0415 1.0415 1.0467 1.0467 1.5693 1.5693 1.5779 1.5779 2.3688 2.3688 2.3695 2.3695 3.3861 3.3861 3.3924 3.3924 3.8033 3.8033 3.8198 3.8198 4.1026 4.1026 4.1099 4.1099 5.0656 5.0656 5.0722 5.0722 6.1928 6.1928 6.1966 6.1966 10.7088 10.7088 10.7106 10.7106 11.2043 11.2043 11.2058 11.2058 k =-0.4862 0.1888 0.5229 ( 2992 PWs) bands (ev): -14.3422 -14.3422 -14.3419 -14.3419 -13.7831 -13.7831 -13.7826 -13.7826 -2.5272 -2.5272 -2.5268 -2.5268 -1.2889 -1.2889 -1.2876 -1.2876 0.7018 0.7018 0.7099 0.7099 1.0345 1.0345 1.0388 1.0388 1.5653 1.5653 1.5717 1.5717 2.3980 2.3980 2.3985 2.3985 3.3718 3.3718 3.3766 3.3766 3.8038 3.8038 3.8162 3.8162 4.1038 4.1038 4.1093 4.1093 5.0674 5.0674 5.0723 5.0723 6.2106 6.2106 6.2134 6.2134 10.6950 10.6950 10.6963 10.6963 11.1948 11.1948 11.1959 11.1959 k =-0.4908 0.1723 0.5229 ( 2992 PWs) bands (ev): -14.3436 -14.3436 -14.3434 -14.3434 -13.7842 -13.7842 -13.7839 -13.7839 -2.5290 -2.5290 -2.5288 -2.5288 -1.2866 -1.2866 -1.2857 -1.2857 0.7061 0.7061 0.7117 0.7117 1.0295 1.0295 1.0326 1.0326 1.5627 1.5627 1.5670 1.5670 2.4198 2.4198 2.4201 2.4201 3.3610 3.3610 3.3643 3.3643 3.8047 3.8047 3.8130 3.8130 4.1049 4.1049 4.1086 4.1086 5.0689 5.0689 5.0722 5.0722 6.2237 6.2237 6.2255 6.2255 10.6851 10.6851 10.6860 10.6860 11.1880 11.1880 11.1888 11.1888 k =-0.4954 0.1557 0.5229 ( 3004 PWs) bands (ev): -14.3444 -14.3444 -14.3443 -14.3443 -13.7849 -13.7849 -13.7847 -13.7847 -2.5301 -2.5301 -2.5300 -2.5300 -1.2851 -1.2851 -1.2847 -1.2847 0.7094 0.7094 0.7122 0.7122 1.0267 1.0267 1.0283 1.0283 1.5616 1.5616 1.5638 1.5638 2.4332 2.4332 2.4333 2.4333 3.3545 3.3545 3.3562 3.3562 3.8061 3.8061 3.8102 3.8102 4.1059 4.1059 4.1077 4.1077 5.0701 5.0701 5.0717 5.0717 6.2317 6.2317 6.2327 6.2327 10.6791 10.6791 10.6796 10.6796 11.1840 11.1840 11.1844 11.1844 k =-0.5000 0.1391 0.5229 ( 3008 PWs) bands (ev): -14.3446 -14.3446 -14.3446 -14.3446 -13.7850 -13.7850 -13.7850 -13.7850 -2.5304 -2.5304 -2.5304 -2.5304 -1.2845 -1.2845 -1.2845 -1.2845 0.7114 0.7114 0.7114 0.7114 1.0263 1.0263 1.0263 1.0263 1.5619 1.5619 1.5619 1.5619 2.4378 2.4378 2.4378 2.4378 3.3529 3.3529 3.3529 3.3529 3.8079 3.8079 3.8079 3.8079 4.1068 4.1068 4.1068 4.1068 5.0710 5.0710 5.0710 5.0710 6.2347 6.2347 6.2347 6.2347 10.6773 10.6773 10.6773 10.6773 11.1828 11.1828 11.1828 11.1828 k =-0.5000 0.1391 0.5229 ( 3008 PWs) bands (ev): -14.3446 -14.3446 -14.3446 -14.3446 -13.7850 -13.7850 -13.7850 -13.7850 -2.5304 -2.5304 -2.5304 -2.5304 -1.2845 -1.2845 -1.2845 -1.2845 0.7114 0.7114 0.7114 0.7114 1.0263 1.0263 1.0263 1.0263 1.5619 1.5619 1.5619 1.5619 2.4378 2.4378 2.4378 2.4378 3.3529 3.3529 3.3529 3.3529 3.8079 3.8079 3.8079 3.8079 4.1068 4.1068 4.1068 4.1068 5.0710 5.0710 5.0710 5.0710 6.2347 6.2347 6.2347 6.2347 10.6773 10.6773 10.6773 10.6773 11.1828 11.1828 11.1828 11.1828 k =-0.5000 0.1391 0.5055 ( 3004 PWs) bands (ev): -14.3585 -14.3585 -14.3310 -14.3310 -13.7907 -13.7907 -13.7790 -13.7790 -2.5551 -2.5551 -2.5063 -2.5063 -1.2994 -1.2994 -1.2686 -1.2686 0.7106 0.7106 0.7123 0.7123 1.0049 1.0049 1.0450 1.0450 1.5542 1.5542 1.5734 1.5734 2.4278 2.4278 2.4478 2.4478 3.3493 3.3493 3.3563 3.3563 3.8073 3.8073 3.8085 3.8085 4.1047 4.1047 4.1087 4.1087 5.0615 5.0615 5.0785 5.0785 6.2333 6.2333 6.2361 6.2361 10.6121 10.6121 10.7342 10.7342 11.1451 11.1451 11.2323 11.2323 k =-0.5000 0.1391 0.4881 ( 3008 PWs) bands (ev): -14.3727 -14.3727 -14.3178 -14.3178 -13.7959 -13.7959 -13.7726 -13.7726 -2.5802 -2.5802 -2.4828 -2.4828 -1.3134 -1.3134 -1.2518 -1.2518 0.7097 0.7097 0.7132 0.7132 0.9816 0.9816 1.0603 1.0603 1.5508 1.5508 1.5877 1.5877 2.4179 2.4179 2.4580 2.4580 3.3457 3.3457 3.3597 3.3597 3.8064 3.8064 3.8089 3.8089 4.1023 4.1023 4.1104 4.1104 5.0499 5.0499 5.0836 5.0836 6.2318 6.2318 6.2375 6.2375 10.5433 10.5433 10.7747 10.7747 11.1276 11.1276 11.2889 11.2889 k =-0.5000 0.1391 0.4707 ( 3004 PWs) bands (ev): -14.3869 -14.3869 -14.3050 -14.3050 -13.8006 -13.8006 -13.7659 -13.7659 -2.6057 -2.6057 -2.4599 -2.4599 -1.3265 -1.3265 -1.2340 -1.2340 0.7089 0.7089 0.7142 0.7142 0.9568 0.9568 1.0716 1.0716 1.5525 1.5525 1.6042 1.6042 2.4081 2.4081 2.4682 2.4682 3.3420 3.3420 3.3629 3.3629 3.8054 3.8054 3.8091 3.8091 4.0997 4.0997 4.1118 4.1118 5.0365 5.0365 5.0863 5.0863 6.2304 6.2304 6.2389 6.2389 10.4732 10.4732 10.7899 10.7899 11.1391 11.1391 11.3500 11.3500 k =-0.5000 0.1391 0.4532 ( 3002 PWs) bands (ev): -14.4013 -14.4013 -14.2928 -14.2928 -13.8046 -13.8046 -13.7590 -13.7590 -2.6315 -2.6315 -2.4378 -2.4378 -1.3386 -1.3386 -1.2155 -1.2155 0.7080 0.7080 0.7151 0.7151 0.9311 0.9311 1.0786 1.0786 1.5599 1.5599 1.6224 1.6224 2.3985 2.3985 2.4783 2.4783 3.3382 3.3382 3.3661 3.3661 3.8043 3.8043 3.8091 3.8091 4.0969 4.0969 4.1130 4.1130 5.0215 5.0215 5.0865 5.0865 6.2289 6.2289 6.2402 6.2402 10.4032 10.4032 10.7795 10.7795 11.1799 11.1799 11.4142 11.4142 k =-0.5000 0.1391 0.4358 ( 3000 PWs) bands (ev): -14.4156 -14.4156 -14.2812 -14.2812 -13.8081 -13.8081 -13.7520 -13.7520 -2.6576 -2.6576 -2.4163 -2.4163 -1.3498 -1.3498 -1.1961 -1.1961 0.7073 0.7073 0.7160 0.7160 0.9049 0.9049 1.0811 1.0811 1.5729 1.5729 1.6417 1.6417 2.3891 2.3891 2.4885 2.4885 3.3344 3.3344 3.3691 3.3691 3.8029 3.8029 3.8090 3.8090 4.0937 4.0937 4.1139 4.1139 5.0052 5.0052 5.0840 5.0840 6.2274 6.2274 6.2414 6.2414 10.3340 10.3340 10.7526 10.7526 11.2410 11.2410 11.4806 11.4806 k =-0.5000 0.1391 0.4184 ( 3000 PWs) bands (ev): -14.4298 -14.4298 -14.2703 -14.2703 -13.8109 -13.8109 -13.7448 -13.7448 -2.6837 -2.6837 -2.3956 -2.3956 -1.3601 -1.3601 -1.1761 -1.1761 0.7065 0.7065 0.7169 0.7169 0.8785 0.8785 1.0794 1.0794 1.5914 1.5914 1.6619 1.6619 2.3799 2.3799 2.4986 2.4986 3.3305 3.3305 3.3721 3.3721 3.8014 3.8014 3.8088 3.8088 4.0903 4.0903 4.1147 4.1147 4.9876 4.9876 5.0788 5.0788 6.2259 6.2259 6.2427 6.2427 10.2662 10.2662 10.7179 10.7179 11.3137 11.3137 11.5484 11.5484 k =-0.5000 0.1391 0.4009 ( 3004 PWs) bands (ev): -14.4440 -14.4440 -14.2602 -14.2602 -13.8130 -13.8130 -13.7376 -13.7376 -2.7099 -2.7099 -2.3757 -2.3757 -1.3696 -1.3696 -1.1554 -1.1554 0.7057 0.7057 0.7178 0.7178 0.8520 0.8520 1.0740 1.0740 1.6150 1.6150 1.6825 1.6825 2.3709 2.3709 2.5086 2.5086 3.3266 3.3266 3.3749 3.3749 3.7997 3.7997 3.8084 3.8084 4.0865 4.0865 4.1151 4.1151 4.9692 4.9692 5.0710 5.0710 6.2244 6.2244 6.2438 6.2438 10.2000 10.2000 10.6802 10.6802 11.3931 11.3931 11.6173 11.6173 k =-0.5000 0.1391 0.3835 ( 3012 PWs) bands (ev): -14.4579 -14.4579 -14.2508 -14.2508 -13.8143 -13.8143 -13.7303 -13.7303 -2.7360 -2.7360 -2.3565 -2.3565 -1.3782 -1.3782 -1.1342 -1.1342 0.7050 0.7050 0.7187 0.7187 0.8258 0.8258 1.0655 1.0655 1.6429 1.6429 1.7033 1.7033 2.3621 2.3621 2.5185 2.5185 3.3226 3.3226 3.3775 3.3775 3.7979 3.7979 3.8077 3.8077 4.0824 4.0824 4.1153 4.1153 4.9500 4.9500 5.0606 5.0606 6.2229 6.2229 6.2449 6.2449 10.1357 10.1357 10.6421 10.6421 11.4765 11.4765 11.6866 11.6866 k =-0.5000 0.1391 0.3661 ( 3002 PWs) bands (ev): -14.4716 -14.4716 -14.2423 -14.2423 -13.8148 -13.8148 -13.7231 -13.7231 -2.7619 -2.7619 -2.3382 -2.3382 -1.3861 -1.3861 -1.1126 -1.1126 0.7043 0.7043 0.7195 0.7195 0.8001 0.8001 1.0546 1.0546 1.6744 1.6744 1.7242 1.7242 2.3536 2.3536 2.5283 2.5283 3.3187 3.3187 3.3802 3.3802 3.7960 3.7960 3.8071 3.8071 4.0780 4.0780 4.1152 4.1152 4.9304 4.9304 5.0478 5.0478 6.2215 6.2215 6.2460 6.2460 10.0735 10.0735 10.6049 10.6049 11.5624 11.5624 11.7561 11.7561 k =-0.5000 0.1391 0.3486 ( 3004 PWs) bands (ev): -14.4849 -14.4849 -14.2347 -14.2347 -13.8146 -13.8146 -13.7159 -13.7159 -2.7875 -2.7875 -2.3206 -2.3206 -1.3932 -1.3932 -1.0906 -1.0906 0.7036 0.7036 0.7201 0.7201 0.7750 0.7750 1.0420 1.0420 1.7086 1.7086 1.7453 1.7453 2.3454 2.3454 2.5379 2.5379 3.3148 3.3148 3.3826 3.3826 3.7939 3.7939 3.8063 3.8063 4.0732 4.0732 4.1148 4.1148 4.9104 4.9104 5.0325 5.0325 6.2200 6.2200 6.2470 6.2470 10.0135 10.0135 10.5694 10.5694 11.6501 11.6501 11.8253 11.8253 k =-0.5000 0.1391 0.3312 ( 3004 PWs) bands (ev): -14.4980 -14.4980 -14.2280 -14.2280 -13.8137 -13.8137 -13.7088 -13.7088 -2.8126 -2.8126 -2.3038 -2.3038 -1.3996 -1.3996 -1.0685 -1.0685 0.7028 0.7028 0.7205 0.7205 0.7509 0.7509 1.0283 1.0283 1.7440 1.7440 1.7673 1.7673 2.3375 2.3375 2.5473 2.5473 3.3109 3.3109 3.3849 3.3849 3.7916 3.7916 3.8054 3.8054 4.0680 4.0680 4.1140 4.1140 4.8903 4.8903 5.0151 5.0151 6.2185 6.2185 6.2480 6.2480 9.9558 9.9558 10.5359 10.5359 11.7388 11.7388 11.8939 11.8939 k =-0.5000 0.1391 0.3138 ( 3006 PWs) bands (ev): -14.5106 -14.5106 -14.2222 -14.2222 -13.8120 -13.8120 -13.7019 -13.7019 -2.8373 -2.8373 -2.2879 -2.2879 -1.4054 -1.4054 -1.0463 -1.0463 0.7017 0.7017 0.7180 0.7180 0.7305 0.7305 1.0137 1.0137 1.7753 1.7753 1.7948 1.7948 2.3298 2.3298 2.5564 2.5564 3.3071 3.3071 3.3871 3.3871 3.7892 3.7892 3.8044 3.8044 4.0624 4.0624 4.1130 4.1130 4.8703 4.8703 4.9957 4.9957 