Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:56:39 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./NaHO.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 49 41 12 1211 911 146 Max 50 42 13 1214 917 149 Sum 1791 1477 435 43679 32933 5281 bravais-lattice index = 14 lattice parameter (alat) = 11.2207 a.u. unit-cell volume = 443.7638 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 32.00 number of Kohn-Sham states= 40 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.220729 celldm(2)= 1.000000 celldm(3)= 0.572338 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.835935 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.835935 0.548828 0.000000 ) a(3) = ( 0.000000 0.000000 0.572338 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.523128 -0.000000 ) b(2) = ( 0.000000 1.822064 -0.000000 ) b(3) = ( 0.000000 0.000000 1.747221 ) 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 Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) H 1.00 1.00790 H( 1.00) Na 9.00 22.98980 Na( 1.00) 4 Sym. Ops., with inversion, found ( 2 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 ) ( 0.2861688 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.2861688 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 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 i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 474 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 2) = ( 0.0053400 0.0178634 -0.0000000), wk = 0.0021097 k( 3) = ( 0.0106800 0.0357267 -0.0000000), wk = 0.0021097 k( 4) = ( 0.0160200 0.0535901 -0.0000000), wk = 0.0021097 k( 5) = ( 0.0213601 0.0714535 -0.0000000), wk = 0.0021097 k( 6) = ( 0.0267001 0.0893168 -0.0000000), wk = 0.0021097 k( 7) = ( 0.0320401 0.1071802 -0.0000000), wk = 0.0021097 k( 8) = ( 0.0373801 0.1250436 -0.0000000), wk = 0.0021097 k( 9) = ( 0.0427201 0.1429070 -0.0000000), wk = 0.0021097 k( 10) = ( 0.0480601 0.1607703 -0.0000000), wk = 0.0021097 k( 11) = ( 0.0534002 0.1786337 -0.0000000), wk = 0.0021097 k( 12) = ( 0.0587402 0.1964971 -0.0000000), wk = 0.0021097 k( 13) = ( 0.0640802 0.2143605 -0.0000000), wk = 0.0021097 k( 14) = ( 0.0694202 0.2322238 -0.0000000), wk = 0.0021097 k( 15) = ( 0.0747602 0.2500872 -0.0000000), wk = 0.0021097 k( 16) = ( 0.0801002 0.2679506 -0.0000000), wk = 0.0021097 k( 17) = ( 0.0854402 0.2858140 -0.0000000), wk = 0.0021097 k( 18) = ( 0.0907803 0.3036773 -0.0000000), wk = 0.0021097 k( 19) = ( 0.0961203 0.3215407 -0.0000000), wk = 0.0021097 k( 20) = ( 0.1014603 0.3394041 -0.0000000), wk = 0.0021097 k( 21) = ( 0.1068003 0.3572675 -0.0000000), wk = 0.0021097 k( 22) = ( 0.1121403 0.3751308 -0.0000000), wk = 0.0021097 k( 23) = ( 0.1174803 0.3929942 -0.0000000), wk = 0.0021097 k( 24) = ( 0.1228203 0.4108576 -0.0000000), wk = 0.0021097 k( 25) = ( 0.1281604 0.4287210 -0.0000000), wk = 0.0021097 k( 26) = ( 0.1335004 0.4465843 -0.0000000), wk = 0.0021097 k( 27) = ( 0.1388404 0.4644477 -0.0000000), wk = 0.0021097 k( 28) = ( 0.1441804 0.4823111 -0.0000000), wk = 0.0021097 k( 29) = ( 0.1495204 0.5001744 -0.0000000), wk = 0.0021097 k( 30) = ( 0.1548604 0.5180378 -0.0000000), wk = 0.0021097 k( 31) = ( 0.1602004 0.5359012 -0.0000000), wk = 0.0021097 k( 32) = ( 0.1655405 0.5537645 -0.0000000), wk = 0.0021097 k( 33) = ( 0.1708805 0.5716279 -0.0000000), wk = 0.0021097 k( 34) = ( 0.1762205 0.5894913 -0.0000000), wk = 0.0021097 k( 35) = ( 0.1815605 0.6073547 -0.0000000), wk = 0.0021097 k( 36) = ( 0.1869005 0.6252180 -0.0000000), wk = 0.0021097 k( 37) = ( 0.1922405 0.6430814 -0.0000000), wk = 0.0021097 k( 38) = ( 0.1975805 0.6609448 -0.0000000), wk = 0.0021097 k( 39) = ( 0.2029206 0.6788082 -0.0000000), wk = 0.0021097 k( 40) = ( 0.2082606 0.6966715 -0.0000000), wk = 0.0021097 k( 41) = ( 0.2136006 0.7145349 -0.0000000), wk = 0.0021097 k( 42) = ( 0.2189406 0.7323983 -0.0000000), wk = 0.0021097 k( 43) = ( 0.2242806 0.7502617 -0.0000000), wk = 0.0021097 k( 44) = ( 0.2296206 0.7681250 -0.0000000), wk = 0.0021097 k( 45) = ( 0.2349607 0.7859884 -0.0000000), wk = 0.0021097 k( 46) = ( 0.2403007 0.8038518 -0.0000000), wk = 0.0021097 k( 47) = ( 0.2456407 0.8217152 -0.0000000), wk = 0.0021097 k( 48) = ( 0.2509807 0.8395785 -0.0000000), wk = 0.0021097 k( 49) = ( 0.2563207 0.8574419 -0.0000000), wk = 0.0021097 k( 50) = ( 0.2616607 0.8753053 -0.0000000), wk = 0.0021097 k( 51) = ( 0.2670008 0.8931687 -0.0000000), wk = 0.0021097 k( 52) = ( 0.2723408 0.9110320 -0.0000000), wk = 0.0021097 k( 53) = ( 0.2723408 0.9110320 -0.0000000), wk = 0.0021097 k( 54) = ( 0.2541847 0.9110320 -0.0000000), wk = 0.0021097 k( 55) = ( 0.2360287 0.9110320 -0.0000000), wk = 0.0021097 k( 56) = ( 0.2178726 0.9110320 -0.0000000), wk = 0.0021097 k( 57) = ( 0.1997166 0.9110320 -0.0000000), wk = 0.0021097 k( 58) = ( 0.1815605 0.9110320 -0.0000000), wk = 0.0021097 k( 59) = ( 0.1634045 0.9110320 -0.0000000), wk = 0.0021097 k( 60) = ( 0.1452484 0.9110320 -0.0000000), wk = 0.0021097 k( 61) = ( 0.1270924 0.9110320 -0.0000000), wk = 0.0021097 k( 62) = ( 0.1089363 0.9110320 -0.0000000), wk = 0.0021097 k( 63) = ( 0.0907803 0.9110320 -0.0000000), wk = 0.0021097 k( 64) = ( 0.0726242 0.9110320 -0.0000000), wk = 0.0021097 k( 65) = ( 0.0544681 0.9110320 -0.0000000), wk = 0.0021097 k( 66) = ( 0.0363121 0.9110320 -0.0000000), wk = 0.0021097 k( 67) = ( 0.0181560 0.9110320 -0.0000000), wk = 0.0021097 k( 68) = ( 0.0000000 0.9110320 -0.0000000), wk = 0.0021097 k( 69) = ( 0.0000000 0.9110320 -0.0000000), wk = 0.0021097 k( 70) = ( 0.0000000 0.9110320 0.0185875), wk = 0.0021097 k( 71) = ( 0.0000000 0.9110320 0.0371749), wk = 0.0021097 k( 72) = ( 0.0000000 0.9110320 0.0557624), wk = 0.0021097 k( 73) = ( 0.0000000 0.9110320 0.0743498), wk = 0.0021097 k( 74) = ( 0.0000000 0.9110320 0.0929373), wk = 0.0021097 k( 75) = ( 0.0000000 0.9110320 0.1115247), wk = 0.0021097 k( 76) = ( 0.0000000 0.9110320 0.1301122), wk = 0.0021097 k( 77) = ( 0.0000000 0.9110320 0.1486996), wk = 0.0021097 k( 78) = ( 0.0000000 0.9110320 0.1672871), wk = 0.0021097 k( 79) = ( 0.0000000 0.9110320 0.1858745), wk = 0.0021097 k( 80) = ( 0.0000000 0.9110320 0.2044620), wk = 0.0021097 k( 81) = ( 0.0000000 0.9110320 0.2230494), wk = 0.0021097 k( 82) = ( 0.0000000 0.9110320 0.2416369), wk = 0.0021097 k( 83) = ( 0.0000000 0.9110320 0.2602244), wk = 0.0021097 k( 84) = ( 0.0000000 0.9110320 0.2788118), wk = 0.0021097 k( 85) = ( 0.0000000 0.9110320 0.2973993), wk = 0.0021097 k( 86) = ( 0.0000000 0.9110320 0.3159867), wk = 0.0021097 k( 87) = ( 0.0000000 0.9110320 0.3345742), wk = 0.0021097 k( 88) = ( 0.0000000 0.9110320 0.3531616), wk = 0.0021097 k( 89) = ( 0.0000000 0.9110320 0.3717491), wk = 0.0021097 k( 90) = ( 0.0000000 0.9110320 0.3903365), wk = 0.0021097 k( 91) = ( 0.0000000 0.9110320 0.4089240), wk = 0.0021097 k( 92) = ( 0.0000000 0.9110320 0.4275114), wk = 0.0021097 k( 93) = ( 0.0000000 0.9110320 0.4460989), wk = 0.0021097 k( 94) = ( 0.0000000 0.9110320 0.4646864), wk = 0.0021097 k( 95) = ( 0.0000000 0.9110320 0.4832738), wk = 0.0021097 k( 96) = ( 0.0000000 0.9110320 0.5018613), wk = 0.0021097 k( 97) = ( 0.0000000 0.9110320 0.5204487), wk = 0.0021097 k( 98) = ( 0.0000000 0.9110320 0.5390362), wk = 0.0021097 k( 99) = ( 0.0000000 0.9110320 0.5576236), wk = 0.0021097 k( 100) = ( 0.0000000 0.9110320 0.5762111), wk = 0.0021097 k( 101) = ( 0.0000000 0.9110320 0.5947985), wk = 0.0021097 k( 102) = ( 0.0000000 0.9110320 0.6133860), wk = 0.0021097 k( 103) = ( 0.0000000 0.9110320 0.6319734), wk = 0.0021097 k( 104) = ( 0.0000000 0.9110320 0.6505609), wk = 0.0021097 k( 105) = ( 0.0000000 0.9110320 0.6691483), wk = 0.0021097 k( 106) = ( 0.0000000 0.9110320 0.6877358), wk = 0.0021097 k( 107) = ( 0.0000000 0.9110320 0.7063233), wk = 0.0021097 k( 108) = ( 0.0000000 0.9110320 0.7249107), wk = 0.0021097 k( 109) = ( 0.0000000 0.9110320 0.7434982), wk = 0.0021097 k( 110) = ( 0.0000000 0.9110320 0.7620856), wk = 0.0021097 k( 111) = ( 0.0000000 0.9110320 0.7806731), wk = 0.0021097 k( 112) = ( 0.0000000 0.9110320 0.7992605), wk = 0.0021097 k( 113) = ( 0.0000000 0.9110320 0.8178480), wk = 0.0021097 k( 114) = ( 0.0000000 0.9110320 0.8364354), wk = 0.0021097 k( 115) = ( 0.0000000 0.9110320 0.8550229), wk = 0.0021097 k( 116) = ( 0.0000000 0.9110320 0.8736103), wk = 0.0021097 k( 117) = ( 0.0000000 0.9110320 0.8736103), wk = 0.0021097 k( 118) = ( 0.0181560 0.9110320 0.8736103), wk = 0.0021097 k( 119) = ( 0.0363121 0.9110320 0.8736103), wk = 0.0021097 k( 120) = ( 0.0544681 0.9110320 0.8736103), wk = 0.0021097 k( 121) = ( 0.0726242 0.9110320 0.8736103), wk = 0.0021097 k( 122) = ( 0.0907803 0.9110320 0.8736103), wk = 0.0021097 k( 123) = ( 0.1089363 0.9110320 0.8736103), wk = 0.0021097 k( 124) = ( 0.1270924 0.9110320 0.8736103), wk = 0.0021097 k( 125) = ( 0.1452484 0.9110320 0.8736103), wk = 0.0021097 k( 126) = ( 0.1634045 0.9110320 0.8736103), wk = 0.0021097 k( 127) = ( 0.1815605 0.9110320 0.8736103), wk = 0.0021097 k( 128) = ( 0.1997166 0.9110320 0.8736103), wk = 0.0021097 k( 129) = ( 0.2178726 0.9110320 0.8736103), wk = 0.0021097 k( 130) = ( 0.2360287 0.9110320 0.8736103), wk = 0.0021097 k( 131) = ( 0.2541847 0.9110320 0.8736103), wk = 0.0021097 k( 132) = ( 0.2723408 0.9110320 0.8736103), wk = 0.0021097 k( 133) = ( 0.2723408 0.9110320 0.8736103), wk = 0.0021097 k( 134) = ( 0.2670008 0.8931687 0.8736103), wk = 0.0021097 k( 135) = ( 0.2616607 0.8753053 0.8736103), wk = 0.0021097 k( 136) = ( 0.2563207 0.8574419 0.8736103), wk = 0.0021097 k( 137) = ( 0.2509807 0.8395785 0.8736103), wk = 0.0021097 k( 138) = ( 0.2456407 0.8217152 0.8736103), wk = 0.0021097 k( 139) = ( 0.2403007 0.8038518 0.8736103), wk = 0.0021097 k( 140) = ( 0.2349607 0.7859884 0.8736103), wk = 0.0021097 k( 141) = ( 0.2296206 0.7681250 0.8736103), wk = 0.0021097 k( 142) = ( 0.2242806 0.7502617 0.8736103), wk = 0.0021097 k( 143) = ( 0.2189406 0.7323983 0.8736103), wk = 0.0021097 k( 144) = ( 0.2136006 0.7145349 0.8736103), wk = 0.0021097 k( 145) = ( 0.2082606 0.6966715 0.8736103), wk = 0.0021097 k( 146) = ( 0.2029206 0.6788082 0.8736103), wk = 0.0021097 k( 147) = ( 0.1975805 0.6609448 0.8736103), wk = 0.0021097 k( 148) = ( 0.1922405 0.6430814 0.8736103), wk = 0.0021097 k( 149) = ( 0.1869005 0.6252180 0.8736103), wk = 0.0021097 k( 150) = ( 0.1815605 0.6073547 0.8736103), wk = 0.0021097 k( 151) = ( 0.1762205 0.5894913 0.8736103), wk = 0.0021097 k( 152) = ( 0.1708805 0.5716279 0.8736103), wk = 0.0021097 k( 153) = ( 0.1655405 0.5537645 0.8736103), wk = 0.0021097 k( 154) = ( 0.1602004 0.5359012 0.8736103), wk = 0.0021097 k( 155) = ( 0.1548604 0.5180378 0.8736103), wk = 0.0021097 k( 156) = ( 0.1495204 0.5001744 0.8736103), wk = 0.0021097 k( 157) = ( 0.1441804 0.4823111 0.8736103), wk = 0.0021097 k( 158) = ( 0.1388404 0.4644477 0.8736103), wk = 0.0021097 k( 159) = ( 0.1335004 0.4465843 0.8736103), wk = 0.0021097 k( 160) = ( 0.1281604 0.4287210 0.8736103), wk = 0.0021097 k( 161) = ( 0.1228203 0.4108576 0.8736103), wk = 0.0021097 k( 162) = ( 0.1174803 0.3929942 0.8736103), wk = 0.0021097 k( 163) = ( 0.1121403 0.3751308 0.8736103), wk = 0.0021097 k( 164) = ( 0.1068003 0.3572675 0.8736103), wk = 0.0021097 k( 165) = ( 0.1014603 0.3394041 0.8736103), wk = 0.0021097 k( 166) = ( 0.0961203 0.3215407 0.8736103), wk = 0.0021097 k( 167) = ( 0.0907803 0.3036773 0.8736103), wk = 0.0021097 k( 168) = ( 0.0854402 0.2858140 0.8736103), wk = 0.0021097 k( 169) = ( 0.0801002 0.2679506 0.8736103), wk = 0.0021097 k( 170) = ( 0.0747602 0.2500872 0.8736103), wk = 0.0021097 k( 171) = ( 0.0694202 0.2322238 0.8736103), wk = 0.0021097 k( 172) = ( 0.0640802 0.2143605 0.8736103), wk = 0.0021097 k( 173) = ( 0.0587402 0.1964971 0.8736103), wk = 0.0021097 k( 174) = ( 0.0534002 0.1786337 0.8736103), wk = 0.0021097 k( 175) = ( 0.0480601 0.1607703 0.8736103), wk = 0.0021097 k( 176) = ( 0.0427201 0.1429070 0.8736103), wk = 0.0021097 k( 177) = ( 0.0373801 0.1250436 0.8736103), wk = 0.0021097 k( 178) = ( 0.0320401 0.1071802 0.8736103), wk = 0.0021097 k( 179) = ( 0.0267001 0.0893168 0.8736103), wk = 0.0021097 k( 180) = ( 0.0213601 0.0714535 0.8736103), wk = 0.0021097 k( 181) = ( 0.0160200 0.0535901 0.8736103), wk = 0.0021097 k( 182) = ( 0.0106800 0.0357267 0.8736103), wk = 0.0021097 k( 183) = ( 0.0053400 0.0178634 0.8736103), wk = 0.0021097 k( 184) = ( 0.0000000 0.0000000 0.8736103), wk = 0.0021097 k( 185) = ( 0.0000000 0.0000000 0.8736103), wk = 0.0021097 k( 186) = ( 0.0000000 0.0000000 0.8550229), wk = 0.0021097 k( 187) = ( 0.0000000 0.0000000 0.8364354), wk = 0.0021097 k( 188) = ( 0.0000000 0.0000000 0.8178480), wk = 0.0021097 k( 189) = ( 0.0000000 0.0000000 0.7992605), wk = 0.0021097 k( 190) = ( 0.0000000 0.0000000 0.7806731), wk = 0.0021097 k( 191) = ( 0.0000000 0.0000000 0.7620856), wk = 0.0021097 k( 192) = ( 0.0000000 0.0000000 0.7434982), wk = 0.0021097 k( 193) = ( 0.0000000 0.0000000 0.7249107), wk = 0.0021097 k( 194) = ( 0.0000000 0.0000000 0.7063233), wk = 0.0021097 k( 195) = ( 0.0000000 0.0000000 0.6877358), wk = 0.0021097 k( 196) = ( 0.0000000 0.0000000 0.6691483), wk = 0.0021097 k( 197) = ( 0.0000000 0.0000000 0.6505609), wk = 0.0021097 k( 198) = ( 