6.2171 6.2171 6.2489 6.2489 9.9006 9.9006 10.5046 10.5046 11.8281 11.8281 11.9616 11.9616 k =-0.5000 0.1391 0.2963 ( 3000 PWs) bands (ev): -14.5227 -14.5227 -14.2172 -14.2172 -13.8097 -13.8097 -13.6952 -13.6952 -2.8613 -2.8613 -2.2727 -2.2727 -1.4106 -1.4106 -1.0241 -1.0241 0.6965 0.6965 0.7055 0.7055 0.7252 0.7252 0.9988 0.9988 1.7979 1.7979 1.8319 1.8319 2.3226 2.3226 2.5653 2.5653 3.3034 3.3034 3.3892 3.3892 3.7866 3.7866 3.8034 3.8034 4.0564 4.0564 4.1116 4.1116 4.8506 4.8506 4.9746 4.9746 6.2157 6.2157 6.2498 6.2498 9.8480 9.8480 10.4757 10.4757 11.9177 11.9177 12.0281 12.0281 k =-0.5000 0.1391 0.2789 ( 3004 PWs) bands (ev): -14.5344 -14.5344 -14.2130 -14.2130 -13.8069 -13.8069 -13.6886 -13.6886 -2.8846 -2.8846 -2.2583 -2.2583 -1.4153 -1.4153 -1.0022 -1.0022 0.6773 0.6773 0.7024 0.7024 0.7252 0.7252 0.9839 0.9839 1.8169 1.8169 1.8729 1.8729 2.3156 2.3156 2.5739 2.5739 3.2998 3.2998 3.3910 3.3910 3.7838 3.7838 3.8022 3.8022 4.0500 4.0500 4.1098 4.1098 4.8312 4.8312 4.9521 4.9521 6.2144 6.2144 6.2506 6.2506 9.7980 9.7980 10.4492 10.4492 12.0071 12.0071 12.0930 12.0930 k =-0.5000 0.1391 0.2615 ( 3004 PWs) bands (ev): -14.5456 -14.5456 -14.2096 -14.2096 -13.8035 -13.8035 -13.6823 -13.6823 -2.9070 -2.9070 -2.2447 -2.2447 -1.4195 -1.4195 -0.9806 -0.9806 0.6563 0.6563 0.7015 0.7015 0.7258 0.7258 0.9691 0.9691 1.8344 1.8344 1.9154 1.9154 2.3090 2.3090 2.5822 2.5822 3.2963 3.2963 3.3928 3.3928 3.7809 3.7809 3.8010 3.8010 4.0432 4.0432 4.1077 4.1077 4.8124 4.8124 4.9287 4.9287 6.2131 6.2131 6.2514 6.2514 9.7506 9.7506 10.4251 10.4251 12.0959 12.0959 12.1561 12.1561 k =-0.5000 0.1391 0.2440 ( 3004 PWs) bands (ev): -14.5562 -14.5562 -14.2068 -14.2068 -13.7998 -13.7998 -13.6763 -13.6763 -2.9285 -2.9285 -2.2320 -2.2320 -1.4232 -1.4232 -0.9595 -0.9595 0.6358 0.6358 0.7009 0.7009 0.7264 0.7264 0.9547 0.9547 1.8507 1.8507 1.9585 1.9585 2.3028 2.3028 2.5901 2.5901 3.2930 3.2930 3.3944 3.3944 3.7778 3.7778 3.7998 3.7998 4.0359 4.0359 4.1053 4.1053 4.7940 4.7940 4.9048 4.9048 6.2119 6.2119 6.2521 6.2521 9.7061 9.7061 10.4032 10.4032 12.1833 12.1833 12.2174 12.2174 k =-0.5000 0.1391 0.2266 ( 3004 PWs) bands (ev): -14.5662 -14.5662 -14.2047 -14.2047 -13.7957 -13.7957 -13.6706 -13.6706 -2.9490 -2.9490 -2.2200 -2.2200 -1.4265 -1.4265 -0.9391 -0.9391 0.6163 0.6163 0.7004 0.7004 0.7271 0.7271 0.9408 0.9408 1.8659 1.8659 2.0017 2.0017 2.2970 2.2970 2.5976 2.5976 3.2898 3.2898 3.3958 3.3958 3.7745 3.7745 3.7987 3.7987 4.0282 4.0282 4.1026 4.1026 4.7762 4.7762 4.8808 4.8808 6.2107 6.2107 6.2527 6.2527 9.6644 9.6644 10.3836 10.3836 12.2652 12.2652 12.2807 12.2807 k =-0.5000 0.1391 0.2092 ( 3008 PWs) bands (ev): -14.5756 -14.5756 -14.2030 -14.2030 -13.7915 -13.7915 -13.6652 -13.6652 -2.9683 -2.9683 -2.2088 -2.2088 -1.4294 -1.4294 -0.9194 -0.9194 0.5978 0.5978 0.6999 0.6999 0.7278 0.7278 0.9276 0.9276 1.8800 1.8800 2.0447 2.0447 2.2915 2.2915 2.6047 2.6047 3.2868 3.2868 3.3972 3.3972 3.7709 3.7709 3.7974 3.7974 4.0202 4.0202 4.0995 4.0995 4.7589 4.7589 4.8573 4.8573 6.2096 6.2096 6.2534 6.2534 9.6255 9.6255 10.3661 10.3661 12.3267 12.3267 12.3600 12.3600 k =-0.5000 0.1391 0.1917 ( 3006 PWs) bands (ev): -14.5843 -14.5843 -14.2019 -14.2019 -13.7872 -13.7872 -13.6602 -13.6602 -2.9864 -2.9864 -2.1984 -2.1984 -1.4320 -1.4320 -0.9007 -0.9007 0.5804 0.5804 0.6995 0.6995 0.7284 0.7284 0.9152 0.9152 1.8931 1.8931 2.0870 2.0870 2.2864 2.2864 2.6114 2.6114 3.2841 3.2841 3.3983 3.3983 3.7673 3.7673 3.7962 3.7962 4.0118 4.0118 4.0962 4.0962 4.7421 4.7421 4.8348 4.8348 6.2085 6.2085 6.2539 6.2539 9.5896 9.5896 10.3506 10.3506 12.3796 12.3796 12.4429 12.4429 k =-0.5000 0.1391 0.1743 ( 2996 PWs) bands (ev): -14.5923 -14.5923 -14.2011 -14.2011 -13.7828 -13.7828 -13.6555 -13.6555 -3.0033 -3.0033 -2.1889 -2.1889 -1.4342 -1.4342 -0.8830 -0.8830 0.5642 0.5642 0.6991 0.6991 0.7290 0.7290 0.9037 0.9037 1.9050 1.9050 2.1281 2.1281 2.2818 2.2818 2.6176 2.6176 3.2815 3.2815 3.3993 3.3993 3.7635 3.7635 3.7952 3.7952 4.0032 4.0032 4.0929 4.0929 4.7257 4.7257 4.8140 4.8140 6.2075 6.2075 6.2544 6.2544 9.5567 9.5567 10.3369 10.3369 12.4285 12.4285 12.5242 12.5242 k =-0.5000 0.1391 0.1569 ( 3002 PWs) bands (ev): -14.5997 -14.5997 -14.2006 -14.2006 -13.7786 -13.7786 -13.6512 -13.6512 -3.0187 -3.0187 -2.1802 -2.1802 -1.4362 -1.4362 -0.8665 -0.8665 0.5493 0.5493 0.6988 0.6988 0.7296 0.7296 0.8930 0.8930 1.9157 1.9157 2.1677 2.1677 2.2776 2.2776 2.6232 2.6232 3.2791 3.2791 3.4001 3.4001 3.7595 3.7595 3.7941 3.7941 3.9944 3.9944 4.0893 4.0893 4.7097 4.7097 4.7950 4.7950 6.2066 6.2066 6.2549 6.2549 9.5268 9.5268 10.3250 10.3250 12.4734 12.4734 12.6028 12.6028 k =-0.5000 0.1391 0.1395 ( 3002 PWs) bands (ev): -14.6063 -14.6063 -14.2003 -14.2003 -13.7746 -13.7746 -13.6473 -13.6473 -3.0327 -3.0327 -2.1724 -2.1724 -1.4379 -1.4379 -0.8514 -0.8514 0.5358 0.5358 0.6985 0.6985 0.7301 0.7301 0.8834 0.8834 1.9254 1.9254 2.2051 2.2051 2.2738 2.2738 2.6284 2.6284 3.2770 3.2770 3.4008 3.4008 3.7554 3.7554 3.7931 3.7931 3.9857 3.9857 4.0858 4.0858 4.6943 4.6943 4.7784 4.7784 6.2058 6.2058 6.2553 6.2553 9.5000 9.5000 10.3148 10.3148 12.5143 12.5143 12.6781 12.6781 k =-0.5000 0.1391 0.1220 ( 2998 PWs) bands (ev): -14.6122 -14.6122 -14.2003 -14.2003 -13.7709 -13.7709 -13.6438 -13.6438 -3.0452 -3.0452 -2.1655 -2.1655 -1.4393 -1.4393 -0.8377 -0.8377 0.5236 0.5236 0.6982 0.6982 0.7306 0.7306 0.8748 0.8748 1.9340 1.9340 2.2400 2.2400 2.2705 2.2705 2.6330 2.6330 3.2752 3.2752 3.4013 3.4013 3.7512 3.7512 3.7923 3.7923 3.9772 3.9772 4.0824 4.0824 4.6795 4.6795 4.7643 4.7643 6.2051 6.2051 6.2556 6.2556 9.4762 9.4762 10.3061 10.3061 12.5509 12.5509 12.7496 12.7496 k =-0.5000 0.1391 0.1046 ( 2998 PWs) bands (ev): -14.6173 -14.6173 -14.2003 -14.2003 -13.7675 -13.7675 -13.6408 -13.6408 -3.0562 -3.0562 -2.1594 -2.1594 -1.4405 -1.4405 -0.8256 -0.8256 0.5130 0.5130 0.6979 0.6979 0.7310 0.7310 0.8673 0.8673 1.9413 1.9413 2.2667 2.2667 2.2727 2.2727 2.6370 2.6370 3.2736 3.2736 3.4017 3.4017 3.7472 3.7472 3.7915 3.7915 3.9691 3.9691 4.0792 4.0792 4.6658 4.6658 4.7525 4.7525 6.2045 6.2045 6.2560 6.2560 9.4556 9.4556 10.2988 10.2988 12.5832 12.5832 12.8163 12.8163 k =-0.5000 0.1391 0.0872 ( 2998 PWs) bands (ev): -14.6217 -14.6217 -14.2004 -14.2004 -13.7646 -13.7646 -13.6382 -13.6382 -3.0656 -3.0656 -2.1543 -2.1543 -1.4415 -1.4415 -0.8151 -0.8151 0.5038 0.5038 0.6977 0.6977 0.7313 0.7313 0.8609 0.8609 1.9475 1.9475 2.2648 2.2648 2.3001 2.3001 2.6404 2.6404 3.2723 3.2723 3.4019 3.4019 3.7433 3.7433 3.7909 3.7909 3.9618 3.9618 4.0763 4.0763 4.6534 4.6534 4.7429 4.7429 6.2039 6.2039 6.2562 6.2562 9.4380 9.4380 10.2927 10.2927 12.6108 12.6108 12.8774 12.8774 k =-0.5000 0.1391 0.0697 ( 2998 PWs) bands (ev): -14.6253 -14.6253 -14.2006 -14.2006 -13.7621 -13.7621 -13.6361 -13.6361 -3.0733 -3.0733 -2.1500 -2.1500 -1.4423 -1.4423 -0.8064 -0.8064 0.4963 0.4963 0.6975 0.6975 0.7316 0.7316 0.8556 0.8556 1.9526 1.9526 2.2628 2.2628 2.3240 2.3240 2.6432 2.6432 3.2712 3.2712 3.4021 3.4021 3.7398 3.7398 3.7904 3.7904 3.9553 3.9553 4.0739 4.0739 4.6429 4.6429 4.7353 4.7353 6.2034 6.2034 6.2564 6.2564 9.4237 9.4237 10.2879 10.2879 12.6336 12.6336 12.9315 12.9315 k =-0.5000 0.1391 0.0523 ( 2994 PWs) bands (ev): -14.6281 -14.6281 -14.2007 -14.2007 -13.7601 -13.7601 -13.6344 -13.6344 -3.0794 -3.0794 -2.1467 -2.1467 -1.4429 -1.4429 -0.7996 -0.7996 0.4904 0.4904 0.6974 0.6974 0.7318 0.7318 0.8515 0.8515 1.9566 1.9566 2.2612 2.2612 2.3432 2.3432 2.6454 2.6454 3.2704 3.2704 3.4021 3.4021 3.7369 3.7369 3.7900 3.7900 3.9500 3.9500 4.0719 4.0719 4.6344 4.6344 4.7297 4.7297 6.2031 6.2031 6.2566 6.2566 9.4125 9.4125 10.2843 10.2843 12.6515 12.6515 12.9773 12.9773 k =-0.5000 0.1391 0.0349 ( 2994 PWs) bands (ev): -14.6301 -14.6301 -14.2009 -14.2009 -13.7586 -13.7586 -13.6332 -13.6332 -3.0837 -3.0837 -2.1443 -2.1443 -1.4434 -1.4434 -0.7947 -0.7947 0.4861 0.4861 0.6972 0.6972 0.7319 0.7319 0.8486 0.8486 1.9594 1.9594 2.2601 2.2601 2.3573 2.3573 2.6470 2.6470 3.2698 3.2698 3.4022 3.4022 3.7346 3.7346 3.7897 3.7897 3.9461 3.9461 4.0704 4.0704 4.6281 4.6281 4.7257 4.7257 6.2028 6.2028 6.2567 6.2567 9.4045 9.4045 10.2817 10.2817 12.6643 12.6643 13.0125 13.0125 k =-0.5000 0.1391 0.0174 ( 2992 PWs) bands (ev): -14.6313 -14.6313 -14.2009 -14.2009 -13.7577 -13.7577 -13.6325 -13.6325 -3.0863 -3.0863 -2.1429 -2.1429 -1.4436 -1.4436 -0.7917 -0.7917 0.4835 0.4835 0.6972 0.6972 0.7320 0.7320 0.8468 0.8468 1.9611 1.9611 2.2594 2.2594 2.3659 2.3659 2.6480 2.6480 3.2695 3.2695 3.4022 3.4022 3.7331 3.7331 3.7895 3.7895 3.9436 3.9436 4.0695 4.0695 4.6243 4.6243 4.7234 4.7234 6.2027 6.2027 6.2568 6.2568 9.3997 9.3997 10.2802 10.2802 12.6720 12.6720 13.0350 13.0350 k =-0.5000 0.1391 0.0000 ( 2996 PWs) bands (ev): -14.6317 -14.6317 -14.2010 -14.2010 -13.7575 -13.7575 -13.6323 -13.6323 -3.0872 -3.0872 -2.1424 -2.1424 -1.4437 -1.4437 -0.7907 -0.7907 0.4827 0.4827 0.6972 0.6972 0.7320 0.7320 0.8462 0.8462 1.9616 1.9616 2.2592 2.2592 2.3688 2.3688 2.6483 2.6483 3.2694 3.2694 3.4022 3.4022 3.7326 3.7326 3.7894 3.7894 3.9428 3.9428 4.0692 4.0692 4.6230 4.6230 4.7226 4.7226 6.2026 6.2026 6.2567 6.2567 9.3981 9.3981 10.2797 10.2797 12.6746 12.6746 13.0427 13.0427 k = 0.0000 0.0000 0.5229 ( 2990 PWs) bands (ev): -14.5370 -14.5370 -14.5370 -14.5370 -13.5381 -13.5381 -13.5381 -13.5381 -3.1817 -3.1817 -3.1817 -3.1817 -0.9472 -0.9472 -0.9472 -0.9472 0.6378 0.6378 0.6378 0.6378 1.2041 1.2041 1.2041 1.2041 2.1067 2.1067 2.1067 2.1067 2.6052 2.6052 2.6052 2.6052 3.3264 3.3264 3.3264 3.3264 3.8094 3.8094 3.8094 3.8094 4.0905 4.0905 4.0905 4.0905 4.9827 4.9827 4.9827 4.9827 6.0911 6.0911 6.0911 6.0911 9.3512 9.3512 9.3512 9.3512 11.9651 11.9651 11.9651 11.9651 k =-0.0167 0.0046 0.5229 ( 2998 PWs) bands (ev): -14.5366 -14.5366 -14.5366 -14.5366 -13.5387 -13.5387 -13.5387 -13.5387 -3.1803 -3.1803 -3.1803 -3.1803 -0.9477 -0.9477 -0.9477 -0.9477 0.6379 0.6379 0.6379 0.6379 1.2037 1.2037 1.2040 1.2040 2.1045 2.1045 2.1049 2.1049 2.6046 2.6046 2.6048 2.6048 3.3260 3.3260 3.3269 3.3269 3.8091 3.8091 3.8097 3.8097 4.0900 4.0900 4.0912 4.0912 4.9828 4.9828 4.9833 4.9833 6.0914 6.0914 6.0915 6.0915 9.3534 9.3534 9.3537 9.3537 11.9638 11.9638 11.9646 11.9646 k =-0.0333 0.0093 0.5229 ( 2998 PWs) bands (ev): -14.5354 -14.5354 -14.5354 -14.5354 -13.5404 -13.5404 -13.5403 -13.5403 -3.1762 -3.1762 -3.1761 -3.1761 -0.9493 -0.9493 -0.9492 -0.9492 0.6384 0.6384 0.6385 0.6385 1.2027 1.2027 1.2032 1.2032 2.0984 2.0984 2.0992 2.0992 2.6031 2.6031 2.6035 2.6035 3.3261 3.3261 3.3278 3.3278 3.8089 3.8089 3.8099 3.8099 4.0899 4.0899 4.0923 4.0923 4.9833 4.9833 4.9844 4.9844 6.0926 6.0926 6.0928 6.0928 9.3603 9.3603 9.3611 9.3611 11.9608 11.9608 11.9624 11.9624 k =-0.0500 0.0139 0.5229 ( 3002 PWs) bands (ev): -14.5334 -14.5334 -14.5334 -14.5334 -13.5431 -13.5431 -13.5431 -13.5431 -3.1693 -3.1693 -3.1692 -3.1692 -0.9519 -0.9519 -0.9517 -0.9517 0.6393 0.6393 0.6394 0.6394 1.2011 1.2011 1.2019 1.2019 2.0884 2.0884 2.0898 2.0898 2.6008 2.6008 2.6014 2.6014 3.3265 3.3265 3.3290 3.3290 3.8086 3.8086 3.8102 3.8102 4.0900 4.0900 4.0935 4.0935 4.9845 4.9845 4.9860 4.9860 6.0946 6.0946 6.0948 6.0948 9.3720 9.3720 9.3731 9.3731 11.9560 11.9560 11.9584 11.9584 k =-0.0667 0.0185 0.5229 ( 3000 PWs) bands (ev): -14.5306 -14.5306 -14.5306 -14.5306 -13.5469 -13.5469 -13.5469 -13.5469 -3.1598 -3.1598 -3.1597 -3.1597 -0.9555 -0.9555 -0.9552 -0.9552 0.6406 0.6406 0.6407 0.6407 1.1989 1.1989 1.2000 1.2000 2.0749 2.0749 2.0767 2.0767 2.5975 2.5975 2.5983 2.5983 3.3273 3.3273 3.3305 3.3305 3.8084 3.8084 3.8105 3.8105 4.0904 4.0904 4.0950 4.0950 4.9861 4.9861 4.9881 4.9881 6.0973 6.0973 6.0976 6.0976 9.3884 9.3884 9.3898 9.3898 11.9495 11.9495 11.9527 11.9527 k =-0.0833 0.0232 0.5229 ( 2992 PWs) bands (ev): -14.5271 -14.5271 -14.5270 -14.5270 -13.5518 -13.5518 -13.5517 -13.5517 -3.1476 -3.1476 -3.1474 -3.1474 -0.9601 -0.9601 -0.9598 -0.9598 0.6423 0.6423 0.6425 0.6425 1.1961 1.1961 1.1975 1.1975 2.0581 2.0581 2.0603 2.0603 2.5935 2.5935 2.5945 2.5945 3.3283 3.3283 3.3323 3.3323 3.8082 3.8082 3.8108 3.8108 4.0910 4.0910 4.0966 4.0966 4.9883 4.9883 4.9908 4.9908 6.1008 6.1008 6.1012 6.1012 9.4093 9.4093 9.4111 9.4111 11.9411 11.9411 11.9451 11.9451 k =-0.1000 0.0278 0.5229 ( 2994 PWs) bands (ev): -14.5228 -14.5228 -14.5227 -14.5227 -13.5577 -13.5577 -13.5576 -13.5576 -3.1328 -3.1328 -3.1326 -3.1326 -0.9659 -0.9659 -0.9655 -0.9655 0.6443 0.6443 0.6445 0.6445 1.1927 1.1927 1.1943 1.1943 2.0381 2.0381 2.0407 2.0407 2.5887 2.5887 2.5898 2.5898 3.3295 3.3295 3.3341 3.3341 3.8080 3.8080 3.8110 3.8110 4.0918 4.0918 4.0983 4.0983 4.9910 4.9910 4.9938 4.9938 6.1050 6.1050 6.1054 6.1054 9.4347 9.4347 9.4368 9.4368 11.9309 11.9309 11.9357 11.9357 k =-0.1167 0.0325 0.5229 ( 2996 PWs) bands (ev): -14.5178 -14.5178 -14.5177 -14.5177 -13.5645 -13.5645 -13.5645 -13.5645 -3.1155 -3.1155 -3.1153 -3.1153 -0.9727 -0.9727 -0.9722 -0.9722 0.6466 0.6466 0.6468 0.6468 1.1887 1.1887 1.1906 1.1906 2.0155 2.0155 2.0185 2.0185 2.5831 2.5831 2.5844 2.5844 3.3309 3.3309 3.3360 3.3360 3.8079 3.8079 3.8112 3.8112 4.0927 4.0927 4.1001 4.1001 4.9941 4.9941 4.9972 4.9972 6.1098 6.1098 6.1103 6.1103 9.4644 9.4644 9.4669 9.4669 11.9188 11.9188 11.9243 11.9243 k =-0.1333 0.0371 