0.0000000 0.0000000 0.6319734), wk = 0.0021097 k( 199) = ( 0.0000000 0.0000000 0.6133860), wk = 0.0021097 k( 200) = ( 0.0000000 0.0000000 0.5947985), wk = 0.0021097 k( 201) = ( 0.0000000 0.0000000 0.5762111), wk = 0.0021097 k( 202) = ( 0.0000000 0.0000000 0.5576236), wk = 0.0021097 k( 203) = ( 0.0000000 0.0000000 0.5390362), wk = 0.0021097 k( 204) = ( 0.0000000 0.0000000 0.5204487), wk = 0.0021097 k( 205) = ( 0.0000000 0.0000000 0.5018613), wk = 0.0021097 k( 206) = ( 0.0000000 0.0000000 0.4832738), wk = 0.0021097 k( 207) = ( 0.0000000 0.0000000 0.4646864), wk = 0.0021097 k( 208) = ( 0.0000000 0.0000000 0.4460989), wk = 0.0021097 k( 209) = ( 0.0000000 0.0000000 0.4275114), wk = 0.0021097 k( 210) = ( 0.0000000 0.0000000 0.4089240), wk = 0.0021097 k( 211) = ( 0.0000000 0.0000000 0.3903365), wk = 0.0021097 k( 212) = ( 0.0000000 0.0000000 0.3717491), wk = 0.0021097 k( 213) = ( 0.0000000 0.0000000 0.3531616), wk = 0.0021097 k( 214) = ( 0.0000000 0.0000000 0.3345742), wk = 0.0021097 k( 215) = ( 0.0000000 0.0000000 0.3159867), wk = 0.0021097 k( 216) = ( 0.0000000 0.0000000 0.2973993), wk = 0.0021097 k( 217) = ( 0.0000000 0.0000000 0.2788118), wk = 0.0021097 k( 218) = ( 0.0000000 0.0000000 0.2602244), wk = 0.0021097 k( 219) = ( 0.0000000 0.0000000 0.2416369), wk = 0.0021097 k( 220) = ( 0.0000000 0.0000000 0.2230494), wk = 0.0021097 k( 221) = ( 0.0000000 0.0000000 0.2044620), wk = 0.0021097 k( 222) = ( 0.0000000 0.0000000 0.1858745), wk = 0.0021097 k( 223) = ( 0.0000000 0.0000000 0.1672871), wk = 0.0021097 k( 224) = ( 0.0000000 0.0000000 0.1486996), wk = 0.0021097 k( 225) = ( 0.0000000 0.0000000 0.1301122), wk = 0.0021097 k( 226) = ( 0.0000000 0.0000000 0.1115247), wk = 0.0021097 k( 227) = ( 0.0000000 0.0000000 0.0929373), wk = 0.0021097 k( 228) = ( 0.0000000 0.0000000 0.0743498), wk = 0.0021097 k( 229) = ( 0.0000000 0.0000000 0.0557624), wk = 0.0021097 k( 230) = ( 0.0000000 0.0000000 0.0371749), wk = 0.0021097 k( 231) = ( 0.0000000 0.0000000 0.0185875), wk = 0.0021097 k( 232) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 233) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 234) = ( -0.0178571 0.0053382 -0.0000000), wk = 0.0021097 k( 235) = ( -0.0357143 0.0106763 -0.0000000), wk = 0.0021097 k( 236) = ( -0.0535714 0.0160145 -0.0000000), wk = 0.0021097 k( 237) = ( -0.0714286 0.0213526 -0.0000000), wk = 0.0021097 k( 238) = ( -0.0892857 0.0266908 -0.0000000), wk = 0.0021097 k( 239) = ( -0.1071429 0.0320289 -0.0000000), wk = 0.0021097 k( 240) = ( -0.1250000 0.0373671 -0.0000000), wk = 0.0021097 k( 241) = ( -0.1428571 0.0427052 -0.0000000), wk = 0.0021097 k( 242) = ( -0.1607143 0.0480434 -0.0000000), wk = 0.0021097 k( 243) = ( -0.1785714 0.0533815 -0.0000000), wk = 0.0021097 k( 244) = ( -0.1964286 0.0587197 -0.0000000), wk = 0.0021097 k( 245) = ( -0.2142857 0.0640578 -0.0000000), wk = 0.0021097 k( 246) = ( -0.2321429 0.0693960 -0.0000000), wk = 0.0021097 k( 247) = ( -0.2500000 0.0747341 -0.0000000), wk = 0.0021097 k( 248) = ( -0.2678571 0.0800723 -0.0000000), wk = 0.0021097 k( 249) = ( -0.2857143 0.0854104 -0.0000000), wk = 0.0021097 k( 250) = ( -0.3035714 0.0907486 -0.0000000), wk = 0.0021097 k( 251) = ( -0.3214286 0.0960867 -0.0000000), wk = 0.0021097 k( 252) = ( -0.3392857 0.1014249 -0.0000000), wk = 0.0021097 k( 253) = ( -0.3571429 0.1067631 -0.0000000), wk = 0.0021097 k( 254) = ( -0.3750000 0.1121012 -0.0000000), wk = 0.0021097 k( 255) = ( -0.3928571 0.1174394 -0.0000000), wk = 0.0021097 k( 256) = ( -0.4107143 0.1227775 -0.0000000), wk = 0.0021097 k( 257) = ( -0.4285714 0.1281157 -0.0000000), wk = 0.0021097 k( 258) = ( -0.4464286 0.1334538 -0.0000000), wk = 0.0021097 k( 259) = ( -0.4642857 0.1387920 -0.0000000), wk = 0.0021097 k( 260) = ( -0.4821429 0.1441301 -0.0000000), wk = 0.0021097 k( 261) = ( -0.5000000 0.1494683 -0.0000000), wk = 0.0021097 k( 262) = ( -0.5000000 0.1494683 -0.0000000), wk = 0.0021097 k( 263) = ( -0.4947056 0.1671791 -0.0000000), wk = 0.0021097 k( 264) = ( -0.4894112 0.1848898 -0.0000000), wk = 0.0021097 k( 265) = ( -0.4841168 0.2026006 -0.0000000), wk = 0.0021097 k( 266) = ( -0.4788224 0.2203114 -0.0000000), wk = 0.0021097 k( 267) = ( -0.4735280 0.2380222 -0.0000000), wk = 0.0021097 k( 268) = ( -0.4682336 0.2557330 -0.0000000), wk = 0.0021097 k( 269) = ( -0.4629392 0.2734438 -0.0000000), wk = 0.0021097 k( 270) = ( -0.4576448 0.2911546 -0.0000000), wk = 0.0021097 k( 271) = ( -0.4523504 0.3088653 -0.0000000), wk = 0.0021097 k( 272) = ( -0.4470560 0.3265761 -0.0000000), wk = 0.0021097 k( 273) = ( -0.4417616 0.3442869 -0.0000000), wk = 0.0021097 k( 274) = ( -0.4364672 0.3619977 -0.0000000), wk = 0.0021097 k( 275) = ( -0.4311728 0.3797085 -0.0000000), wk = 0.0021097 k( 276) = ( -0.4258784 0.3974193 -0.0000000), wk = 0.0021097 k( 277) = ( -0.4205840 0.4151300 -0.0000000), wk = 0.0021097 k( 278) = ( -0.4152896 0.4328408 -0.0000000), wk = 0.0021097 k( 279) = ( -0.4099952 0.4505516 -0.0000000), wk = 0.0021097 k( 280) = ( -0.4047008 0.4682624 -0.0000000), wk = 0.0021097 k( 281) = ( -0.3994064 0.4859732 -0.0000000), wk = 0.0021097 k( 282) = ( -0.3941120 0.5036840 -0.0000000), wk = 0.0021097 k( 283) = ( -0.3888176 0.5213948 -0.0000000), wk = 0.0021097 k( 284) = ( -0.3835232 0.5391055 -0.0000000), wk = 0.0021097 k( 285) = ( -0.3782288 0.5568163 -0.0000000), wk = 0.0021097 k( 286) = ( -0.3729344 0.5745271 -0.0000000), wk = 0.0021097 k( 287) = ( -0.3676400 0.5922379 -0.0000000), wk = 0.0021097 k( 288) = ( -0.3623456 0.6099487 -0.0000000), wk = 0.0021097 k( 289) = ( -0.3570512 0.6276595 -0.0000000), wk = 0.0021097 k( 290) = ( -0.3517568 0.6453702 -0.0000000), wk = 0.0021097 k( 291) = ( -0.3464624 0.6630810 -0.0000000), wk = 0.0021097 k( 292) = ( -0.3411680 0.6807918 -0.0000000), wk = 0.0021097 k( 293) = ( -0.3358736 0.6985026 -0.0000000), wk = 0.0021097 k( 294) = ( -0.3305792 0.7162134 -0.0000000), wk = 0.0021097 k( 295) = ( -0.3252848 0.7339242 -0.0000000), wk = 0.0021097 k( 296) = ( -0.3199904 0.7516350 -0.0000000), wk = 0.0021097 k( 297) = ( -0.3146960 0.7693457 -0.0000000), wk = 0.0021097 k( 298) = ( -0.3094016 0.7870565 -0.0000000), wk = 0.0021097 k( 299) = ( -0.3041072 0.8047673 -0.0000000), wk = 0.0021097 k( 300) = ( -0.2988128 0.8224781 -0.0000000), wk = 0.0021097 k( 301) = ( -0.2935184 0.8401889 -0.0000000), wk = 0.0021097 k( 302) = ( -0.2882240 0.8578997 -0.0000000), wk = 0.0021097 k( 303) = ( -0.2829296 0.8756104 -0.0000000), wk = 0.0021097 k( 304) = ( -0.2776352 0.8933212 -0.0000000), wk = 0.0021097 k( 305) = ( -0.2723408 0.9110320 -0.0000000), wk = 0.0021097 k( 306) = ( -0.2723408 0.9110320 -0.0000000), wk = 0.0021097 k( 307) = ( -0.2723408 0.9110320 0.0185875), wk = 0.0021097 k( 308) = ( -0.2723408 0.9110320 0.0371749), wk = 0.0021097 k( 309) = ( -0.2723408 0.9110320 0.0557624), wk = 0.0021097 k( 310) = ( -0.2723408 0.9110320 0.0743498), wk = 0.0021097 k( 311) = ( -0.2723408 0.9110320 0.0929373), wk = 0.0021097 k( 312) = ( -0.2723408 0.9110320 0.1115247), wk = 0.0021097 k( 313) = ( -0.2723408 0.9110320 0.1301122), wk = 0.0021097 k( 314) = ( -0.2723408 0.9110320 0.1486996), wk = 0.0021097 k( 315) = ( -0.2723408 0.9110320 0.1672871), wk = 0.0021097 k( 316) = ( -0.2723408 0.9110320 0.1858745), wk = 0.0021097 k( 317) = ( -0.2723408 0.9110320 0.2044620), wk = 0.0021097 k( 318) = ( -0.2723408 0.9110320 0.2230494), wk = 0.0021097 k( 319) = ( -0.2723408 0.9110320 0.2416369), wk = 0.0021097 k( 320) = ( -0.2723408 0.9110320 0.2602244), wk = 0.0021097 k( 321) = ( -0.2723408 0.9110320 0.2788118), wk = 0.0021097 k( 322) = ( -0.2723408 0.9110320 0.2973993), wk = 0.0021097 k( 323) = ( -0.2723408 0.9110320 0.3159867), wk = 0.0021097 k( 324) = ( -0.2723408 0.9110320 0.3345742), wk = 0.0021097 k( 325) = ( -0.2723408 0.9110320 0.3531616), wk = 0.0021097 k( 326) = ( -0.2723408 0.9110320 0.3717491), wk = 0.0021097 k( 327) = ( -0.2723408 0.9110320 0.3903365), wk = 0.0021097 k( 328) = ( -0.2723408 0.9110320 0.4089240), wk = 0.0021097 k( 329) = ( -0.2723408 0.9110320 0.4275114), wk = 0.0021097 k( 330) = ( -0.2723408 0.9110320 0.4460989), wk = 0.0021097 k( 331) = ( -0.2723408 0.9110320 0.4646864), wk = 0.0021097 k( 332) = ( -0.2723408 0.9110320 0.4832738), wk = 0.0021097 k( 333) = ( -0.2723408 0.9110320 0.5018613), wk = 0.0021097 k( 334) = ( -0.2723408 0.9110320 0.5204487), wk = 0.0021097 k( 335) = ( -0.2723408 0.9110320 0.5390362), wk = 0.0021097 k( 336) = ( -0.2723408 0.9110320 0.5576236), wk = 0.0021097 k( 337) = ( -0.2723408 0.9110320 0.5762111), wk = 0.0021097 k( 338) = ( -0.2723408 0.9110320 0.5947985), wk = 0.0021097 k( 339) = ( -0.2723408 0.9110320 0.6133860), wk = 0.0021097 k( 340) = ( -0.2723408 0.9110320 0.6319734), wk = 0.0021097 k( 341) = ( -0.2723408 0.9110320 0.6505609), wk = 0.0021097 k( 342) = ( -0.2723408 0.9110320 0.6691483), wk = 0.0021097 k( 343) = ( -0.2723408 0.9110320 0.6877358), wk = 0.0021097 k( 344) = ( -0.2723408 0.9110320 0.7063233), wk = 0.0021097 k( 345) = ( -0.2723408 0.9110320 0.7249107), wk = 0.0021097 k( 346) = ( -0.2723408 0.9110320 0.7434982), wk = 0.0021097 k( 347) = ( -0.2723408 0.9110320 0.7620856), wk = 0.0021097 k( 348) = ( -0.2723408 0.9110320 0.7806731), wk = 0.0021097 k( 349) = ( -0.2723408 0.9110320 0.7992605), wk = 0.0021097 k( 350) = ( -0.2723408 0.9110320 0.8178480), wk = 0.0021097 k( 351) = ( -0.2723408 0.9110320 0.8364354), wk = 0.0021097 k( 352) = ( -0.2723408 0.9110320 0.8550229), wk = 0.0021097 k( 353) = ( -0.2723408 0.9110320 0.8736103), wk = 0.0021097 k( 354) = ( -0.2723408 0.9110320 0.8736103), wk = 0.0021097 k( 355) = ( -0.2776352 0.8933212 0.8736103), wk = 0.0021097 k( 356) = ( -0.2829296 0.8756104 0.8736103), wk = 0.0021097 k( 357) = ( -0.2882240 0.8578997 0.8736103), wk = 0.0021097 k( 358) = ( -0.2935184 0.8401889 0.8736103), wk = 0.0021097 k( 359) = ( -0.2988128 0.8224781 0.8736103), wk = 0.0021097 k( 360) = ( -0.3041072 0.8047673 0.8736103), wk = 0.0021097 k( 361) = ( -0.3094016 0.7870565 0.8736103), wk = 0.0021097 k( 362) = ( -0.3146960 0.7693457 0.8736103), wk = 0.0021097 k( 363) = ( -0.3199904 0.7516350 0.8736103), wk = 0.0021097 k( 364) = ( -0.3252848 0.7339242 0.8736103), wk = 0.0021097 k( 365) = ( -0.3305792 0.7162134 0.8736103), wk = 0.0021097 k( 366) = ( -0.3358736 0.6985026 0.8736103), wk = 0.0021097 k( 367) = ( -0.3411680 0.6807918 0.8736103), wk = 0.0021097 k( 368) = ( -0.3464624 0.6630810 0.8736103), wk = 0.0021097 k( 369) = ( -0.3517568 0.6453702 0.8736103), wk = 0.0021097 k( 370) = ( -0.3570512 0.6276595 0.8736103), wk = 0.0021097 k( 371) = ( -0.3623456 0.6099487 0.8736103), wk = 0.0021097 k( 372) = ( -0.3676400 0.5922379 0.8736103), wk = 0.0021097 k( 373) = ( -0.3729344 0.5745271 0.8736103), wk = 0.0021097 k( 374) = ( -0.3782288 0.5568163 0.8736103), wk = 0.0021097 k( 375) = ( -0.3835232 0.5391055 0.8736103), wk = 0.0021097 k( 376) = ( -0.3888176 0.5213948 0.8736103), wk = 0.0021097 k( 377) = ( -0.3941120 0.5036840 0.8736103), wk = 0.0021097 k( 378) = ( -0.3994064 0.4859732 0.8736103), wk = 0.0021097 k( 379) = ( -0.4047008 0.4682624 0.8736103), wk = 0.0021097 k( 380) = ( -0.4099952 0.4505516 0.8736103), wk = 0.0021097 k( 381) = ( -0.4152896 0.4328408 0.8736103), wk = 0.0021097 k( 382) = ( -0.4205840 0.4151300 0.8736103), wk = 0.0021097 k( 383) = ( -0.4258784 0.3974193 0.8736103), wk = 0.0021097 k( 384) = ( -0.4311728 0.3797085 0.8736103), wk = 0.0021097 k( 385) = ( -0.4364672 0.3619977 0.8736103), wk = 0.0021097 k( 386) = ( -0.4417616 0.3442869 0.8736103), wk = 0.0021097 k( 387) = ( -0.4470560 0.3265761 0.8736103), wk = 0.0021097 k( 388) = ( -0.4523504 0.3088653 0.8736103), wk = 0.0021097 k( 389) = ( -0.4576448 0.2911546 0.8736103), wk = 0.0021097 k( 390) = ( -0.4629392 0.2734438 0.8736103), wk = 0.0021097 k( 391) = ( -0.4682336 0.2557330 0.8736103), wk = 0.0021097 k( 392) = ( -0.4735280 0.2380222 0.8736103), wk = 0.0021097 k( 393) = ( -0.4788224 0.2203114 0.8736103), wk = 0.0021097 k( 394) = ( -0.4841168 0.2026006 0.8736103), wk = 0.0021097 k( 395) = ( -0.4894112 0.1848898 0.8736103), wk = 0.0021097 k( 396) = ( -0.4947056 0.1671791 0.8736103), wk = 0.0021097 k( 397) = ( -0.5000000 0.1494683 0.8736103), wk = 0.0021097 k( 398) = ( -0.5000000 0.1494683 0.8736103), wk = 0.0021097 k( 399) = ( -0.5000000 0.1494683 0.8550229), wk = 0.0021097 k( 400) = ( -0.5000000 0.1494683 0.8364354), wk = 0.0021097 k( 401) = ( -0.5000000 0.1494683 0.8178480), wk = 0.0021097 k( 402) = ( -0.5000000 0.1494683 0.7992605), wk = 0.0021097 k( 403) = ( -0.5000000 0.1494683 0.7806731), wk = 0.0021097 k( 404) = ( -0.5000000 0.1494683 0.7620856), wk = 0.0021097 k( 405) = ( -0.5000000 0.1494683 0.7434982), wk = 0.0021097 k( 406) = ( -0.5000000 0.1494683 0.7249107), wk = 0.0021097 k( 407) = ( -0.5000000 0.1494683 0.7063233), wk = 0.0021097 k( 408) = ( -0.5000000 0.1494683 0.6877358), wk = 0.0021097 k( 409) = ( -0.5000000 0.1494683 0.6691483), wk = 0.0021097 k( 410) = ( -0.5000000 0.1494683 0.6505609), wk = 0.0021097 k( 411) = ( -0.5000000 0.1494683 0.6319734), wk = 0.0021097 k( 412) = ( -0.5000000 0.1494683 0.6133860), wk = 0.0021097 k( 413) = ( -0.5000000 0.1494683 0.5947985), wk = 0.0021097 k( 414) = ( -0.5000000 0.1494683 0.5762111), wk = 0.0021097 k( 415) = ( -0.5000000 0.1494683 0.5576236), wk = 0.0021097 k( 416) = ( -0.5000000 0.1494683 0.5390362), wk = 0.0021097 k( 417) = ( -0.5000000 0.1494683 0.5204487), wk = 0.0021097 k( 418) = ( -0.5000000 0.1494683 0.5018613), wk = 0.0021097 k( 419) = ( -0.5000000 0.1494683 0.4832738), wk = 0.0021097 k( 420) = ( -0.5000000 0.1494683 0.4646864), wk = 0.0021097 k( 421) = ( -0.5000000 0.1494683 0.4460989), wk = 0.0021097 k( 422) = ( -0.5000000 0.1494683 0.4275114), wk = 0.0021097 k( 423) = ( -0.5000000 0.1494683 0.4089240), wk = 0.0021097 k( 424) = ( -0.5000000 0.1494683 0.3903365), wk = 0.0021097 k( 425) = ( -0.5000000 0.1494683 0.3717491), wk = 0.0021097 k( 426) = ( -0.5000000 0.1494683 0.3531616), wk = 0.0021097 k( 427) = ( -0.5000000 0.1494683 0.3345742), wk = 0.0021097 k( 428) = ( -0.5000000 0.1494683 0.3159867), wk = 0.0021097 k( 429) = ( -0.5000000 0.1494683 0.2973993), wk = 0.0021097 k( 430) = ( -0.5000000 0.1494683 0.2788118), wk = 0.0021097 k( 431) = ( -0.5000000 0.1494683 0.2602244), wk = 0.0021097 k( 432) = ( -0.5000000 0.1494683 0.2416369), wk = 0.0021097 k( 433) = ( -0.5000000 0.1494683 0.2230494), wk = 0.0021097 k( 434) = ( -0.5000000 0.1494683 0.2044620), wk = 0.0021097 k( 435) = ( -0.5000000 0.1494683 0.1858745), wk = 0.0021097 k( 436) = ( -0.5000000 0.1494683 0.1672871), wk = 0.0021097 k( 437) = ( -0.5000000 0.1494683 0.1486996), wk = 0.0021097 k( 438) = ( -0.5000000 0.1494683 0.1301122), wk = 0.0021097 k( 439) = ( -0.5000000 0.1494683 0.1115247), wk = 0.0021097 k( 440) = ( -0.5000000 0.1494683 0.0929373), wk = 0.0021097 k( 441) = ( -0.5000000 0.1494683 0.0743498), wk = 0.0021097 k( 442) = ( -0.5000000 0.1494683 0.0557624), wk = 0.0021097 k( 443) = ( -0.5000000 0.1494683 0.0371749), wk = 0.0021097 k( 444) = ( -0.5000000 0.1494683 0.0185875), wk = 0.0021097 k( 445) = ( -0.5000000 0.1494683 -0.0000000), wk = 0.0021097 k( 446) = ( 0.0000000 0.0000000 0.8736103), wk = 0.0021097 k( 447) = ( -0.0178571 0.0053382 0.8736103), wk = 0.0021097 k( 448) = ( -0.0357143 0.0106763 0.8736103), wk = 0.0021097 k( 449) = ( -0.0535714 0.0160145 0.8736103), wk = 0.0021097 k( 450) = ( -0.0714286 0.0213526 0.8736103), wk = 0.0021097 k( 451) = ( -0.0892857 0.0266908 0.8736103), wk = 0.0021097 k( 452) = ( -0.1071429 0.0320289 0.8736103), wk = 0.0021097 k( 453) = ( -0.1250000 0.0373671 0.8736103), wk = 0.0021097 k( 454) = ( -0.1428571 0.0427052 0.8736103), wk = 0.0021097 k( 455) = ( -0.1607143 0.0480434 0.8736103), wk = 0.0021097 k( 456) = ( -0.1785714 0.0533815 0.8736103), wk = 0.0021097 k( 457) = ( -0.1964286 0.0587197 0.8736103), wk = 0.0021097 k( 458) = ( -0.2142857 0.0640578 0.8736103), wk = 0.0021097 k( 459) = ( -0.2321429 0.0693960 0.8736103), wk = 0.0021097 k( 460) = ( -0.2500000 0.0747341 0.8736103), wk = 0.0021097 k( 461) = ( -0.2678571 0.0800723 0.8736103), wk = 0.0021097 k( 462) = ( -0.2857143 0.0854104 0.8736103), wk = 0.0021097 k( 463) = ( -0.3035714 0.0907486 0.8736103), wk = 0.0021097 k( 464) = ( -0.3214286 0.0960867 0.8736103), wk = 0.0021097 k( 465) = ( -0.3392857 0.1014249 0.8736103), wk = 0.0021097 k( 466) = ( -0.3571429 0.1067631 0.8736103), wk = 0.0021097 k( 467) = ( -0.3750000 0.1121012 0.8736103), wk = 0.0021097 k( 468) = ( -0.3928571 0.1174394 0.8736103), wk = 0.0021097 k( 469) = ( -0.4107143 0.1227775 0.8736103), wk = 0.0021097 k( 470) = ( -0.4285714 0.1281157 0.8736103), wk = 0.0021097 k( 471) = ( -0.4464286 0.1334538 0.8736103), wk = 0.0021097 k( 472) = ( -0.4642857 0.1387920 0.8736103), wk = 0.0021097 k( 473) = ( -0.4821429 0.1441301 0.8736103), wk = 0.0021097 k( 474) = ( -0.5000000 0.1494683 0.8736103), wk = 0.0021097 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 2) = ( 0.0053400 0.0053400 0.0000000), wk = 0.0021097 k( 3) = ( 0.0106800 0.0106800 0.0000000), wk = 0.0021097 k( 4) = ( 0.0160200 0.0160200 0.0000000), wk = 0.0021097 k( 5) = ( 0.0213601 0.0213601 0.0000000), wk = 0.0021097 k( 6) = ( 0.0267001 0.0267001 0.0000000), wk = 0.0021097 k( 7) = ( 0.0320401 0.0320401 0.0000000), wk = 0.0021097 k( 8) = ( 0.0373801 0.0373801 0.0000000), wk = 0.0021097 k( 9) = ( 0.0427201 0.0427201 0.0000000), wk = 0.0021097 k( 10) = ( 0.0480601 0.0480601 0.0000000), wk = 0.0021097 k( 11) = ( 0.0534002 0.0534002 0.0000000), wk = 0.0021097 k( 12) = ( 0.0587402 0.0587402 0.0000000), wk = 0.0021097 k( 13) = ( 0.0640802 0.0640802 0.0000000), wk = 0.0021097 k( 14) = ( 0.0694202 0.0694202 0.0000000), wk = 0.0021097 k( 15) = ( 0.0747602 0.0747602 0.0000000), wk = 0.0021097 k( 16) = ( 0.0801002 0.0801002 -0.0000000), wk = 0.0021097 k( 17) = ( 0.0854402 0.0854402 0.0000000), wk = 0.0021097 k( 18) = ( 0.0907803 0.0907803 -0.0000000), wk = 0.0021097 k( 19) = ( 0.0961203 0.0961203 0.0000000), wk = 0.0021097 k( 20) = ( 0.1014603 0.1014603 0.0000000), wk = 0.0021097 k( 21) = ( 0.1068003 0.1068003 0.0000000), wk = 0.0021097 k( 22) = ( 0.1121403 0.1121403 -0.0000000), wk = 0.0021097 k( 23) = ( 0.1174803 0.1174803 0.0000000), wk = 0.0021097 k( 24) = ( 0.1228203 0.1228203 0.0000000), wk = 0.0021097 k( 25) = ( 0.1281604 0.1281604 0.0000000), wk = 0.0021097 k( 26) = ( 0.1335004 0.1335004 0.0000000), wk = 0.0021097 k( 27) = ( 0.1388404 0.1388404 0.0000000), wk = 0.0021097 k( 28) = ( 0.1441804 0.1441804 0.0000000), wk = 0.0021097 k( 29) = ( 0.1495204 0.1495204 0.0000000), wk = 0.0021097 k( 30) = ( 0.1548604 0.1548604 0.0000000), wk = 0.0021097 k( 31) = ( 0.1602004 0.1602005 -0.0000000), wk = 0.0021097 k( 32) = ( 0.1655405 0.1655405 0.0000000), wk = 0.0021097 k( 33) = ( 0.1708805 0.1708805 0.0000000), wk = 0.0021097 k( 34) = ( 0.1762205 0.1762205 0.0000000), wk = 0.0021097 k( 35) = ( 0.1815605 0.1815605 0.0000000), wk = 0.0021097 k( 36) = ( 0.1869005 0.1869005 0.0000000), wk = 0.0021097 k( 37) = ( 0.1922405 0.1922405 0.0000000), wk = 0.0021097 k( 38) = ( 0.1975805 0.1975805 0.0000000), wk = 0.0021097 k( 39) = ( 0.2029206 0.2029206 0.0000000), wk = 0.0021097 k( 40) = ( 0.2082606 0.2082606 0.0000000), wk = 0.0021097 k( 41) = ( 0.2136006 0.2136006 0.0000000), wk = 0.0021097 k( 42) = ( 0.2189406 0.2189406 0.0000000), wk = 0.0021097 k( 43) = ( 0.2242806 0.2242806 0.0000000), wk = 0.0021097 k( 44) = ( 0.2296206 0.2296206 0.0000000), wk = 0.0021097 k( 45) = ( 0.2349607 0.2349607 0.0000000), wk = 0.0021097 k( 46) = ( 0.2403007 0.2403007 0.0000000), wk = 0.0021097 k( 47) = ( 0.2456407 0.2456407 0.0000000), wk = 0.0021097 k( 48) = ( 0.2509807 0.2509807 0.0000000), wk = 0.0021097 k( 49) = ( 0.2563207 0.2563207 0.0000000), wk = 0.0021097 k( 50) = ( 0.2616607 0.2616607 0.0000000), wk = 0.0021097 k( 51) = ( 0.2670008 0.2670008 0.0000000), wk = 0.0021097 k( 52) = ( 0.2723408 0.2723408 0.0000000), wk = 0.0021097 k( 53) = ( 0.2723408 0.2723408 0.0000000), wk = 0.0021097 k( 54) = ( 0.2541847 0.2875181 -0.0000000), wk = 0.0021097 k( 55) = ( 0.2360287 0.3026953 0.0000000), wk = 0.0021097 k( 56) = ( 0.2178726 0.3178726 0.0000000), wk = 0.0021097 k( 57) = ( 0.1997166 0.3330499 0.0000000), wk = 0.0021097 k( 58) = ( 0.1815605 0.3482272 0.0000000), wk = 0.0021097 k( 59) = ( 0.1634045 0.3634045 0.0000000), wk = 0.0021097 k( 60) = ( 0.1452484 0.3785817 0.0000000), wk = 0.0021097 k( 61) = ( 0.1270924 0.3937590 0.0000000), wk = 0.0021097 k( 62) = ( 0.1089363 0.4089363 0.0000000), wk = 0.0021097 k( 63) = ( 0.0907803 0.4241136 0.0000000), wk = 0.0021097 k( 64) = ( 0.0726242 0.4392909 0.0000000), wk = 0.0021097 k( 65) = ( 0.0544681 0.4544682 -0.0000000), wk = 0.0021097 k( 66) = ( 0.0363121 0.4696454 0.0000000), wk = 0.0021097 k( 67) = ( 0.0181560 0.4848227 0.0000000), wk = 0.0021097 k( 68) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021097 k( 69) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021097 k( 70) = ( 0.0000000 0.5000000 0.0106383), wk = 0.0021097 k( 71) = ( 0.0000000 0.5000000 0.0212766), wk = 0.0021097 k( 72) = ( 0.0000000 0.5000000 0.0319149), wk = 0.0021097 k( 73) = ( 0.0000000 0.5000000 0.0425532), wk = 0.0021097 k( 74) = ( 0.0000000 0.5000000 0.0531915), wk = 0.0021097 k( 75) = ( 0.0000000 0.5000000 0.0638298), wk = 0.0021097 k( 76) = ( 0.0000000 0.5000000 0.0744681), wk = 0.0021097 k( 77) = ( 0.0000000 0.5000000 0.0851064), wk = 0.0021097 k( 78) = ( 0.0000000 0.5000000 0.0957447), wk = 0.0021097 k( 79) = ( 0.0000000 0.5000000 0.1063830), wk = 0.0021097 k( 80) = ( 0.0000000 0.5000000 0.1170213), wk = 0.0021097 k( 81) = ( 0.0000000 0.5000000 0.1276596), wk = 0.0021097 k( 82) = ( 0.0000000 0.5000000 0.1382979), wk = 0.0021097 k( 83) = ( 0.0000000 0.5000000 0.1489362), wk = 0.0021097 k( 84) = ( 0.0000000 0.5000000 0.1595745), wk = 0.0021097 k( 85) = ( 0.0000000 0.5000000 0.1702128), wk = 0.0021097 k( 86) = ( 0.0000000 0.5000000 0.1808511), wk = 0.0021097 k( 87) = ( 0.0000000 0.5000000 0.1914894), wk = 0.0021097 k( 88) = ( 0.0000000 0.5000000 0.2021277), wk = 0.0021097 k( 89) = ( 0.0000000 0.5000000 0.2127660), wk = 0.0021097 k( 90) = ( 0.0000000 0.5000000 0.2234043), wk = 0.0021097 k( 91) = ( 0.0000000 0.5000000 0.2340425), wk = 0.0021097 k( 92) = ( 0.0000000 0.5000000 0.2446808), wk = 0.0021097 k( 93) = ( 0.0000000 0.5000000 0.2553191), wk = 0.0021097 k( 94) = ( 0.0000000 0.5000000 0.2659574), wk = 0.0021097 k( 95) = ( 0.0000000 0.5000000 0.2765957), wk = 0.0021097 k( 96) = ( 0.0000000 0.5000000 0.2872340), wk = 0.0021097 k( 97) = ( 0.0000000 0.5000000 0.2978723), wk = 0.0021097 k( 98) = ( 0.0000000 0.5000000 0.3085106), wk = 0.0021097 k( 99) = ( 0.0000000 0.5000000 0.3191489), wk = 0.0021097 k( 100) = ( 0.0000000 0.5000000 0.3297872), wk = 0.0021097 k( 101) = ( 0.0000000 0.5000000 0.3404255), wk = 0.0021097 k( 102) = ( 0.0000000 0.5000000 0.3510638), wk = 0.0021097 k( 103) = ( 0.0000000 0.5000000 0.3617021), wk = 0.0021097 k( 104) = ( 0.0000000 0.5000000 0.3723404), wk = 0.0021097 k( 105) = ( 0.0000000 0.5000000 0.3829787), wk = 0.0021097 k( 106) = ( 0.0000000 0.5000000 0.3936170), wk = 0.0021097 k( 107) = ( 0.0000000 0.5000000 0.4042553), wk = 0.0021097 k( 108) = ( 0.0000000 0.5000000 0.4148936), wk = 0.0021097 k( 109) = ( 0.0000000 0.5000000 0.4255319), wk = 0.0021097 k( 110) = ( 0.0000000 0.5000000 0.4361702), wk = 0.0021097 k( 111) = ( 0.0000000 0.5000000 0.4468085), wk = 0.0021097 k( 112) = ( 0.0000000 0.5000000 0.4574468), wk = 0.0021097 k( 113) = ( 0.0000000 0.5000000 0.4680851), wk = 0.0021097 k( 114) = ( 0.0000000 0.5000000 0.4787234), wk = 0.0021097 k( 115) = ( 0.0000000 0.5000000 0.4893617), wk = 0.0021097 k( 116) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021097 k( 117) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021097 k( 118) = ( 0.0181560 0.4848227 0.5000000), wk = 0.0021097 k( 119) = ( 0.0363121 0.4696454 0.5000000), wk = 0.0021097 k( 120) = ( 0.0544681 0.4544682 0.5000000), wk = 0.0021097 k( 121) = ( 0.0726242 0.4392909 0.5000000), wk = 0.0021097 k( 122) = ( 0.0907803 0.4241136 0.5000000), wk = 0.0021097 k( 123) = ( 0.1089363 0.4089363 0.5000000), wk = 0.0021097 k( 124) = ( 0.1270924 0.3937590 0.5000000), wk = 0.0021097 k( 125) = ( 0.1452484 0.3785817 0.5000000), wk = 0.0021097 k( 126) = ( 0.1634045 0.3634045 0.5000000), wk = 0.0021097 k( 127) = ( 0.1815605 0.3482272 0.5000000), wk = 0.0021097 k( 128) = ( 0.1997166 0.3330499 0.5000000), wk = 0.0021097 k( 129) = ( 0.2178726 0.3178726 0.5000000), wk = 0.0021097 k( 130) = ( 0.2360287 0.3026953 0.5000000), wk = 0.0021097 k( 131) = ( 0.2541847 0.2875181 0.5000000), wk = 0.0021097 k( 132) = ( 0.2723408 0.2723408 0.5000000), wk = 0.0021097 k( 133) = ( 0.2723408 0.2723408 0.5000000), wk = 0.0021097 k( 134) = ( 0.2670008 0.2670008 0.5000000), wk = 0.0021097 k( 135) = ( 0.2616607 0.2616607 0.5000000), wk = 0.0021097 k( 136) = ( 0.2563207 0.2563207 0.5000000), wk = 0.0021097 k( 137) = ( 0.2509807 0.2509807 0.5000000), wk = 0.0021097 k( 138) = ( 0.2456407 0.2456407 0.5000000), wk = 0.0021097 k( 139) = ( 0.2403007 0.2403007 0.5000000), wk = 0.0021097 k( 140) = ( 0.2349607 0.2349607 0.5000000), wk = 0.0021097 k( 141) = ( 0.2296206 0.2296206 0.5000000), wk = 0.0021097 k( 142) = ( 0.2242806 0.2242806 0.5000000), wk = 0.0021097 k( 143) = ( 0.2189406 0.2189406 0.5000000), wk = 0.0021097 k( 144) = ( 0.2136006 0.2136006 0.5000000), wk = 0.0021097 k( 145) = ( 0.2082606 0.2082606 0.5000000), wk = 0.0021097 k( 146) = ( 0.2029206 0.2029206 0.5000000), wk = 0.0021097 k( 147) = ( 0.1975805 0.1975805 0.5000000), wk = 0.0021097 k( 148) = ( 0.1922405 0.1922405 0.5000000), wk = 0.0021097 k( 149) = ( 0.1869005 0.1869005 0.5000000), wk = 0.0021097 k( 150) = ( 0.1815605 0.1815605 0.5000000), wk = 0.0021097 k( 151) = ( 0.1762205 0.1762205 0.5000000), wk = 0.0021097 k( 152) = ( 0.1708805 0.1708805 0.5000000), wk = 0.0021097 k( 153) = ( 0.1655405 0.1655405 0.5000000), wk = 0.0021097 k( 154) = ( 0.1602004 0.1602005 0.5000000), wk = 0.0021097 k( 155) = ( 0.1548604 0.1548604 0.5000000), wk = 0.0021097 k( 156) = ( 0.1495204 0.1495204 0.5000000), wk = 0.0021097 k( 157) = ( 0.1441804 0.1441804 0.5000000), wk = 0.0021097 k( 158) = ( 0.1388404 0.1388404 0.5000000), wk = 0.0021097 k( 159) = ( 0.1335004 0.1335004 