0.5229 ( 3000 PWs) bands (ev): -14.5120 -14.5120 -14.5120 -14.5120 -13.5723 -13.5723 -13.5722 -13.5722 -3.0959 -3.0959 -3.0957 -3.0957 -0.9806 -0.9806 -0.9801 -0.9801 0.6492 0.6492 0.6494 0.6494 1.1841 1.1841 1.1862 1.1862 1.9906 1.9906 1.9940 1.9940 2.5769 2.5769 2.5783 2.5783 3.3324 3.3324 3.3380 3.3380 3.8077 3.8077 3.8113 3.8113 4.0938 4.0938 4.1018 4.1018 4.9975 4.9975 5.0010 5.0010 6.1151 6.1151 6.1157 6.1157 9.4984 9.4984 9.5012 9.5012 11.9048 11.9048 11.9109 11.9109 k =-0.1500 0.0417 0.5229 ( 3004 PWs) bands (ev): -14.5056 -14.5056 -14.5055 -14.5055 -13.5810 -13.5810 -13.5809 -13.5809 -3.0739 -3.0739 -3.0737 -3.0737 -0.9896 -0.9896 -0.9890 -0.9890 0.6520 0.6520 0.6522 0.6522 1.1789 1.1789 1.1812 1.1812 1.9638 1.9638 1.9676 1.9676 2.5700 2.5700 2.5715 2.5715 3.3340 3.3340 3.3400 3.3400 3.8076 3.8076 3.8114 3.8114 4.0949 4.0949 4.1035 4.1035 5.0013 5.0013 5.0051 5.0051 6.1210 6.1210 6.1217 6.1217 9.5364 9.5364 9.5396 9.5396 11.8887 11.8887 11.8955 11.8955 k =-0.1667 0.0464 0.5229 ( 3012 PWs) bands (ev): -14.4986 -14.4986 -14.4985 -14.4985 -13.5905 -13.5905 -13.5904 -13.5904 -3.0499 -3.0499 -3.0496 -3.0496 -0.9998 -0.9998 -0.9992 -0.9992 0.6551 0.6551 0.6553 0.6553 1.1730 1.1730 1.1756 1.1756 1.9355 1.9355 1.9396 1.9396 2.5627 2.5627 2.5642 2.5642 3.3357 3.3357 3.3419 3.3419 3.8074 3.8074 3.8115 3.8115 4.0960 4.0960 4.1051 4.1051 5.0054 5.0054 5.0094 5.0094 6.1274 6.1274 6.1281 6.1281 9.5782 9.5782 9.5818 9.5818 11.8705 11.8705 11.8780 11.8780 k =-0.1833 0.0510 0.5229 ( 3008 PWs) bands (ev): -14.4909 -14.4909 -14.4908 -14.4908 -13.6007 -13.6007 -13.6006 -13.6006 -3.0238 -3.0238 -3.0235 -3.0235 -1.0111 -1.0111 -1.0104 -1.0104 0.6584 0.6584 0.6586 0.6586 1.1665 1.1665 1.1694 1.1694 1.9063 1.9063 1.9107 1.9107 2.5549 2.5549 2.5565 2.5565 3.3373 3.3373 3.3437 3.3437 3.8073 3.8073 3.8115 3.8115 4.0972 4.0972 4.1067 4.1067 5.0097 5.0097 5.0139 5.0139 6.1342 6.1342 6.1349 6.1349 9.6237 9.6237 9.6276 9.6276 11.8502 11.8502 11.8582 11.8582 k =-0.2000 0.0556 0.5229 ( 3010 PWs) bands (ev): -14.4827 -14.4827 -14.4826 -14.4826 -13.6116 -13.6116 -13.6115 -13.6115 -2.9959 -2.9959 -2.9956 -2.9956 -1.0235 -1.0235 -1.0228 -1.0228 0.6619 0.6619 0.6622 0.6622 1.1595 1.1595 1.1625 1.1625 1.8764 1.8764 1.8812 1.8812 2.5467 2.5467 2.5484 2.5484 3.3388 3.3388 3.3453 3.3453 3.8072 3.8072 3.8115 3.8115 4.0983 4.0983 4.1080 4.1080 5.0142 5.0142 5.0185 5.0185 6.1412 6.1412 6.1420 6.1420 9.6726 9.6726 9.6769 9.6769 11.8277 11.8277 11.8362 11.8362 k =-0.2167 0.0603 0.5229 ( 2998 PWs) bands (ev): -14.4740 -14.4740 -14.4739 -14.4739 -13.6230 -13.6230 -13.6229 -13.6229 -2.9663 -2.9663 -2.9660 -2.9660 -1.0370 -1.0370 -1.0362 -1.0362 0.6656 0.6656 0.6659 0.6659 1.1518 1.1518 1.1551 1.1551 1.8465 1.8465 1.8514 1.8514 2.5383 2.5383 2.5400 2.5400 3.3403 3.3403 3.3469 3.3469 3.8071 3.8071 3.8115 3.8115 4.0994 4.0994 4.1092 4.1092 5.0189 5.0189 5.0232 5.0232 6.1486 6.1486 6.1494 6.1494 9.7248 9.7248 9.7294 9.7294 11.8029 11.8029 11.8119 11.8119 k =-0.2333 0.0649 0.5229 ( 3000 PWs) bands (ev): -14.4649 -14.4649 -14.4648 -14.4648 -13.6350 -13.6350 -13.6349 -13.6349 -2.9353 -2.9353 -2.9350 -2.9350 -1.0516 -1.0516 -1.0508 -1.0508 0.6694 0.6694 0.6697 0.6697 1.1436 1.1436 1.1470 1.1470 1.8167 1.8167 1.8219 1.8219 2.5296 2.5296 2.5313 2.5313 3.3417 3.3417 3.3482 3.3482 3.8071 3.8071 3.8115 3.8115 4.1003 4.1003 4.1101 4.1101 5.0235 5.0235 5.0278 5.0278 6.1561 6.1561 6.1568 6.1568 9.7799 9.7799 9.7848 9.7848 11.7757 11.7757 11.7852 11.7852 k =-0.2500 0.0696 0.5229 ( 2996 PWs) bands (ev): -14.4554 -14.4554 -14.4553 -14.4553 -13.6473 -13.6473 -13.6472 -13.6472 -2.9032 -2.9032 -2.9028 -2.9028 -1.0672 -1.0672 -1.0664 -1.0664 0.6733 0.6733 0.6735 0.6735 1.1349 1.1349 1.1384 1.1384 1.7876 1.7876 1.7929 1.7929 2.5209 2.5209 2.5226 2.5226 3.3430 3.3430 3.3494 3.3494 3.8070 3.8070 3.8114 3.8114 4.1012 4.1012 4.1109 4.1109 5.0282 5.0282 5.0325 5.0325 6.1636 6.1636 6.1643 6.1643 9.8376 9.8376 9.8429 9.8429 11.7462 11.7462 11.7560 11.7560 k =-0.2667 0.0742 0.5229 ( 2996 PWs) bands (ev): -14.4456 -14.4456 -14.4455 -14.4455 -13.6600 -13.6600 -13.6599 -13.6599 -2.8701 -2.8701 -2.8697 -2.8697 -1.0838 -1.0838 -1.0830 -1.0830 0.6771 0.6771 0.6774 0.6774 1.1257 1.1257 1.1293 1.1293 1.7595 1.7595 1.7648 1.7648 2.5122 2.5122 2.5139 2.5139 3.3443 3.3443 3.3506 3.3506 3.8070 3.8070 3.8112 3.8112 4.1019 4.1019 4.1114 4.1114 5.0328 5.0328 