0.5000000), wk = 0.0021097 k( 160) = ( 0.1281604 0.1281604 0.5000000), wk = 0.0021097 k( 161) = ( 0.1228203 0.1228203 0.5000000), wk = 0.0021097 k( 162) = ( 0.1174803 0.1174803 0.5000000), wk = 0.0021097 k( 163) = ( 0.1121403 0.1121403 0.5000000), wk = 0.0021097 k( 164) = ( 0.1068003 0.1068003 0.5000000), wk = 0.0021097 k( 165) = ( 0.1014603 0.1014603 0.5000000), wk = 0.0021097 k( 166) = ( 0.0961203 0.0961203 0.5000000), wk = 0.0021097 k( 167) = ( 0.0907803 0.0907803 0.5000000), wk = 0.0021097 k( 168) = ( 0.0854402 0.0854402 0.5000000), wk = 0.0021097 k( 169) = ( 0.0801002 0.0801002 0.5000000), wk = 0.0021097 k( 170) = ( 0.0747602 0.0747602 0.5000000), wk = 0.0021097 k( 171) = ( 0.0694202 0.0694202 0.5000000), wk = 0.0021097 k( 172) = ( 0.0640802 0.0640802 0.5000000), wk = 0.0021097 k( 173) = ( 0.0587402 0.0587402 0.5000000), wk = 0.0021097 k( 174) = ( 0.0534002 0.0534002 0.5000000), wk = 0.0021097 k( 175) = ( 0.0480601 0.0480601 0.5000000), wk = 0.0021097 k( 176) = ( 0.0427201 0.0427201 0.5000000), wk = 0.0021097 k( 177) = ( 0.0373801 0.0373801 0.5000000), wk = 0.0021097 k( 178) = ( 0.0320401 0.0320401 0.5000000), wk = 0.0021097 k( 179) = ( 0.0267001 0.0267001 0.5000000), wk = 0.0021097 k( 180) = ( 0.0213601 0.0213601 0.5000000), wk = 0.0021097 k( 181) = ( 0.0160200 0.0160200 0.5000000), wk = 0.0021097 k( 182) = ( 0.0106800 0.0106800 0.5000000), wk = 0.0021097 k( 183) = ( 0.0053400 0.0053400 0.5000000), wk = 0.0021097 k( 184) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021097 k( 185) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021097 k( 186) = ( 0.0000000 0.0000000 0.4893617), wk = 0.0021097 k( 187) = ( 0.0000000 0.0000000 0.4787234), wk = 0.0021097 k( 188) = ( 0.0000000 0.0000000 0.4680851), wk = 0.0021097 k( 189) = ( 0.0000000 0.0000000 0.4574468), wk = 0.0021097 k( 190) = ( 0.0000000 0.0000000 0.4468085), wk = 0.0021097 k( 191) = ( 0.0000000 0.0000000 0.4361702), wk = 0.0021097 k( 192) = ( 0.0000000 0.0000000 0.4255319), wk = 0.0021097 k( 193) = ( 0.0000000 0.0000000 0.4148936), wk = 0.0021097 k( 194) = ( 0.0000000 0.0000000 0.4042553), wk = 0.0021097 k( 195) = ( 0.0000000 0.0000000 0.3936170), wk = 0.0021097 k( 196) = ( 0.0000000 0.0000000 0.3829787), wk = 0.0021097 k( 197) = ( 0.0000000 0.0000000 0.3723404), wk = 0.0021097 k( 198) = ( 0.0000000 0.0000000 0.3617021), wk = 0.0021097 k( 199) = ( 0.0000000 0.0000000 0.3510638), wk = 0.0021097 k( 200) = ( 0.0000000 0.0000000 0.3404255), wk = 0.0021097 k( 201) = ( 0.0000000 0.0000000 0.3297872), wk = 0.0021097 k( 202) = ( 0.0000000 0.0000000 0.3191489), wk = 0.0021097 k( 203) = ( 0.0000000 0.0000000 0.3085106), wk = 0.0021097 k( 204) = ( 0.0000000 0.0000000 0.2978723), wk = 0.0021097 k( 205) = ( 0.0000000 0.0000000 0.2872340), wk = 0.0021097 k( 206) = ( 0.0000000 0.0000000 0.2765957), wk = 0.0021097 k( 207) = ( 0.0000000 0.0000000 0.2659574), wk = 0.0021097 k( 208) = ( 0.0000000 0.0000000 0.2553191), wk = 0.0021097 k( 209) = ( 0.0000000 0.0000000 0.2446809), wk = 0.0021097 k( 210) = ( 0.0000000 0.0000000 0.2340425), wk = 0.0021097 k( 211) = ( 0.0000000 0.0000000 0.2234043), wk = 0.0021097 k( 212) = ( 0.0000000 0.0000000 0.2127660), wk = 0.0021097 k( 213) = ( 0.0000000 0.0000000 0.2021277), wk = 0.0021097 k( 214) = ( 0.0000000 0.0000000 0.1914894), wk = 0.0021097 k( 215) = ( 0.0000000 0.0000000 0.1808511), wk = 0.0021097 k( 216) = ( 0.0000000 0.0000000 0.1702128), wk = 0.0021097 k( 217) = ( 0.0000000 0.0000000 0.1595745), wk = 0.0021097 k( 218) = ( 0.0000000 0.0000000 0.1489362), wk = 0.0021097 k( 219) = ( 0.0000000 0.0000000 0.1382979), wk = 0.0021097 k( 220) = ( 0.0000000 0.0000000 0.1276596), wk = 0.0021097 k( 221) = ( 0.0000000 0.0000000 0.1170213), wk = 0.0021097 k( 222) = ( 0.0000000 0.0000000 0.1063830), wk = 0.0021097 k( 223) = ( 0.0000000 0.0000000 0.0957447), wk = 0.0021097 k( 224) = ( 0.0000000 0.0000000 0.0851064), wk = 0.0021097 k( 225) = ( 0.0000000 0.0000000 0.0744681), wk = 0.0021097 k( 226) = ( 0.0000000 0.0000000 0.0638298), wk = 0.0021097 k( 227) = ( 0.0000000 0.0000000 0.0531915), wk = 0.0021097 k( 228) = ( 0.0000000 0.0000000 0.0425532), wk = 0.0021097 k( 229) = ( 0.0000000 0.0000000 0.0319149), wk = 0.0021097 k( 230) = ( 0.0000000 0.0000000 0.0212766), wk = 0.0021097 k( 231) = ( 0.0000000 0.0000000 0.0106383), wk = 0.0021097 k( 232) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 233) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021097 k( 234) = ( -0.0178571 0.0178571 -0.0000000), wk = 0.0021097 k( 235) = ( -0.0357143 0.0357143 0.0000000), wk = 0.0021097 k( 236) = ( -0.0535714 0.0535714 -0.0000000), wk = 0.0021097 k( 237) = ( -0.0714286 0.0714286 -0.0000000), wk = 0.0021097 k( 238) = ( -0.0892857 0.0892857 -0.0000000), wk = 0.0021097 k( 239) = ( -0.1071429 0.1071429 -0.0000000), wk = 0.0021097 k( 240) = ( -0.1250000 0.1250000 -0.0000000), wk = 0.0021097 k( 241) = ( -0.1428571 0.1428571 -0.0000000), wk = 0.0021097 k( 242) = ( -0.1607143 0.1607143 -0.0000000), wk = 0.0021097 k( 243) = ( -0.1785714 0.1785714 0.0000000), wk = 0.0021097 k( 244) = ( -0.1964286 0.1964286 0.0000000), wk = 0.0021097 k( 245) = ( -0.2142857 0.2142857 -0.0000000), wk = 0.0021097 k( 246) = ( -0.2321429 0.2321429 -0.0000000), wk = 0.0021097 k( 247) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0021097 k( 248) = ( -0.2678571 0.2678571 0.0000000), wk = 0.0021097 k( 249) = ( -0.2857143 0.2857143 -0.0000000), wk = 0.0021097 k( 250) = ( -0.3035714 0.3035714 -0.0000000), wk = 0.0021097 k( 251) = ( -0.3214286 0.3214286 -0.0000000), wk = 0.0021097 k( 252) = ( -0.3392857 0.3392857 -0.0000000), wk = 0.0021097 k( 253) = ( -0.3571429 0.3571429 0.0000000), wk = 0.0021097 k( 254) = ( -0.3750000 0.3750000 -0.0000000), wk = 0.0021097 k( 255) = ( -0.3928571 0.3928571 0.0000000), wk = 0.0021097 k( 256) = ( -0.4107143 0.4107143 -0.0000000), wk = 0.0021097 k( 257) = ( -0.4285714 0.4285714 -0.0000000), wk = 0.0021097 k( 258) = ( -0.4464286 0.4464286 0.0000000), wk = 0.0021097 k( 259) = ( -0.4642857 0.4642857 -0.0000000), wk = 0.0021097 k( 260) = ( -0.4821429 0.4821429 -0.0000000), wk = 0.0021097 k( 261) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021097 k( 262) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021097 k( 263) = ( -0.4947056 0.5052944 -0.0000000), wk = 0.0021097 k( 264) = ( -0.4894112 0.5105888 0.0000000), wk = 0.0021097 k( 265) = ( -0.4841168 0.5158832 0.0000000), wk = 0.0021097 k( 266) = ( -0.4788224 0.5211776 0.0000000), wk = 0.0021097 k( 267) = ( -0.4735280 0.5264720 -0.0000000), wk = 0.0021097 k( 268) = ( -0.4682336 0.5317664 -0.0000000), wk = 0.0021097 k( 269) = ( -0.4629392 0.5370608 -0.0000000), wk = 0.0021097 k( 270) = ( -0.4576448 0.5423552 0.0000000), wk = 0.0021097 k( 271) = ( -0.4523504 0.5476496 -0.0000000), wk = 0.0021097 k( 272) = ( -0.4470560 0.5529440 0.0000000), wk = 0.0021097 k( 273) = ( -0.4417616 0.5582384 -0.0000000), wk = 0.0021097 k( 274) = ( -0.4364672 0.5635328 0.0000000), wk = 0.0021097 k( 275) = ( -0.4311728 0.5688272 -0.0000000), wk = 0.0021097 k( 276) = ( -0.4258784 0.5741216 -0.0000000), wk = 0.0021097 k( 277) = ( -0.4205840 0.5794160 0.0000000), wk = 0.0021097 k( 278) = ( -0.4152896 0.5847104 -0.0000000), wk = 0.0021097 k( 279) = ( -0.4099952 0.5900048 -0.0000000), wk = 0.0021097 k( 280) = ( -0.4047008 0.5952992 0.0000000), wk = 0.0021097 k( 281) = ( -0.3994064 0.6005936 0.0000000), wk = 0.0021097 k( 282) = ( -0.3941120 0.6058880 0.0000000), wk = 0.0021097 k( 283) = ( -0.3888176 0.6111824 -0.0000000), wk = 0.0021097 k( 284) = ( -0.3835232 0.6164768 0.0000000), wk = 0.0021097 k( 285) = ( -0.3782288 0.6217712 0.0000000), wk = 0.0021097 k( 286) = ( -0.3729344 0.6270656 0.0000000), wk = 0.0021097 k( 287) = ( -0.3676400 0.6323600 0.0000000), wk = 0.0021097 k( 288) = ( -0.3623456 0.6376544 -0.0000000), wk = 0.0021097 k( 289) = ( -0.3570512 0.6429488 -0.0000000), wk = 0.0021097 k( 290) = ( -0.3517568 0.6482432 0.0000000), wk = 0.0021097 k( 291) = ( -0.3464624 0.6535376 -0.0000000), wk = 0.0021097 k( 292) = ( -0.3411680 0.6588320 0.0000000), wk = 0.0021097 k( 293) = ( -0.3358736 0.6641264 -0.0000000), wk = 0.0021097 k( 294) = ( -0.3305792 0.6694208 -0.0000000), wk = 0.0021097 k( 295) = ( -0.3252848 0.6747152 0.0000000), wk = 0.0021097 k( 296) = ( -0.3199904 0.6800096 -0.0000000), wk = 0.0021097 k( 297) = ( -0.3146960 0.6853040 0.0000000), wk = 0.0021097 k( 298) = ( -0.3094016 0.6905984 0.0000000), wk = 0.0021097 k( 299) = ( -0.3041072 0.6958928 -0.0000000), wk = 0.0021097 k( 300) = ( -0.2988128 0.7011872 0.0000000), wk = 0.0021097 k( 301) = ( -0.2935184 0.7064816 -0.0000000), wk = 0.0021097 k( 302) = ( -0.2882240 0.7117760 0.0000000), wk = 0.0021097 k( 303) = ( -0.2829296 0.7170704 0.0000000), wk = 0.0021097 k( 304) = ( -0.2776352 0.7223648 0.0000000), wk = 0.0021097 k( 305) = ( -0.2723408 0.7276592 0.0000000), wk = 0.0021097 k( 306) = ( -0.2723408 0.7276592 0.0000000), wk = 0.0021097 k( 307) = ( -0.2723408 0.7276592 0.0106383), wk = 0.0021097 k( 308) = ( -0.2723408 0.7276592 0.0212766), wk = 0.0021097 k( 309) = ( -0.2723408 0.7276592 0.0319149), wk = 0.0021097 k( 310) = ( -0.2723408 0.7276592 0.0425532), wk = 0.0021097 k( 311) = ( -0.2723408 0.7276592 0.0531915), wk = 0.0021097 k( 312) = ( -0.2723408 0.7276592 0.0638298), wk = 0.0021097 k( 313) = ( -0.2723408 0.7276592 0.0744681), wk = 0.0021097 k( 314) = ( -0.2723408 0.7276592 0.0851064), wk = 0.0021097 k( 315) = ( -0.2723408 0.7276592 0.0957447), wk = 0.0021097 k( 316) = ( -0.2723408 0.7276592 0.1063830), wk = 0.0021097 k( 317) = ( -0.2723408 0.7276592 0.1170213), wk = 0.0021097 k( 318) = ( -0.2723408 0.7276592 0.1276596), wk = 0.0021097 k( 319) = ( -0.2723408 0.7276592 0.1382979), wk = 0.0021097 k( 320) = ( -0.2723408 0.7276592 0.1489362), wk = 0.0021097 k( 321) = ( -0.2723408 0.7276592 0.1595745), wk = 0.0021097 k( 322) = ( -0.2723408 0.7276592 0.1702128), wk = 0.0021097 k( 323) = ( -0.2723408 0.7276592 0.1808511), wk = 0.0021097 k( 324) = ( -0.2723408 0.7276592 0.1914894), wk = 0.0021097 k( 325) = ( -0.2723408 0.7276592 0.2021277), wk = 0.0021097 k( 326) = ( -0.2723408 0.7276592 0.2127660), wk = 0.0021097 k( 327) = ( -0.2723408 0.7276592 0.2234043), wk = 0.0021097 k( 328) = ( -0.2723408 0.7276592 0.2340425), wk = 0.0021097 k( 329) = ( -0.2723408 0.7276592 0.2446809), wk = 0.0021097 k( 330) = ( -0.2723408 0.7276592 0.2553191), wk = 0.0021097 k( 331) = ( -0.2723408 0.7276592 0.2659574), wk = 0.0021097 k( 332) = ( -0.2723408 0.7276592 0.2765957), wk = 0.0021097 k( 333) = ( -0.2723408 0.7276592 0.2872340), wk = 0.0021097 k( 334) = ( -0.2723408 0.7276592 0.2978723), wk = 0.0021097 k( 335) = ( -0.2723408 0.7276592 0.3085106), wk = 0.0021097 k( 336) = ( -0.2723408 0.7276592 0.3191489), wk = 0.0021097 k( 337) = ( -0.2723408 0.7276592 0.3297872), wk = 0.0021097 k( 338) = ( -0.2723408 0.7276592 0.3404255), wk = 0.0021097 k( 339) = ( -0.2723408 0.7276592 0.3510638), wk = 0.0021097 k( 340) = ( -0.2723408 0.7276592 0.3617021), wk = 0.0021097 k( 341) = ( -0.2723408 0.7276592 0.3723404), wk = 0.0021097 k( 342) = ( -0.2723408 0.7276592 0.3829787), wk = 0.0021097 k( 343) = ( -0.2723408 0.7276592 0.3936170), wk = 0.0021097 k( 344) = ( -0.2723408 0.7276592 0.4042553), wk = 0.0021097 k( 345) = ( -0.2723408 0.7276592 0.4148936), wk = 0.0021097 k( 346) = ( -0.2723408 0.7276592 0.4255319), wk = 0.0021097 k( 347) = ( -0.2723408 0.7276592 0.4361702), wk = 0.0021097 k( 348) = ( -0.2723408 0.7276592 0.4468085), wk = 0.0021097 k( 349) = ( -0.2723408 0.7276592 0.4574468), wk = 0.0021097 k( 350) = ( -0.2723408 0.7276592 0.4680851), wk = 0.0021097 k( 351) = ( -0.2723408 0.7276592 0.4787234), wk = 0.0021097 k( 352) = ( -0.2723408 0.7276592 0.4893617), wk = 0.0021097 k( 353) = ( -0.2723408 0.7276592 0.5000000), wk = 0.0021097 k( 354) = ( -0.2723408 0.7276592 0.5000000), wk = 0.0021097 k( 355) = ( -0.2776352 0.7223648 0.5000000), wk = 0.0021097 k( 356) = ( -0.2829296 0.7170704 0.5000000), wk = 0.0021097 k( 357) = ( -0.2882240 0.7117760 0.5000000), wk = 0.0021097 k( 358) = ( -0.2935184 0.7064816 0.5000000), wk = 0.0021097 k( 359) = ( -0.2988128 0.7011872 0.5000000), wk = 0.0021097 k( 360) = ( -0.3041072 0.6958928 0.5000000), wk = 0.0021097 k( 361) = ( -0.3094016 0.6905984 0.5000000), wk = 0.0021097 k( 362) = ( -0.3146960 0.6853040 0.5000000), wk = 0.0021097 k( 363) = ( -0.3199904 0.6800096 0.5000000), wk = 0.0021097 k( 364) = ( -0.3252848 0.6747152 0.5000000), wk = 0.0021097 k( 365) = ( -0.3305792 0.6694208 0.5000000), wk = 0.0021097 k( 366) = ( -0.3358736 0.6641264 0.5000000), wk = 0.0021097 k( 367) = ( -0.3411680 0.6588320 0.5000000), wk = 0.0021097 k( 368) = ( -0.3464624 0.6535376 0.5000000), wk = 0.0021097 k( 369) = ( -0.3517568 0.6482432 0.5000000), wk = 0.0021097 k( 370) = ( -0.3570512 0.6429488 0.5000000), wk = 0.0021097 k( 371) = ( -0.3623456 0.6376544 0.5000000), wk = 0.0021097 k( 372) = ( -0.3676400 0.6323600 0.5000000), wk = 0.0021097 k( 373) = ( -0.3729344 0.6270656 0.5000000), wk = 0.0021097 k( 374) = ( -0.3782288 0.6217712 0.5000000), wk = 0.0021097 k( 375) = ( -0.3835232 0.6164768 