5.0370 5.0370 6.1711 6.1711 6.1718 6.1718 9.8977 9.8977 9.9033 9.9033 11.7143 11.7143 11.7243 11.7243 k =-0.2833 0.0788 0.5229 ( 2992 PWs) bands (ev): -14.4356 -14.4356 -14.4355 -14.4355 -13.6728 -13.6728 -13.6727 -13.6727 -2.8364 -2.8364 -2.8360 -2.8360 -1.1013 -1.1013 -1.1004 -1.1004 0.6810 0.6810 0.6812 0.6812 1.1162 1.1162 1.1198 1.1198 1.7327 1.7327 1.7380 1.7380 2.5035 2.5035 2.5052 2.5052 3.3455 3.3455 3.3515 3.3515 3.8069 3.8069 3.8111 3.8111 4.1025 4.1025 4.1117 4.1117 5.0373 5.0373 5.0414 5.0414 6.1785 6.1785 6.1792 6.1792 9.9599 9.9599 9.9659 9.9659 11.6799 11.6799 11.6902 11.6902 k =-0.3000 0.0835 0.5229 ( 2990 PWs) bands (ev): -14.4255 -14.4255 -14.4254 -14.4254 -13.6856 -13.6856 -13.6855 -13.6855 -2.8024 -2.8024 -2.8020 -2.8020 -1.1195 -1.1195 -1.1186 -1.1186 0.6848 0.6848 0.6851 0.6851 1.1064 1.1064 1.1099 1.1099 1.7074 1.7074 1.7126 1.7126 2.4951 2.4951 2.4967 2.4967 3.3465 3.3465 3.3522 3.3522 3.8069 3.8069 3.8109 3.8109 4.1031 4.1031 4.1119 4.1119 5.0417 5.0417 5.0456 5.0456 6.1857 6.1857 6.1864 6.1864 10.0239 10.0239 10.0301 10.0301 11.6431 11.6431 11.6536 11.6536 k =-0.3167 0.0881 0.5229 ( 2998 PWs) bands (ev): -14.4154 -14.4154 -14.4153 -14.4153 -13.6984 -13.6984 -13.6983 -13.6983 -2.7685 -2.7685 -2.7681 -2.7681 -1.1382 -1.1382 -1.1373 -1.1373 0.6884 0.6884 0.6887 0.6887 1.0964 1.0964 1.0999 1.0999 1.6838 1.6838 1.6889 1.6889 2.4870 2.4870 2.4885 2.4885 3.3473 3.3473 3.3527 3.3527 3.8069 3.8069 3.8107 3.8107 4.1035 4.1035 4.1118 4.1118 5.0458 5.0458 5.0495 5.0495 6.1926 6.1926 6.1933 6.1933 10.0892 10.0892 10.0957 10.0957 11.6040 11.6040 11.6146 11.6146 k =-0.3333 0.0927 0.5229 ( 2998 PWs) bands (ev): -14.4054 -14.4054 -14.4053 -14.4053 -13.7109 -13.7109 -13.7108 -13.7108 -2.7349 -2.7349 -2.7345 -2.7345 -1.1571 -1.1571 -1.1563 -1.1563 0.6920 0.6920 0.6922 0.6922 1.0865 1.0865 1.0898 1.0898 1.6622 1.6622 1.6671 1.6671 2.4792 2.4792 2.4806 2.4806 3.3481 3.3481 3.3531 3.3531 3.8069 3.8069 3.8105 3.8105 4.1038 4.1038 4.1116 4.1116 5.0498 5.0498 5.0532 5.0532 6.1993 6.1993 6.1999 6.1999 10.1555 10.1555 10.1622 10.1622 11.5627 11.5627 11.5733 11.5733 k =-0.3500 0.0974 0.5229 ( 3004 PWs) bands (ev): -14.3957 -14.3957 -14.3956 -14.3956 -13.7230 -13.7230 -13.7229 -13.7229 -2.7023 -2.7023 -2.7019 -2.7019 -1.1762 -1.1762 -1.1754 -1.1754 0.6953 0.6953 0.6955 0.6955 1.0767 1.0767 1.0799 1.0799 1.6426 1.6426 1.6472 1.6472 2.4718 2.4718 2.4732 2.4732 3.3488 3.3488 3.3534 3.3534 3.8069 3.8069 3.8102 3.8102 4.1041 4.1041 4.1113 4.1113 5.0535 5.0535 5.0566 5.0566 6.2055 6.2055 6.2061 6.2061 10.2224 10.2224 10.2293 10.2293 11.5193 11.5193 11.5299 11.5299 k =-0.3667 0.1020 0.5229 ( 3004 PWs) bands (ev): -14.3864 -14.3864 -14.3863 -14.3863 -13.7345 -13.7345 -13.7344 -13.7344 -2.6711 -2.6711 -2.6707 -2.6707 -1.1949 -1.1949 -1.1941 -1.1941 0.6984 0.6984 0.6987 0.6987 1.0674 1.0674 1.0702 1.0702 1.6252 1.6252 1.6294 1.6294 2.4651 2.4651 2.4663 2.4663 3.3494 3.3494 3.3537 3.3537 3.8070 3.8070 3.8099 3.8099 4.1044 4.1044 4.1110 4.1110 5.0568 5.0568 5.0597 5.0597 6.2113 6.2113 6.2118 6.2118 10.2892 10.2892 10.2963 10.2963 11.4742 11.4742 11.4847 11.4847 k =-0.3833 0.1066 0.5229 ( 3002 PWs) bands (ev): -14.3776 -14.3776 -14.3775 -14.3775 -13.7452 -13.7452 -13.7451 -13.7451 -2.6416 -2.6416 -2.6412 -2.6412 -1.2129 -1.2129 -1.2122 -1.2122 0.7013 0.7013 0.7015 0.7015 1.0585 1.0585 1.0611 1.0611 1.6099 1.6099 1.6137 1.6137 2.4589 2.4589 2.4600 2.4600 3.3500 3.3500 3.3538 3.3538 3.8071 3.8071 3.8097 3.8097 4.1047 4.1047 4.1105 4.1105 5.0599 5.0599 5.0625 5.0625 6.2165 6.2165 6.2170 6.2170 10.3555 10.3555 10.3627 10.3627 11.4278 11.4278 11.4380 11.4380 k =-0.4000 0.1113 0.5229 ( 3010 PWs) bands (ev): -14.3696 -14.3696 -14.3695 -14.3695 -13.7550 -13.7550 -13.7550 -13.7550 -2.6145 -2.6145 -2.6142 -2.6142 -1.2299 -1.2299 -1.2292 -1.2292 0.7039 0.7039 0.7041 0.7041 1.0504 1.0504 1.0527 1.0527 1.5967 1.5967 1.6001 1.6001 2.4534 2.4534 2.4544 2.4544 3.3505 3.3505 3.3538 3.3538 3.8071 3.8071 3.8094 3.8094 4.1049 4.1049 4.1100 4.1100 5.0626 5.0626 5.0649 5.0649 6.2211 6.2211 6.2215 6.2215 10.4204 10.4204 10.4276 10.4276 11.3806 11.3806 11.3905 11.3905 k =-0.4167 0.1159 0.5229 ( 3008 PWs) bands (ev): -14.3624 -14.3624 -14.3623 -14.3623 -13.7638 -13.7638 -13.7637 -13.7637 -2.5904 -2.5904 -2.5901 -2.5901 -1.2453 -1.2453 -1.2447 -1.2447 0.7061 0.7061 0.7063 0.7063 1.0433 1.0433 1.0452 1.0452 1.5857 