0.5000000), wk = 0.0021097 k( 376) = ( -0.3888176 0.6111824 0.5000000), wk = 0.0021097 k( 377) = ( -0.3941120 0.6058880 0.5000000), wk = 0.0021097 k( 378) = ( -0.3994064 0.6005936 0.5000000), wk = 0.0021097 k( 379) = ( -0.4047008 0.5952992 0.5000000), wk = 0.0021097 k( 380) = ( -0.4099952 0.5900048 0.5000000), wk = 0.0021097 k( 381) = ( -0.4152896 0.5847104 0.5000000), wk = 0.0021097 k( 382) = ( -0.4205840 0.5794160 0.5000000), wk = 0.0021097 k( 383) = ( -0.4258784 0.5741216 0.5000000), wk = 0.0021097 k( 384) = ( -0.4311728 0.5688272 0.5000000), wk = 0.0021097 k( 385) = ( -0.4364672 0.5635328 0.5000000), wk = 0.0021097 k( 386) = ( -0.4417616 0.5582384 0.5000000), wk = 0.0021097 k( 387) = ( -0.4470560 0.5529440 0.5000000), wk = 0.0021097 k( 388) = ( -0.4523504 0.5476496 0.5000000), wk = 0.0021097 k( 389) = ( -0.4576448 0.5423552 0.5000000), wk = 0.0021097 k( 390) = ( -0.4629392 0.5370608 0.5000000), wk = 0.0021097 k( 391) = ( -0.4682336 0.5317664 0.5000000), wk = 0.0021097 k( 392) = ( -0.4735280 0.5264720 0.5000000), wk = 0.0021097 k( 393) = ( -0.4788224 0.5211776 0.5000000), wk = 0.0021097 k( 394) = ( -0.4841168 0.5158832 0.5000000), wk = 0.0021097 k( 395) = ( -0.4894112 0.5105888 0.5000000), wk = 0.0021097 k( 396) = ( -0.4947056 0.5052944 0.5000000), wk = 0.0021097 k( 397) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021097 k( 398) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021097 k( 399) = ( -0.5000000 0.5000000 0.4893617), wk = 0.0021097 k( 400) = ( -0.5000000 0.5000000 0.4787234), wk = 0.0021097 k( 401) = ( -0.5000000 0.5000000 0.4680851), wk = 0.0021097 k( 402) = ( -0.5000000 0.5000000 0.4574468), wk = 0.0021097 k( 403) = ( -0.5000000 0.5000000 0.4468085), wk = 0.0021097 k( 404) = ( -0.5000000 0.5000000 0.4361702), wk = 0.0021097 k( 405) = ( -0.5000000 0.5000000 0.4255319), wk = 0.0021097 k( 406) = ( -0.5000000 0.5000000 0.4148936), wk = 0.0021097 k( 407) = ( -0.5000000 0.5000000 0.4042553), wk = 0.0021097 k( 408) = ( -0.5000000 0.5000000 0.3936170), wk = 0.0021097 k( 409) = ( -0.5000000 0.5000000 0.3829787), wk = 0.0021097 k( 410) = ( -0.5000000 0.5000000 0.3723404), wk = 0.0021097 k( 411) = ( -0.5000000 0.5000000 0.3617021), wk = 0.0021097 k( 412) = ( -0.5000000 0.5000000 0.3510638), wk = 0.0021097 k( 413) = ( -0.5000000 0.5000000 0.3404255), wk = 0.0021097 k( 414) = ( -0.5000000 0.5000000 0.3297872), wk = 0.0021097 k( 415) = ( -0.5000000 0.5000000 0.3191489), wk = 0.0021097 k( 416) = ( -0.5000000 0.5000000 0.3085106), wk = 0.0021097 k( 417) = ( -0.5000000 0.5000000 0.2978723), wk = 0.0021097 k( 418) = ( -0.5000000 0.5000000 0.2872340), wk = 0.0021097 k( 419) = ( -0.5000000 0.5000000 0.2765957), wk = 0.0021097 k( 420) = ( -0.5000000 0.5000000 0.2659574), wk = 0.0021097 k( 421) = ( -0.5000000 0.5000000 0.2553191), wk = 0.0021097 k( 422) = ( -0.5000000 0.5000000 0.2446809), wk = 0.0021097 k( 423) = ( -0.5000000 0.5000000 0.2340425), wk = 0.0021097 k( 424) = ( -0.5000000 0.5000000 0.2234043), wk = 0.0021097 k( 425) = ( -0.5000000 0.5000000 0.2127660), wk = 0.0021097 k( 426) = ( -0.5000000 0.5000000 0.2021277), wk = 0.0021097 k( 427) = ( -0.5000000 0.5000000 0.1914894), wk = 0.0021097 k( 428) = ( -0.5000000 0.5000000 0.1808511), wk = 0.0021097 k( 429) = ( -0.5000000 0.5000000 0.1702128), wk = 0.0021097 k( 430) = ( -0.5000000 0.5000000 0.1595745), wk = 0.0021097 k( 431) = ( -0.5000000 0.5000000 0.1489362), wk = 0.0021097 k( 432) = ( -0.5000000 0.5000000 0.1382979), wk = 0.0021097 k( 433) = ( -0.5000000 0.5000000 0.1276596), wk = 0.0021097 k( 434) = ( -0.5000000 0.5000000 0.1170213), wk = 0.0021097 k( 435) = ( -0.5000000 0.5000000 0.1063830), wk = 0.0021097 k( 436) = ( -0.5000000 0.5000000 0.0957447), wk = 0.0021097 k( 437) = ( -0.5000000 0.5000000 0.0851064), wk = 0.0021097 k( 438) = ( -0.5000000 0.5000000 0.0744681), wk = 0.0021097 k( 439) = ( -0.5000000 0.5000000 0.0638298), wk = 0.0021097 k( 440) = ( -0.5000000 0.5000000 0.0531915), wk = 0.0021097 k( 441) = ( -0.5000000 0.5000000 0.0425532), wk = 0.0021097 k( 442) = ( -0.5000000 0.5000000 0.0319149), wk = 0.0021097 k( 443) = ( -0.5000000 0.5000000 0.0212766), wk = 0.0021097 k( 444) = ( -0.5000000 0.5000000 0.0106383), wk = 0.0021097 k( 445) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021097 k( 446) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021097 k( 447) = ( -0.0178571 0.0178571 0.5000000), wk = 0.0021097 k( 448) = ( -0.0357143 0.0357143 0.5000000), wk = 0.0021097 k( 449) = ( -0.0535714 0.0535714 0.5000000), wk = 0.0021097 k( 450) = ( -0.0714286 0.0714286 0.5000000), wk = 0.0021097 k( 451) = ( -0.0892857 0.0892857 0.5000000), wk = 0.0021097 k( 452) = ( -0.1071429 0.1071429 0.5000000), wk = 0.0021097 k( 453) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0021097 k( 454) = ( -0.1428571 0.1428571 0.5000000), wk = 0.0021097 k( 455) = ( -0.1607143 0.1607143 0.5000000), wk = 0.0021097 k( 456) = ( -0.1785714 0.1785714 0.5000000), wk = 0.0021097 k( 457) = ( -0.1964286 0.1964286 0.5000000), wk = 0.0021097 k( 458) = ( -0.2142857 0.2142857 0.5000000), wk = 0.0021097 k( 459) = ( -0.2321429 0.2321429 0.5000000), wk = 0.0021097 k( 460) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0021097 k( 461) = ( -0.2678571 0.2678571 0.5000000), wk = 0.0021097 k( 462) = ( -0.2857143 0.2857143 0.5000000), wk = 0.0021097 k( 463) = ( -0.3035714 0.3035714 0.5000000), wk = 0.0021097 k( 464) = ( -0.3214286 0.3214286 0.5000000), wk = 0.0021097 k( 465) = ( -0.3392857 0.3392857 0.5000000), wk = 0.0021097 k( 466) = ( -0.3571429 0.3571429 0.5000000), wk = 0.0021097 k( 467) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0021097 k( 468) = ( -0.3928571 0.3928571 0.5000000), wk = 0.0021097 k( 469) = ( -0.4107143 0.4107143 0.5000000), wk = 0.0021097 k( 470) = ( -0.4285714 0.4285714 0.5000000), wk = 0.0021097 k( 471) = ( -0.4464286 0.4464286 0.5000000), wk = 0.0021097 k( 472) = ( -0.4642857 0.4642857 0.5000000), wk = 0.0021097 k( 473) = ( -0.4821429 0.4821429 0.5000000), wk = 0.0021097 k( 474) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021097 Dense grid: 43679 G-vectors FFT dimensions: ( 72, 72, 40) Smooth grid: 32933 G-vectors FFT dimensions: ( 60, 60, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.15 Mb ( 240, 40) NL pseudopotentials 0.11 Mb ( 120, 60) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1214) G-vector shells 0.00 Mb ( 620) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.59 Mb ( 240, 160) Each subspace H/S matrix 0.02 Mb ( 40, 40) Each matrix 0.07 Mb ( 60, 2, 40) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./NaHO.save/charge-density.dat Starting wfc are 40 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.6 secs Computing kpt #: 2 total cpu time spent up to now is 2.0 secs Computing kpt #: 3 total cpu time spent up to now is 2.3 secs Computing kpt #: 4 total cpu time spent up to now is 2.7 secs Computing kpt #: 5 total cpu time spent up to now is 3.0 secs Computing kpt #: 6 total cpu time spent up to now is 3.3 secs Computing kpt #: 7 total cpu time spent up to now is 3.6 secs Computing kpt #: 8 total cpu time spent up to now is 3.9 secs Computing kpt #: 9 total cpu time spent up to now is 4.2 secs Computing kpt #: 10 total cpu time spent up to now is 4.6 secs Computing kpt #: 11 total cpu time spent up to now is 4.9 secs Computing kpt #: 12 total cpu time spent up to now is 5.1 secs Computing kpt #: 13 total cpu time spent up to now is 5.4 secs Computing kpt #: 14 total cpu time spent up to now is 5.7 secs Computing kpt #: 15 total cpu time spent up to now is 5.9 secs Computing kpt #: 16 total cpu time spent up to now is 6.2 secs Computing kpt #: 17 total cpu time spent up to now is 6.4 secs Computing kpt #: 18 total cpu time spent up to now is 6.7 secs Computing kpt #: 19 total cpu time spent up to now is 6.9 secs Computing kpt #: 20 total cpu time spent up to now is 7.2 secs Computing kpt #: 21 total cpu time spent up to now is 7.4 secs Computing kpt #: 22 total cpu time spent up to now is 7.7 secs Computing kpt #: 23 total cpu time spent up to now is 7.9 secs Computing kpt #: 24 total cpu time spent up to now is 8.2 secs Computing kpt #: 25 total cpu time spent up to now is 8.4 secs Computing kpt #: 26 total cpu time spent up to now is 8.7 secs Computing kpt #: 27 total cpu time spent up to now is 8.9 secs Computing kpt #: 28 total cpu time spent up to now is 9.2 secs Computing kpt #: 29 total cpu time spent up to now is 9.5 secs Computing kpt #: 30 total cpu time spent up to now is 9.7 secs Computing kpt #: 31 total cpu time spent up to now is 10.0 secs Computing kpt #: 32 total cpu time spent up to now is 10.3 secs Computing kpt #: 33 total cpu time spent up to now is 10.6 secs Computing kpt #: 34 total cpu time spent up to now is 10.8 secs Computing kpt #: 35 total cpu time spent up to now is 11.1 secs Computing kpt #: 36 total cpu time spent up to now is 11.4 secs Computing kpt #: 37 total cpu time spent up to now is 11.7 secs Computing kpt #: 38 total cpu time spent up to now is 11.9 secs Computing kpt #: 39 total cpu time spent up to now is 12.2 secs Computing kpt #: 40 total cpu time spent up to now is 12.5 secs Computing kpt #: 41 total cpu time spent up to now is 12.7 secs Computing kpt #: 42 total cpu time spent up to now is 13.0 secs Computing kpt #: 43 total cpu time spent up to now is 13.2 secs Computing kpt #: 44 total cpu time spent up to now is 13.5 secs Computing kpt #: 45 total cpu time spent up to now is 13.8 secs Computing kpt #: 46 total cpu time spent up to now is 14.0 secs Computing kpt #: 47 total cpu time spent up to now is 14.3 secs Computing kpt #: 48 total cpu time spent up to now is 14.5 secs Computing kpt #: 49 total cpu time spent up to now is 14.8 secs Computing kpt #: 50 total cpu time spent up to now is 15.1 secs Computing kpt #: 51 total cpu time spent up to now is 15.3 secs Computing kpt #: 52 total cpu time spent up to now is 15.6 secs Computing kpt #: 53 total cpu time spent up to now is 15.8 secs Computing kpt #: 54 total cpu time spent up to now is 16.1 secs Computing kpt #: 55 total cpu time spent up to now is 16.4 secs Computing kpt #: 56 total cpu time spent up to now is 16.6 secs Computing kpt #: 57 total cpu time spent up to now is 16.9 secs Computing kpt #: 58 total cpu time spent up to now is 17.2 secs Computing kpt #: 59 total cpu time spent up to now is 17.4 secs Computing kpt #: 60 total cpu time spent up to now is 17.7 secs Computing kpt #: 61 total cpu time spent up to now is 18.0 secs Computing kpt #: 62 total cpu time spent up to now is 18.2 secs Computing kpt #: 63 total cpu time spent up to now is 18.5 secs Computing kpt #: 64 total cpu time spent up to now is 18.7 secs Computing kpt #: 65 total cpu time spent up to now is 19.0 secs Computing kpt #: 66 total cpu time spent up to now is 19.3 secs Computing kpt #: 67 total cpu time spent up to now is 19.5 secs Computing kpt #: 68 total cpu time spent up to now is 19.8 secs Computing kpt #: 69 total cpu time spent up to now is 20.0 secs Computing kpt #: 70 total cpu time spent up to now is 20.3 secs Computing kpt #: 71 total cpu time spent up to now is 20.5 secs Computing kpt #: 72 total cpu time spent up to now is 20.8 secs Computing kpt #: 73 total cpu time spent up to now is 21.0 secs Computing kpt #: 74 total cpu time spent up to now is 21.3 secs Computing kpt #: 75 total cpu time spent up to now is 21.6 secs Computing kpt #: 76 total cpu time spent up to now is 21.8 secs Computing kpt #: 77 total cpu time spent up to now is 22.1 secs Computing kpt #: 78 total cpu time spent up to now is 22.3 secs Computing kpt #: 79 total cpu time spent up to now is 22.6 secs Computing kpt #: 80 total cpu time spent up to now is 22.9 secs Computing kpt #: 81 total cpu time spent up to now is 23.1 secs Computing kpt #: 82 total cpu time spent up to now is 23.4 secs Computing kpt #: 83 total cpu time spent up to now is 23.7 secs Computing kpt #: 84 total cpu time spent up to now is 23.9 secs Computing kpt #: 85 total cpu time spent up to now is 24.2 secs Computing kpt #: 86 total cpu time spent up to now is 24.5 secs Computing kpt #: 87 total cpu time spent up to now is 24.7 secs Computing kpt #: 88 total cpu time spent up to now is 25.0 secs Computing kpt #: 89 total cpu time spent up to now is 25.3 secs Computing kpt #: 90 total cpu time spent up to now is 25.5 secs Computing kpt #: 91 total cpu time spent up to now is 25.8 secs Computing kpt #: 92 total cpu time spent up to now is 26.1 secs Computing kpt #: 93 total cpu time spent up to now is 26.4 secs Computing kpt #: 94 total cpu time spent up to now is 26.6 secs Computing kpt #: 95 total cpu time spent up to now is 26.9 secs Computing kpt #: 96 total cpu time spent up to now is 27.2 secs Computing kpt #: 97 total cpu time spent up to now is 27.5 secs Computing kpt #: 98 total cpu time spent up to now is 27.7 secs Computing kpt #: 99 total cpu time spent up to now is 28.0 secs Computing kpt #: 100 total cpu time spent up to now is 28.3 secs Computing kpt #: 101 total cpu time spent up to now is 28.6 secs Computing kpt #: 102 total cpu time spent up to now is 28.9 secs Computing kpt #: 103 total cpu time spent up to now is 29.1 secs Computing kpt #: 104 total cpu time spent up to now is 29.4 secs Computing kpt #: 105 total cpu time spent up to now is 29.7 secs Computing kpt #: 106 total cpu time spent up to now is 29.9 secs Computing kpt #: 107 total cpu time spent up to now is 30.2 secs Computing kpt #: 108 total cpu time spent up to now is 30.5 secs Computing kpt #: 109 total cpu time spent up to now is 30.7 secs Computing kpt #: 110 total cpu time spent up to now is 31.0 secs Computing kpt #: 111 total cpu time spent up to now is 31.3 secs Computing kpt #: 112 total cpu time spent up to now is 31.5 secs Computing kpt #: 113 total cpu time spent up to now is 31.8 secs Computing kpt #: 114 total cpu time spent up to now is 32.1 secs Computing kpt #: 115 total cpu time spent up to now is 32.3 secs Computing kpt #: 116 total cpu time spent up to now is 32.6 secs Computing kpt #: 117 total cpu time spent up to now is 33.1 secs Computing kpt #: 118 total cpu time spent up to now is 33.3 secs Computing kpt #: 119 total cpu time spent up to now is 33.6 secs Computing kpt #: 120 total cpu time spent up to now is 33.9 secs Computing kpt #: 121 total cpu time spent up to now is 34.1 secs Computing kpt #: 122 total cpu time spent up to now is 34.4 secs Computing kpt #: 123 total cpu time spent up to now is 34.6 secs Computing kpt #: 124 total cpu time spent up to now is 34.9 secs Computing kpt #: 125 total cpu time spent up to now is 35.2 secs Computing kpt #: 126 total cpu time spent up to now is 35.4 secs Computing kpt #: 127 total cpu time spent up to now is 35.7 secs Computing kpt #: 128 total cpu time spent up to now is 35.9 secs Computing kpt #: 129 total cpu time spent up to now is 36.2 secs Computing kpt #: 130 total cpu time spent up to now is 36.4 secs Computing kpt #: 131 total cpu time spent up to now is 36.7 secs Computing kpt #: 132 total cpu time spent up to now is 37.0 secs Computing kpt #: 133 total cpu time spent up to now is 37.2 secs Computing kpt #: 134 total cpu time spent up to now is 37.5 secs Computing kpt #: 135 total cpu time spent up to now is 37.8 secs Computing kpt #: 136 total cpu time spent up to now is 38.0 secs Computing kpt #: 137 total cpu time spent up to now is 38.3 secs Computing kpt #: 138 total cpu time spent up to now is 38.5 secs Computing kpt #: 139 total cpu time spent up to now is 38.8 secs Computing kpt #: 140 total cpu time spent up to now is 39.1 secs Computing kpt #: 141 total cpu time spent up to now is 39.3 secs Computing kpt #: 142 total cpu time spent up to now is 39.6 secs Computing kpt #: 143 total cpu time spent up to now is 39.9 secs Computing kpt #: 144 total cpu time spent up to now is 40.1 secs Computing kpt #: 145 total cpu time spent up to now is 40.4 secs Computing kpt #: 146 total cpu time spent up to now is 40.7 secs Computing kpt #: 147 total cpu time spent up to now is 41.0 secs Computing kpt #: 148 total cpu time spent up to now is 41.3 secs Computing kpt #: 149 total cpu time spent up to now is 41.6 secs Computing kpt #: 150 total cpu time spent up to now is 41.9 secs Computing kpt #: 151 total cpu time spent up to now is 42.2 secs Computing kpt #: 152 total cpu time spent up to now is 42.5 secs Computing kpt #: 153 total cpu time spent up to now is 42.8 secs Computing kpt #: 154 total cpu time spent up to now is 43.0 secs Computing kpt #: 155 total cpu time spent up to now is 43.3 secs Computing kpt #: 156 total cpu time spent up to now is 43.6 secs Computing kpt #: 157 total cpu time spent up to now is 43.9 secs Computing kpt #: 158 total cpu time spent up to now is 44.2 secs Computing kpt #: 159 total cpu time spent up to now is 44.4 secs Computing kpt #: 160 total cpu time spent up to now is 44.7 secs Computing kpt #: 161 total cpu time spent up to now is 45.0 secs Computing kpt #: 162 total cpu time spent up to now is 45.2 secs Computing kpt #: 163 total cpu time spent up to now is 45.5 secs Computing kpt #: 164 total cpu time spent up to now is 45.8 secs Computing kpt #: 165 total cpu time spent up to now is 46.0 secs Computing kpt #: 166 total cpu time spent up to now is 46.3 secs Computing kpt #: 167 total cpu time spent up to now is 46.6 secs Computing kpt #: 168 total cpu time spent up to now is 46.8 secs Computing kpt #: 169 total cpu time spent up to now is 47.1 secs Computing kpt #: 170 total cpu time spent up to now is 47.4 secs Computing kpt #: 171 total cpu time spent up to now is 47.6 secs Computing kpt #: 172 total cpu time spent up to now is 47.9 secs Computing kpt #: 173 total cpu time spent up to now is 48.1 secs Computing kpt #: 174 total cpu time spent up to now is 48.4 secs Computing kpt #: 175 total cpu time spent up to now is 48.6 secs Computing kpt #: 176 total cpu time spent up to now is 48.9 secs Computing kpt #: 177 total cpu time spent up to now is 49.1 secs Computing kpt #: 178 total cpu time spent up to now is 49.4 secs Computing kpt #: 179 total cpu time spent up to now is 49.6 secs Computing kpt #: 180 total cpu time spent up to now is 49.9 secs Computing kpt #: 181 total cpu time spent up to now is 50.1 secs Computing kpt #: 182 total cpu time spent up to now is 50.4 secs Computing kpt #: 183 total cpu time spent up to now is 50.6 secs Computing kpt #: 184 total cpu time spent up to now is 50.9 secs Computing kpt #: 185 total cpu time spent up to now is 51.1 secs Computing kpt #: 186 total cpu time spent up to now is 51.4 secs Computing kpt #: 187 total cpu time spent up to now is 51.6 secs Computing kpt #: 188 total cpu time spent up to now is 51.9 secs Computing kpt #: 189 total cpu time spent up to now is 52.1 secs Computing kpt #: 190 total cpu time spent up to now is 52.4 secs Computing kpt #: 191 total cpu time spent up to now is 52.6 secs Computing kpt #: 192 total cpu time spent up to now is 52.9 secs Computing kpt #: 193 total cpu time spent up to now is 53.1 secs Computing kpt #: 194 total cpu time spent up to now is 53.4 secs Computing kpt #: 195 total cpu time spent up to now is 53.6 secs Computing kpt #: 196 total cpu time spent up to now is 53.9 secs Computing kpt #: 197 total cpu time spent up to now is 54.2 secs Computing kpt #: 198 total cpu time spent up to now is 54.4 secs Computing kpt #: 199 total cpu time spent up to now is 54.7 secs Computing kpt #: 200 total cpu time spent up to now is 55.0 secs Computing kpt #: 201 total cpu time spent up to now is 55.3 secs Computing kpt #: 202 total cpu time spent up to now is 55.5 secs Computing kpt #: 203 total cpu time spent up to now is 55.8 secs Computing kpt #: 204 total cpu time spent up to now is 56.1 secs Computing kpt #: 205 total cpu time spent up to now is 56.3 secs Computing kpt #: 206 total cpu time spent up to now is 56.6 secs Computing kpt #: 207 total cpu time spent up to now is 56.9 secs Computing kpt #: 208 total cpu time spent up to now is 57.1 secs Computing kpt #: 209 total cpu time spent up to now is 57.4 secs Computing kpt #: 210 total cpu time spent up to now is 57.6 secs Computing kpt #: 211 total cpu time spent up to now is 57.9 secs Computing kpt #: 212 total cpu time spent up to now is 58.1 secs Computing kpt #: 213 total cpu time spent up to now is 58.4 secs Computing kpt #: 214 total cpu time spent up to now is 58.7 secs Computing kpt #: 215 total cpu time spent up to now is 58.9 secs Computing kpt #: 216 total cpu time spent up to now is 59.2 secs Computing kpt #: 217 total cpu time spent up to now is 59.4 secs Computing kpt #: 218 total cpu time spent up to now is 59.7 secs Computing kpt #: 219 total cpu time spent up to now is 60.0 secs Computing kpt #: 220 total cpu time spent up to now is 60.2 secs Computing kpt #: 221 total cpu time spent up to now is 60.5 secs Computing kpt #: 222 total cpu time spent up to now is 60.7 secs Computing kpt #: 223 total cpu time spent up to now is 61.0 secs Computing kpt #: 224 total cpu time spent up to now is 61.3 secs Computing kpt #: 225 total cpu time spent up to now is 61.6 secs Computing kpt #: 226 total cpu time spent up to now is 61.9 secs Computing kpt #: 227 total cpu time spent up to now is 62.2 secs Computing kpt #: 228 total cpu time spent up to now is 62.5 secs Computing kpt #: 229 total cpu time spent up to now is 62.8 secs Computing kpt #: 230 total cpu time spent up to now is 63.2 secs Computing kpt #: 231 total cpu time spent up to now is 63.5 secs Computing kpt #: 232 total cpu time spent up to now is 63.8 secs Computing kpt #: 233 total cpu time spent up to now is 64.1 secs Computing kpt #: 234 total cpu time spent up to now is 64.4 secs Computing kpt #: 235 total cpu time spent up to now is 64.7 secs Computing kpt #: 236 total cpu time spent up to now is 65.0 secs Computing kpt #: 237 total cpu time spent up to now is 65.3 secs Computing kpt #: 238 total cpu time spent up to now is 65.6 secs Computing kpt #: 239 total cpu time spent up to now is 65.9 secs Computing kpt #: 240 total cpu time spent up to now is 66.2 secs Computing kpt #: 241 total cpu time spent up to now is 66.4 secs Computing kpt #: 242 total cpu time spent up to now is 66.7 secs Computing kpt #: 243 total cpu time spent up to now is 67.0 secs Computing kpt #: 244 total cpu time spent up to now is 67.2 secs Computing kpt #: 245 total cpu time spent up to now is 67.5 secs Computing kpt #: 246 total cpu time spent up to now is 67.7 secs Computing kpt #: 247 total cpu time spent up to now is 68.1 secs Computing kpt #: 248 total cpu time spent up to now is 68.4 secs Computing kpt #: 249 total cpu time spent up to now is 68.6 secs Computing kpt #: 250 total cpu time spent up to now is 68.9 secs Computing kpt #: 251 total cpu time spent up to now is 69.1 secs Computing kpt #: 252 total cpu time spent up to now is 69.4 secs Computing kpt #: 253 total cpu time spent up to now is 69.6 secs Computing kpt #: 254 total cpu time spent up to now is 69.9 secs Computing kpt #: 255 total cpu time spent up to now is 70.1 secs Computing kpt #: 256 total cpu time spent up to now is 70.4 secs Computing kpt #: 257 total cpu time spent up to now is 70.6 secs Computing kpt #: 258 total cpu time spent up to now is 70.9 secs Computing kpt #: 259 total cpu time spent up to now is 71.2 secs Computing kpt #: 260 total cpu time spent up to now is 71.4 secs Computing kpt #: 261 total cpu time spent up to now is 71.7 secs Computing kpt #: 262 total cpu time spent up to now is 71.9 secs Computing kpt #: 263 total cpu time spent up to now is 72.2 secs Computing kpt #: 264 total cpu time spent up to now is 72.4 secs Computing kpt #: 265 total cpu time spent up to now is 72.7 secs Computing kpt #: 266 total cpu time spent up to now is 73.0 secs Computing kpt #: 267 total cpu time spent up to now is 73.2 secs Computing kpt #: 268 total cpu time spent up to now is 73.5 secs Computing kpt #: 269 total cpu time spent up to now is 73.7 secs Computing kpt #: 270 total cpu time spent up to now is 74.0 secs Computing kpt #: 271 total cpu time spent up to now is 74.3 secs Computing kpt #: 272 total cpu time spent up to now is 74.5 secs Computing kpt #: 273 total cpu time spent up to now is 74.8 secs Computing kpt #: 274 total cpu time spent up to now is 75.1 secs Computing kpt #: 275 total cpu time spent up to now is 75.3 secs Computing kpt #: 276 total cpu time spent up to now is 75.6 secs Computing kpt #: 277 total cpu time spent up to now is 75.8 secs Computing kpt #: 278 total cpu time spent up to now is 76.1 secs Computing kpt #: 279 total cpu time spent up to now is 76.4 secs Computing kpt #: 280 total cpu time spent up to now is 76.6 secs Computing kpt #: 281 total cpu time spent up to now is 76.9 secs Computing kpt #: 282 total cpu time spent up to now is 77.1 secs Computing kpt #: 283 total cpu time spent up to now is 77.4 secs Computing kpt #: 284 total cpu time spent up to now is 77.6 secs Computing kpt #: 285 total cpu time spent up to now is 77.9 secs Computing kpt #: 286 total cpu time spent up to now is 78.2 secs Computing kpt #: 287 total cpu time spent up to now is 78.4 secs Computing kpt #: 288 total cpu time spent up to now is 78.7 secs Computing kpt #: 289 total cpu time spent up to now is 78.9 secs Computing kpt #: 290 total cpu time spent up to now is 79.2 secs Computing kpt #: 291 total cpu time spent up to now is 79.5 secs Computing kpt #: 292 total cpu time spent up to now is 79.8 secs Computing kpt #: 293 total cpu time spent up to now is 80.1 secs Computing kpt #: 294 total cpu time spent up to now is 80.3 secs Computing kpt #: 295 total cpu time spent up to now is 80.6 secs Computing kpt #: 296 total cpu time spent up to now is 80.9 secs Computing kpt #: 297 total cpu time spent up to now is 81.1 secs Computing kpt #: 298 total cpu time spent up to now is 81.4 secs Computing kpt #: 299 total cpu time spent up to now is 81.7 secs Computing kpt #: 300 total cpu time