1.5857 1.5886 1.5886 2.4487 2.4487 2.4495 2.4495 3.3510 3.3510 3.3538 3.3538 3.8072 3.8072 3.8091 3.8091 4.1052 4.1052 4.1094 4.1094 5.0650 5.0650 5.0669 5.0669 6.2252 6.2252 6.2255 6.2255 10.4828 10.4828 10.4898 10.4898 11.3337 11.3337 11.3430 11.3430 k =-0.4333 0.1206 0.5229 ( 3004 PWs) bands (ev): -14.3562 -14.3562 -14.3562 -14.3562 -13.7712 -13.7712 -13.7711 -13.7711 -2.5697 -2.5697 -2.5694 -2.5694 -1.2587 -1.2587 -1.2582 -1.2582 0.7080 0.7080 0.7081 0.7081 1.0372 1.0372 1.0388 1.0388 1.5769 1.5769 1.5792 1.5792 2.4447 2.4447 2.4454 2.4454 3.3515 3.3515 3.3537 3.3537 3.8073 3.8073 3.8089 3.8089 4.1054 4.1054 4.1089 4.1089 5.0670 5.0670 5.0686 5.0686 6.2286 6.2286 6.2288 6.2288 10.5413 10.5413 10.5479 10.5479 11.2885 11.2885 11.2970 11.2970 k =-0.4500 0.1252 0.5229 ( 3000 PWs) bands (ev): -14.3513 -14.3513 -14.3512 -14.3512 -13.7771 -13.7771 -13.7771 -13.7771 -2.5529 -2.5529 -2.5527 -2.5527 -1.2697 -1.2697 -1.2693 -1.2693 0.7095 0.7095 0.7096 0.7096 1.0324 1.0324 1.0336 1.0336 1.5701 1.5701 1.5719 1.5719 2.4417 2.4417 2.4421 2.4421 3.3519 3.3519 3.3536 3.3536 3.8074 3.8074 3.8086 3.8086 4.1058 4.1058 4.1084 4.1084 5.0687 5.0687 5.0698 5.0698 6.2312 6.2312 6.2314 6.2314 10.5936 10.5936 10.5994 10.5994 11.2471 11.2471 11.2544 11.2544 k =-0.4667 0.1298 0.5229 ( 3000 PWs) bands (ev): -14.3476 -14.3476 -14.3476 -14.3476 -13.7815 -13.7815 -13.7815 -13.7815 -2.5406 -2.5406 -2.5404 -2.5404 -1.2778 -1.2778 -1.2776 -1.2776 0.7106 0.7106 0.7106 0.7106 1.0289 1.0289 1.0297 1.0297 1.5654 1.5654 1.5666 1.5666 2.4395 2.4395 2.4398 2.4398 3.3523 3.3523 3.3534 3.3534 3.8076 3.8076 3.8084 3.8084 4.1061 4.1061 4.1078 4.1078 5.0699 5.0699 5.0707 5.0707 6.2332 6.2332 6.2333 6.2333 10.6366 10.6366 10.6411 10.6411 11.2128 11.2128 11.2183 11.2183 k =-0.4833 0.1345 0.5229 ( 3008 PWs) bands (ev): -14.3454 -14.3454 -14.3454 -14.3454 -13.7842 -13.7842 -13.7841 -13.7841 -2.5330 -2.5330 -2.5329 -2.5329 -1.2828 -1.2828 -1.2827 -1.2827 0.7112 0.7112 0.7112 0.7112 1.0268 1.0268 1.0272 1.0272 1.5626 1.5626 1.5632 1.5632 2.4381 2.4381 2.4383 2.4383 3.3526 3.3526 3.3531 3.3531 3.8078 3.8078 3.8082 3.8082 4.1064 4.1064 4.1073 4.1073 5.0706 5.0706 5.0710 5.0710 6.2343 6.2343 6.2344 6.2344 10.6659 10.6659 10.6685 10.6685 11.1900 11.1900 11.1930 11.1930 k =-0.5000 0.1391 0.5229 ( 3008 PWs) bands (ev): -14.3446 -14.3446 -14.3446 -14.3446 -13.7850 -13.7850 -13.7850 -13.7850 -2.5304 -2.5304 -2.5304 -2.5304 -1.2845 -1.2845 -1.2845 -1.2845 0.7114 0.7114 0.7114 0.7114 1.0263 1.0263 1.0263 1.0263 1.5619 1.5619 1.5619 1.5619 2.4378 2.4378 2.4378 2.4378 3.3529 3.3529 3.3529 3.3529 3.8079 3.8079 3.8079 3.8079 4.1068 4.1068 4.1068 4.1068 5.0710 5.0710 5.0710 5.0710 6.2347 6.2347 6.2347 6.2347 10.6773 10.6773 10.6773 10.6773 11.1828 11.1828 11.1828 11.1828 Writing output data file CuxHOx2.save init_run : 0.72s CPU 0.43s WALL ( 1 calls) electrons : 442.29s CPU 300.95s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.10s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 442.28s CPU 300.93s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.14s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.37s CPU 0.54s WALL ( 440 calls) cegterg : 388.24s CPU 269.85s WALL ( 733 calls) Called by sum_band: Called by *egterg: h_psi : 277.60s CPU 169.42s WALL ( 10362 calls) s_psi : 10.13s CPU 6.74s WALL ( 10362 calls) g_psi : 0.33s CPU 0.27s WALL ( 9189 calls) cdiaghg : 115.51s CPU 95.14s WALL ( 9629 calls) cegterg:over : 12.16s CPU 9.08s WALL ( 9189 calls) cegterg:upda : 9.61s CPU 7.11s WALL ( 9189 calls) cegterg:last : 4.80s CPU 3.76s WALL ( 1613 calls) cdiaghg:chol : 6.47s CPU 5.31s WALL ( 9629 calls) cdiaghg:inve : 3.98s CPU 3.44s WALL ( 9629 calls) cdiaghg:para : 6.95s CPU 5.66s WALL ( 19258 calls) Called by h_psi: h_psi:vloc : 251.79s CPU 151.87s WALL ( 10362 calls) h_psi:vnl : 25.49s CPU 17.29s WALL ( 10362 calls) add_vuspsi : 14.31s CPU 9.41s WALL ( 10362 calls) General routines calbec : 11.15s CPU 7.84s WALL ( 10362 calls) fft : 0.04s CPU 0.02s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 237.67s CPU 142.03s WALL ( 1224468 calls) interpolate : 0.02s CPU 0.01s WALL ( 4 calls) davcio : 0.54s CPU 1.17s WALL ( 880 calls) Parallel routines fft_scatter : 81.94s CPU 54.62s WALL ( 1224491 calls) PWSCF : 7m44.01s CPU 5m39.85s WALL This run was terminated on: 2:57:53 12Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=