spent up to now is 81.9 secs Computing kpt #: 301 total cpu time spent up to now is 82.2 secs Computing kpt #: 302 total cpu time spent up to now is 82.5 secs Computing kpt #: 303 total cpu time spent up to now is 82.7 secs Computing kpt #: 304 total cpu time spent up to now is 83.0 secs Computing kpt #: 305 total cpu time spent up to now is 83.3 secs Computing kpt #: 306 total cpu time spent up to now is 83.5 secs Computing kpt #: 307 total cpu time spent up to now is 83.8 secs Computing kpt #: 308 total cpu time spent up to now is 84.1 secs Computing kpt #: 309 total cpu time spent up to now is 84.3 secs Computing kpt #: 310 total cpu time spent up to now is 84.6 secs Computing kpt #: 311 total cpu time spent up to now is 84.9 secs Computing kpt #: 312 total cpu time spent up to now is 85.1 secs Computing kpt #: 313 total cpu time spent up to now is 85.4 secs Computing kpt #: 314 total cpu time spent up to now is 85.7 secs Computing kpt #: 315 total cpu time spent up to now is 85.9 secs Computing kpt #: 316 total cpu time spent up to now is 86.2 secs Computing kpt #: 317 total cpu time spent up to now is 86.5 secs Computing kpt #: 318 total cpu time spent up to now is 86.7 secs Computing kpt #: 319 total cpu time spent up to now is 87.0 secs Computing kpt #: 320 total cpu time spent up to now is 87.3 secs Computing kpt #: 321 total cpu time spent up to now is 87.6 secs Computing kpt #: 322 total cpu time spent up to now is 87.8 secs Computing kpt #: 323 total cpu time spent up to now is 88.1 secs Computing kpt #: 324 total cpu time spent up to now is 88.4 secs Computing kpt #: 325 total cpu time spent up to now is 88.7 secs Computing kpt #: 326 total cpu time spent up to now is 88.9 secs Computing kpt #: 327 total cpu time spent up to now is 89.2 secs Computing kpt #: 328 total cpu time spent up to now is 89.5 secs Computing kpt #: 329 total cpu time spent up to now is 89.8 secs Computing kpt #: 330 total cpu time spent up to now is 90.1 secs Computing kpt #: 331 total cpu time spent up to now is 90.4 secs Computing kpt #: 332 total cpu time spent up to now is 90.7 secs Computing kpt #: 333 total cpu time spent up to now is 91.0 secs Computing kpt #: 334 total cpu time spent up to now is 91.3 secs Computing kpt #: 335 total cpu time spent up to now is 91.6 secs Computing kpt #: 336 total cpu time spent up to now is 91.9 secs Computing kpt #: 337 total cpu time spent up to now is 92.1 secs Computing kpt #: 338 total cpu time spent up to now is 92.4 secs Computing kpt #: 339 total cpu time spent up to now is 92.7 secs Computing kpt #: 340 total cpu time spent up to now is 93.0 secs Computing kpt #: 341 total cpu time spent up to now is 93.3 secs Computing kpt #: 342 total cpu time spent up to now is 93.5 secs Computing kpt #: 343 total cpu time spent up to now is 93.8 secs Computing kpt #: 344 total cpu time spent up to now is 94.1 secs Computing kpt #: 345 total cpu time spent up to now is 94.4 secs Computing kpt #: 346 total cpu time spent up to now is 94.6 secs Computing kpt #: 347 total cpu time spent up to now is 94.9 secs Computing kpt #: 348 total cpu time spent up to now is 95.2 secs Computing kpt #: 349 total cpu time spent up to now is 95.4 secs Computing kpt #: 350 total cpu time spent up to now is 95.7 secs Computing kpt #: 351 total cpu time spent up to now is 96.0 secs Computing kpt #: 352 total cpu time spent up to now is 96.2 secs Computing kpt #: 353 total cpu time spent up to now is 96.5 secs Computing kpt #: 354 total cpu time spent up to now is 96.7 secs Computing kpt #: 355 total cpu time spent up to now is 97.0 secs Computing kpt #: 356 total cpu time spent up to now is 97.2 secs Computing kpt #: 357 total cpu time spent up to now is 97.5 secs Computing kpt #: 358 total cpu time spent up to now is 97.8 secs Computing kpt #: 359 total cpu time spent up to now is 98.0 secs Computing kpt #: 360 total cpu time spent up to now is 98.3 secs Computing kpt #: 361 total cpu time spent up to now is 98.5 secs Computing kpt #: 362 total cpu time spent up to now is 98.8 secs Computing kpt #: 363 total cpu time spent up to now is 99.0 secs Computing kpt #: 364 total cpu time spent up to now is 99.3 secs Computing kpt #: 365 total cpu time spent up to now is 99.5 secs Computing kpt #: 366 total cpu time spent up to now is 99.8 secs Computing kpt #: 367 total cpu time spent up to now is 100.1 secs Computing kpt #: 368 total cpu time spent up to now is 100.3 secs Computing kpt #: 369 total cpu time spent up to now is 100.6 secs Computing kpt #: 370 total cpu time spent up to now is 100.8 secs Computing kpt #: 371 total cpu time spent up to now is 101.1 secs Computing kpt #: 372 total cpu time spent up to now is 101.3 secs Computing kpt #: 373 total cpu time spent up to now is 101.6 secs Computing kpt #: 374 total cpu time spent up to now is 101.8 secs Computing kpt #: 375 total cpu time spent up to now is 102.0 secs Computing kpt #: 376 total cpu time spent up to now is 102.3 secs Computing kpt #: 377 total cpu time spent up to now is 102.5 secs Computing kpt #: 378 total cpu time spent up to now is 102.8 secs Computing kpt #: 379 total cpu time spent up to now is 103.1 secs Computing kpt #: 380 total cpu time spent up to now is 103.3 secs Computing kpt #: 381 total cpu time spent up to now is 103.6 secs Computing kpt #: 382 total cpu time spent up to now is 103.8 secs Computing kpt #: 383 total cpu time spent up to now is 104.1 secs Computing kpt #: 384 total cpu time spent up to now is 104.3 secs Computing kpt #: 385 total cpu time spent up to now is 104.6 secs Computing kpt #: 386 total cpu time spent up to now is 104.8 secs Computing kpt #: 387 total cpu time spent up to now is 105.1 secs Computing kpt #: 388 total cpu time spent up to now is 105.3 secs Computing kpt #: 389 total cpu time spent up to now is 105.5 secs Computing kpt #: 390 total cpu time spent up to now is 105.8 secs Computing kpt #: 391 total cpu time spent up to now is 106.0 secs Computing kpt #: 392 total cpu time spent up to now is 106.3 secs Computing kpt #: 393 total cpu time spent up to now is 106.5 secs Computing kpt #: 394 total cpu time spent up to now is 106.8 secs Computing kpt #: 395 total cpu time spent up to now is 107.0 secs Computing kpt #: 396 total cpu time spent up to now is 107.3 secs Computing kpt #: 397 total cpu time spent up to now is 107.5 secs Computing kpt #: 398 total cpu time spent up to now is 107.7 secs Computing kpt #: 399 total cpu time spent up to now is 108.0 secs Computing kpt #: 400 total cpu time spent up to now is 108.2 secs Computing kpt #: 401 total cpu time spent up to now is 108.5 secs Computing kpt #: 402 total cpu time spent up to now is 108.7 secs Computing kpt #: 403 total cpu time spent up to now is 109.0 secs Computing kpt #: 404 total cpu time spent up to now is 109.2 secs Computing kpt #: 405 total cpu time spent up to now is 109.5 secs Computing kpt #: 406 total cpu time spent up to now is 109.7 secs Computing kpt #: 407 total cpu time spent up to now is 110.0 secs Computing kpt #: 408 total cpu time spent up to now is 110.3 secs Computing kpt #: 409 total cpu time spent up to now is 110.5 secs Computing kpt #: 410 total cpu time spent up to now is 110.8 secs Computing kpt #: 411 total cpu time spent up to now is 111.1 secs Computing kpt #: 412 total cpu time spent up to now is 111.3 secs Computing kpt #: 413 total cpu time spent up to now is 111.6 secs Computing kpt #: 414 total cpu time spent up to now is 111.9 secs Computing kpt #: 415 total cpu time spent up to now is 112.1 secs Computing kpt #: 416 total cpu time spent up to now is 112.4 secs Computing kpt #: 417 total cpu time spent up to now is 112.7 secs Computing kpt #: 418 total cpu time spent up to now is 112.9 secs Computing kpt #: 419 total cpu time spent up to now is 113.2 secs Computing kpt #: 420 total cpu time spent up to now is 113.5 secs Computing kpt #: 421 total cpu time spent up to now is 113.8 secs Computing kpt #: 422 total cpu time spent up to now is 114.1 secs Computing kpt #: 423 total cpu time spent up to now is 114.3 secs Computing kpt #: 424 total cpu time spent up to now is 114.6 secs Computing kpt #: 425 total cpu time spent up to now is 114.9 secs Computing kpt #: 426 total cpu time spent up to now is 115.2 secs Computing kpt #: 427 total cpu time spent up to now is 115.4 secs Computing kpt #: 428 total cpu time spent up to now is 115.7 secs Computing kpt #: 429 total cpu time spent up to now is 116.0 secs Computing kpt #: 430 total cpu time spent up to now is 116.3 secs Computing kpt #: 431 total cpu time spent up to now is 116.5 secs Computing kpt #: 432 total cpu time spent up to now is 116.8 secs Computing kpt #: 433 total cpu time spent up to now is 117.1 secs Computing kpt #: 434 total cpu time spent up to now is 117.3 secs Computing kpt #: 435 total cpu time spent up to now is 117.6 secs Computing kpt #: 436 total cpu time spent up to now is 117.9 secs Computing kpt #: 437 total cpu time spent up to now is 118.1 secs Computing kpt #: 438 total cpu time spent up to now is 118.4 secs Computing kpt #: 439 total cpu time spent up to now is 118.6 secs Computing kpt #: 440 total cpu time spent up to now is 118.9 secs Computing kpt #: 441 total cpu time spent up to now is 119.2 secs Computing kpt #: 442 total cpu time spent up to now is 119.4 secs Computing kpt #: 443 total cpu time spent up to now is 119.7 secs Computing kpt #: 444 total cpu time spent up to now is 119.9 secs Computing kpt #: 445 total cpu time spent up to now is 120.2 secs Computing kpt #: 446 total cpu time spent up to now is 120.4 secs Computing kpt #: 447 total cpu time spent up to now is 120.7 secs Computing kpt #: 448 total cpu time spent up to now is 120.9 secs Computing kpt #: 449 total cpu time spent up to now is 121.2 secs Computing kpt #: 450 total cpu time spent up to now is 121.4 secs Computing kpt #: 451 total cpu time spent up to now is 121.7 secs Computing kpt #: 452 total cpu time spent up to now is 121.9 secs Computing kpt #: 453 total cpu time spent up to now is 122.2 secs Computing kpt #: 454 total cpu time spent up to now is 122.4 secs Computing kpt #: 455 total cpu time spent up to now is 122.7 secs Computing kpt #: 456 total cpu time spent up to now is 122.9 secs Computing kpt #: 457 total cpu time spent up to now is 123.2 secs Computing kpt #: 458 total cpu time spent up to now is 123.4 secs Computing kpt #: 459 total cpu time spent up to now is 123.7 secs Computing kpt #: 460 total cpu time spent up to now is 123.9 secs Computing kpt #: 461 total cpu time spent up to now is 124.2 secs Computing kpt #: 462 total cpu time spent up to now is 124.4 secs Computing kpt #: 463 total cpu time spent up to now is 124.7 secs Computing kpt #: 464 total cpu time spent up to now is 124.9 secs Computing kpt #: 465 total cpu time spent up to now is 125.2 secs Computing kpt #: 466 total cpu time spent up to now is 125.4 secs Computing kpt #: 467 total cpu time spent up to now is 125.6 secs Computing kpt #: 468 total cpu time spent up to now is 125.9 secs Computing kpt #: 469 total cpu time spent up to now is 126.1 secs Computing kpt #: 470 total cpu time spent up to now is 126.4 secs Computing kpt #: 471 total cpu time spent up to now is 126.6 secs Computing kpt #: 472 total cpu time spent up to now is 126.9 secs Computing kpt #: 473 total cpu time spent up to now is 127.1 secs Computing kpt #: 474 total cpu time spent up to now is 127.4 secs ethr = 3.13E-08, avg # of iterations = 15.6 total cpu time spent up to now is 127.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4141 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5979 -19.5979 -19.4707 -19.4707 -19.4194 -19.4194 -19.4053 -19.4053 -19.3586 -19.3586 -16.0377 -16.0377 -15.6465 -15.6465 -3.8320 -3.8320 -2.3872 -2.3872 1.1096 1.1096 1.2991 1.2991 1.3005 1.3005 1.4739 1.4739 4.4838 4.4838 10.1096 10.1096 10.1521 10.1521 12.6515 12.6515 k = 0.0053 0.0179-0.0000 ( 4141 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5980 -19.5980 -19.4707 -19.4707 -19.4195 -19.4195 -19.4052 -19.4052 -19.3587 -19.3587 -16.0375 -16.0375 -15.6463 -15.6463 -3.8317 -3.8317 -2.3872 -2.3872 1.1096 1.1096 1.2965 1.2965 1.2990 1.2990 1.4738 1.4738 4.4870 4.4870 10.1094 10.1094 10.1541 10.1541 12.6527 12.6527 k = 0.0107 0.0357-0.0000 ( 4137 PWs) bands (ev): -47.5594 -47.5594 -47.5452 -47.5452 -19.6548 -19.6548 -19.5982 -19.5982 -19.4707 -19.4707 -19.4199 -19.4199 -19.4050 -19.4050 -19.3588 -19.3588 -16.0367 -16.0367 -15.6459 -15.6459 -3.8307 -3.8307 -2.3872 -2.3872 1.1098 1.1098 1.2887 1.2887 1.2945 1.2945 1.4737 1.4737 4.4963 4.4963 10.1088 10.1088 10.1600 10.1600 12.6566 12.6566 k = 0.0160 0.0536-0.0000 ( 4135 PWs) bands (ev): -47.5593 -47.5593 -47.5452 -47.5452 -19.6548 -19.6548 -19.5985 -19.5985 -19.4707 -19.4707 -19.4204 -19.4204 -19.4048 -19.4048 -19.3592 -19.3592 -16.0355 -16.0355 -15.6451 -15.6451 -3.8290 -3.8290 -2.3873 -2.3873 1.1101 1.1101 1.2758 1.2758 1.2870 1.2870 1.4734 1.4734 4.5118 4.5118 10.1078 10.1078 10.1699 10.1699 12.6628 12.6628 k = 0.0214 0.0715-0.0000 ( 4139 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6549 -19.6549 -19.5989 -19.5989 -19.4707 -19.4707 -19.4212 -19.4212 -19.4046 -19.4046 -19.3596 -19.3596 -16.0338 -16.0338 -15.6440 -15.6440 -3.8267 -3.8267 -2.3874 -2.3874 1.1105 1.1105 1.2579 1.2579 1.2765 1.2765 1.4730 1.4730 4.5332 4.5332 10.1063 10.1063 10.1837 10.1837 12.6715 12.6715 k = 0.0267 0.0893-0.0000 ( 4131 PWs) bands (ev): -47.5592 -47.5592 -47.5453 -47.5453 -19.6548 -19.6548 -19.5994 -19.5994 -19.4708 -19.4708 -19.4221 -19.4221 -19.4042 -19.4042 -19.3602 -19.3602 -16.0316 -16.0316 -15.6426 -15.6426 -3.8236 -3.8236 -2.3875 -2.3875 1.1110 1.1110 1.2354 1.2354 1.2633 1.2633 1.4726 1.4726 4.5604 4.5604 10.1043 10.1043 10.2013 10.2013 12.6822 12.6822 k = 0.0320 0.1072-0.0000 ( 4131 PWs) bands (ev): -47.5592 -47.5592 -47.5453 -47.5453 -19.6549 -19.6549 -19.6000 -19.6000 -19.4708 -19.4708 -19.4232 -19.4232 -19.4039 -19.4039 -19.3608 -19.3608 -16.0289 -16.0289 -15.6410 -15.6410 -3.8199 -3.8199 -2.3876 -2.3876 1.1116 1.1116 1.2085 1.2085 1.2473 1.2473 1.4720 1.4720 4.5930 4.5930 10.1017 10.1017 10.2226 10.2226 12.6949 12.6949 k = 0.0374 0.1250-0.0000 ( 4129 PWs) bands (ev): -47.5591 -47.5591 -47.5453 -47.5453 -19.6549 -19.6549 -19.6007 -19.6007 -19.4709 -19.4709 -19.4244 -19.4244 -19.4036 -19.4036 -19.3616 -19.3616 -16.0258 -16.0258 -15.6390 -15.6390 -3.8156 -3.8156 -2.3878 -2.3878 1.1123 1.1123 1.1775 1.1775 1.2286 1.2286 1.4714 1.4714 4.6308 4.6308 10.0985 10.0985 10.2476 10.2476 12.7092 12.7092 k = 0.0427 0.1429-0.0000 ( 4129 PWs) bands (ev): -47.5590 -47.5590 -47.5453 -47.5453 -19.6550 -19.6550 -19.6015 -19.6015 -19.4711 -19.4711 -19.4257 -19.4257 -19.4034 -19.4034 -19.3625 -19.3625 -16.0223 -16.0223 -15.6368 -15.6368 -3.8107 -3.8107 -2.3880 -2.3880 1.1130 1.1130 1.1428 1.1428 1.2075 1.2075 1.4707 1.4707 4.6734 4.6734 10.0944 10.0944 10.2762 10.2762 12.7247 12.7247 k = 0.0481 0.1608-0.0000 ( 4125 PWs) bands (ev): -47.5588 -47.5588 -47.5453 -47.5453 -19.6551 -19.6551 -19.6024 -19.6024 -19.4712 -19.4712 -19.4270 -19.4270 -19.4031 -19.4031 -19.3634 -19.3634 -16.0183 -16.0183 -15.6343 -15.6343 -3.8051 -3.8051 -2.3883 -2.3883 1.1047 1.1047 1.1135 1.1135 1.1843 1.1843 1.4699 1.4699 4.7206 4.7206 10.0894 10.0894 10.3083 10.3083 12.7404 12.7404 k = 0.0534 0.1786-0.0000 ( 4125 PWs) bands (ev): -47.5587 -47.5587 -47.5453 -47.5453 -19.6552 -19.6552 -19.6035 -19.6035 -19.4714 -19.4714 -19.4285 -19.4285 -19.4029 -19.4029 -19.3644 -19.3644 -16.0139 -16.0139 -15.6315 -15.6315 -3.7989 -3.7989 -2.3887 -2.3887 1.0638 1.0638 1.1136 1.1136 1.1594 1.1594 1.4690 1.4690 4.7719 4.7719 10.0833 10.0833 10.3436 10.3436 12.6528 12.6528 k = 0.0587 0.1965-0.0000 ( 4121 PWs) bands (ev): -47.5586 -47.5586 -47.5453 -47.5453 -19.6553 -19.6553 -19.6046 -19.6046 -19.4716 -19.4716 -19.4300 -19.4300 -19.4027 -19.4027 -19.3654 -19.3654 -16.0091 -16.0091 -15.6286 -15.6286 -3.7921 -3.7921 -2.3891 -2.3891 1.0202 1.0202 1.1109 1.1109 1.1355 1.1355 1.4680 1.4680 4.8271 4.8271 10.0759 10.0759 10.3822 10.3822 12.5605 12.5605 k = 0.0641 0.2144-0.0000 ( 4121 PWs) bands (ev): -47.5584 -47.5584 -47.5454 -47.5454 -19.6554 -19.6554 -19.6058 -19.6058 -19.4718 -19.4718 -19.4317 -19.4317 -19.4026 -19.4026 -19.3665 -19.3665 -16.0040 -16.0040 -15.6254 -15.6254 -3.7847 -3.7847 -2.3897 -2.3897 0.9745 0.9745 1.0938 1.0938 1.1240 1.1240 1.4670 1.4670 4.8858 4.8858 10.0670 10.0670 10.4238 10.4238 12.4665 12.4665 k = 0.0694 0.2322-0.0000 ( 4121 PWs) bands (ev): -47.5583 -47.5583 -47.5454 -47.5454 -19.6556 -19.6556 -19.6072 -19.6072 -19.4721 -19.4721 -19.4333 -19.4333 -19.4026 -19.4026 -19.3675 -19.3675 -15.9985 -15.9985 -15.6220 -15.6220 -3.7768 -3.7768 -2.3903 -2.3903 0.9269 0.9269 1.0648 1.0648 1.1229 1.1229 1.4659 1.4659 4.9478 4.9478 10.0563 10.0563 10.4684 10.4684 12.3718 12.3718 k = 0.0748 0.2501-0.0000 ( 4117 PWs) bands (ev): -47.5581 -47.5581 -47.5454 -47.5454 -19.6558 -19.6558 -19.6086 -19.6086 -19.4724 -19.4724 -19.4350 -19.4350 -19.4025 -19.4025 -19.3686 -19.3686 -15.9927 -15.9927 -15.6184 -15.6184 -3.7684 -3.7684 -2.3911 -2.3911 0.8778 0.8778 1.0324 1.0324 1.1236 1.1236 1.4647 1.4647 5.0127 5.0127 10.0436 10.0436 10.5157 10.5157 12.2773 12.2773 k = 0.0801 0.2680-0.0000 ( 4121 PWs) bands (ev): -47.5579 -47.5579 -47.5455 -47.5455 -19.6560 -19.6560 -19.6101 -19.6101 -19.4728 -19.4728 -19.4367 -19.4367 -19.4026 -19.4026 -19.3697 -19.3697 -15.9866 -15.9866 -15.6146 -15.6146 -3.7594 -3.7594 -2.3920 -2.3920 0.8276 0.8276 0.9983 0.9983 1.1250 1.1250 1.4634 1.4634 5.0804 5.0804 10.0285 10.0285 10.5657 10.5657 12.1838 12.1838 k = 0.0854 0.2858-0.0000 ( 4119 PWs) bands (ev): -47.5577 -47.5577 -47.5455 -47.5455 -19.6562 -19.6562 -19.6116 -19.6116 -19.4732 -19.4732 -19.4385 -19.4385 -19.4026 -19.4026 -19.3707 -19.3707 -15.9802 -15.9802 -15.6107 -15.6107 -3.7500 -3.7500 -2.3931 -2.3931 0.7764 0.7764 0.9628 0.9628 1.1266 1.1266 1.4621 1.4621 5.1506 5.1506 10.0107 10.0107 10.6182 10.6182 12.0922 12.0922 k = 0.0908 0.3037-0.0000 ( 4123 PWs) bands (ev): -47.5575 -47.5575 -47.5456 -47.5456 -19.6566 -19.6566 -19.6133 -19.6133 -19.4737 -19.4737 -19.4403 -19.4403 -19.4027 -19.4027 -19.3717 -19.3717 -15.9735 -15.9735 -15.6066 -15.6066 -3.7401 -3.7401 -2.3943 -2.3943 0.7247 0.7247 0.9263 0.9263 1.1284 1.1284 1.4606 1.4606 5.2230 5.2230 9.9899 9.9899 10.6730 10.6730 12.0033 12.0033 k = 0.0961 0.3215-0.0000 ( 4121 PWs) bands (ev): -47.5573 -47.5573 -47.5456 -47.5456 -19.6569 -19.6569 -19.6150 -19.6150 -19.4743 -19.4743 -19.4421 -19.4421 -19.4029 -19.4029 -19.3727 -19.3727 -15.9667 -15.9667 -15.6025 -15.6025 -3.7297 -3.7297 -2.3958 -2.3958 0.6727 0.6727 0.8890 0.8890 1.1303 1.1303 1.4591 1.4591 5.2976 5.2976 9.9655 9.9655 10.7300 10.7300 11.9179 11.9179 k = 0.1015 0.3394-0.0000 ( 4109 PWs) bands (ev): -47.5571 -47.5571 -47.5457 -47.5457 -19.6572 -19.6572 -19.6168 -19.6168 -19.4748 -19.4748 -19.4439 -19.4439 -19.4029 -19.4029 -19.3736 -19.3736 -15.9596 -15.9596 -15.5982 -15.5982 -3.7189 -3.7189 -2.3974 -2.3974 0.6206 0.6206 0.8511 0.8511 1.1323 1.1323 1.4575 1.4575 5.3741 5.3741 9.9374 9.9374 10.7891 10.7891 11.8367 11.8367 k = 0.1068 0.3573-0.0000 ( 4113 PWs) bands (ev): -47.5568 -47.5568 -47.5457 -47.5457 -19.6576 -19.6576 -19.6187 -19.6187 -19.4753 -19.4753 -19.4457 -19.4457 -19.4031 -19.4031 -19.3745 -19.3745 -15.9524 -15.9524 -15.5939 -15.5939 -3.7077 -3.7077 -2.3993 -2.3993 0.5686 0.5686 0.8129 0.8129 1.1344 1.1344 1.4559 1.4559 5.4524 5.4524 9.9049 9.9049 10.8500 10.8500 11.7604 11.7604 k = 0.1121 0.3751-0.0000 ( 4123 PWs) bands (ev): -47.5566 -47.5566 -47.5458 -47.5458 -19.6580 -19.6580 -19.6207 -19.6207 -19.4760 -19.4760 -19.4476 -19.4476 -19.4032 -19.4032 -19.3754 -19.3754 -15.9451 -15.9451 -15.5895 -15.5895 -3.6962 -3.6962 -2.4014 -2.4014 0.5170 0.5170 0.7744 0.7744 1.1366 1.1366 1.4542 1.4542 5.5323 5.5323 9.8680 9.8680 10.9126 10.9126 11.6896 11.6896 k = 0.1175 0.3930-0.0000 ( 4117 PWs) bands (ev): -47.5564 -47.5564 -47.5459 -47.5459 -19.6584 -19.6584 -19.6226 -19.6226 -19.4767 -19.4767 -19.4494 -19.4494 -19.4033 -19.4033 -19.3762 -19.3762 -15.9376 -15.9376 -15.5851 -15.5851 -3.6844 -3.6844 -2.4038 -2.4038 0.4659 0.4659 0.7359 0.7359 1.1389 1.1389 1.4524 1.4524 5.6137 5.6137 9.8263 9.8263 10.9767 10.9767 11.6247 11.6247 k = 0.1228 0.4109-0.0000 ( 4121 PWs) bands (ev): -47.5561 -47.5561 -47.5459 -47.5459 -19.6589 -19.6589 -19.6246 -19.6246 -19.4774 -19.4774 -19.4512 -19.4512 -19.4033 -19.4033 -19.3770 -19.3770 -15.9301 -15.9301 -15.5807 -15.5807 -3.6723 -3.6723 -2.4065 -2.4065 0.4157 0.4157 0.6977 0.6977 1.1413 1.1413 1.4505 1.4505 5.6966 5.6966 9.7796 9.7796 11.0421 11.0421 11.5662 11.5662 k = 0.1282 0.4287-0.0000 ( 4121 PWs) bands (ev): -47.5559 -47.5559 -47.5460 -47.5460 -19.6594 -19.6594 -19.6267 -19.6267 -19.4781 -19.4781 -19.4529 -19.4529 -19.4034 -19.4034 -19.3777 -19.3777 -15.9226 -15.9226 -15.5764 -15.5764 -3.6599 -3.6599 -2.4096 -2.4096 0.3664 0.3664 0.6597 0.6597 1.1437 1.1437 1.4486 1.4486 5.7808 5.7808 9.7279 9.7279 11.1086 11.1086 11.5143 11.5143 k = 0.1335 0.4466-0.0000 ( 4117 PWs) bands (ev): -47.5556 -47.5556 -47.5461 -47.5461 -19.6599 -19.6599 -19.6288 -19.6288 -19.4787 -19.4787 -19.4547 -19.4547 -19.4033 -19.4033 -19.3784 -19.3784 -15.9150 -15.9150 -15.5720 -15.5720 -3.6472 -3.6472 -2.4129 -2.4129 0.3182 0.3182 0.6223 0.6223 1.1462 1.1462 1.4466 1.4466 5.8663 5.8663 9.6714 9.6714 11.1758 11.1758 11.4690 11.4690 k = 0.1388 0.4644-0.0000 ( 4113 PWs) bands (ev): -47.5553 -47.5553 -47.5462 -47.5462 -19.6605 -19.6605 -19.6309 -19.6309 -19.4795 -19.4795 -19.4564 -19.4564 -19.4032 -19.4032 -19.3791 -19.3791 -15.9075 -15.9075 -15.5678 -15.5678 -3.6344 -3.6344 -2.4166 -2.4166 0.2712 0.2712 0.5856 0.5856 1.1488 1.1488 1.4446 1.4446 5.9529 5.9529 9.6102 9.6102 11.2434 11.2434 11.4305 11.4305 k = 0.1442 0.4823-0.0000 ( 4107 PWs) bands (ev): -47.5551 -47.5551 -47.5463 -47.5463 -19.6610 -19.6610 -19.6330 -19.6330 -19.4801 -19.4801 -19.4580 -19.4580 -19.4031 -19.4031 -19.3797 -19.3797 -15.9000 -15.9000 -15.5636 -15.5636 -3.6214 -3.6214 -2.4207 -2.4207 0.2256 0.2256 0.5498 0.5498 1.1514 1.1514 1.4425 1.4425 6.0406 6.0406 9.5446 9.5446 11.3108 11.3108 11.3984 11.3984 k = 0.1495 0.5002-0.0000 ( 4111 PWs) bands (ev): -47.5548 -47.5548 -47.5464 -47.5464 -19.6617 -19.6617 -19.6352 -19.6352 -19.4808 -19.4808 -19.4597 -19.4597 -19.4030 -19.4030 -19.3804 -19.3804 -15.8925 -15.8925 -15.5596 -15.5596 -3.6083 -3.6083 -2.4251 -2.4251 0.1816 0.1816 0.5150 0.5150 1.1540 1.1540 1.4403 1.4403 6.1294 6.1294 9.4751 9.4751 11.3718 11.3718 11.3781 11.3781 k = 0.1549 0.5180-0.0000 ( 4107 PWs) bands (ev): -47.5545 -47.5545 -47.5465 -47.5465 -19.6623 -19.6623 -19.6373 -19.6373 -19.4814 -19.4814 -19.4612 -19.4612 -19.4028 -19.4028 -19.3810 -19.3810 -15.8852 -15.8852 -15.5556 -15.5556 -3.5951 -3.5951 -2.4300 -2.4300 0.1391 0.1391 0.4813 0.4813 1.1567 1.1567 1.4381 1.4381 6.2191 6.2191 9.4021 9.4021 11.3525 11.3525 11.4420 11.4420 k = 0.1602 0.5359-0.0000 ( 4099 PWs) bands (ev): -47.5542 -47.5542 -47.5466 -47.5466 -19.6628 -19.6628 -19.6394 -19.6394 -19.4820 -19.4820 -19.4628 -19.4628 -19.4025 -19.4025 -19.3817 -19.3817 -15.8781 -15.8781 -15.5519 -15.5519 -3.5819 -3.5819 -2.4353 -2.4353 0.0985 0.0985 0.4490 0.4490 1.1594 1.1594 1.4359 1.4359 6.3098 6.3098 9.3262 9.3262 11.3381 11.3381 11.5028 11.5028 k = 0.1655 0.5538-0.0000 ( 4119 PWs) bands (ev): -47.5540 -47.5540 -47.5467 -47.5467 -19.6635 -19.6635 -19.6417 -19.6417 -19.4826 -19.4826 -19.4643 -19.4643 -19.4022 -19.4022 -19.3824 -19.3824 -15.8711 -15.8711 -15.5483 -15.5483 -3.5686 -3.5686 -2.4411 -2.4411 0.0596 0.0596 0.4180 0.4180 1.1621 1.1621 1.4335 1.4335 6.4014 6.4014 9.2477 9.2477 11.3289 11.3289 11.5572 11.5572 k = 0.1709 0.5716-0.0000 ( 4107 PWs) bands (ev): -47.5537 -47.5537 -47.5468 -47.5468 -19.6640 -19.6640 -19.6437 -19.6437 -19.4830 -19.4830 -19.4657 -19.4657 -19.4019 -19.4019 -19.3830 -19.3830 -15.8642 -15.8642 -15.5449 -15.5449 -3.5553 -3.5553 -2.4473 -2.4473 0.0227 0.0227 0.3886 0.3886 1.1649 1.1649 1.4312 1.4312 6.4938 6.4938 9.1674 9.1674 11.3244 11.3244 11.6004 11.6004 k = 0.1762 0.5895-0.0000 ( 4107 PWs) bands (ev): -47.5534 -47.5534 -47.5470 -47.5470 -19.6646 -19.6646 -19.6458 -19.6458 -19.4834 -19.4834 -19.4671 -19.4671 -19.4015 -19.4015 -19.3836 -19.3836 -15.8576 -15.8576 -15.5418 -15.5418 -3.5421 -3.5421 -2.4540 -2.4540 -0.0122 -0.0122 0.3608 0.3608 1.1676 1.1676 1.4288 1.4288 6.5870 6.5870 9.0856 9.0856 11.3244 11.3244 11.6260 11.6260 k = 0.1816 0.6074-0.0000 ( 4107 PWs) bands (ev): -47.5531 -47.5531 -47.5471 -47.5471 -19.6651 -19.6651 -19.6478 -19.6478 -19.4838 -19.4838 -19.4685 -19.4685 -19.4010 -19.4010 -19.3842 -19.3842 -15.8512 -15.8512 -15.5389 -15.5389 -3.5289 -3.5289 -2.4612 -2.4612 -0.0449 -0.0449 0.3348 0.3348 1.1704 1.1704 1.4264 1.4264 6.6809 6.6809 9.0028 9.0028 11.3285 11.3285 11.6274 11.6274 k = 0.1869 0.6252-0.0000 ( 4102 PWs) bands (ev): -47.5529 -47.5529 -47.5473 -47.5473 -19.6655 -19.6655 -19.6497 -19.6497 -19.4841 -19.4841 -19.4698 -19.4698 -19.4006 -19.4006 -19.3848 -19.3848 -15.8451 -15.8451 -15.5362 -15.5362 -3.5159 -3.5159 -2.4689 -2.4689 -0.0755 -0.0755 0.3107 0.3107 1.1732 1.1732 1.4239 1.4239 6.7754 6.7754 8.9194 8.9194 11.3364 11.3364 11.6029 11.6029 k = 0.1922 0.6431-0.0000 ( 4102 PWs) bands (ev): -47.5526 -47.5526 -47.5474 -47.5474 -19.6660 -19.6660 -19.6516 -19.6516 -19.4843 -19.4843 -19.4710 -19.4710 -19.4000 -19.4000 -19.3854 -19.3854 -15.8393 -15.8393 -15.5338 -15.5338 -3.5030 -3.5030 -2.4770 -2.4770 -0.1038 -0.1038 0.2885 0.2885 1.1760 1.1760 1.4214 1.4214 6.8705 6.8705 8.8359 8.8359 11.3478 11.3478 11.5572 11.5572 k = 0.1976 0.6609-0.0000 ( 4106 PWs) bands (ev): -47.5523 -47.5523 -47.5476 -47.5476 -19.6664 -19.6664 -19.6535 -19.6535 -19.4845 -19.4845 -19.4722 -19.4722 -19.3995 -19.3995 -19.3861 -19.3861 -15.8338 -15.8338 -15.5317 -15.5317 -3.4903 -3.4903 -2.4857 -2.4857 -0.1299 -0.1299 0.2683 0.2683 1.1788 1.1788 1.4188 1.4188 6.9660 6.9660 8.7526 8.7526 11.3625 11.3625 11.4970 11.4970 k = 0.2029 0.6788-0.0000 ( 4106 PWs) bands (ev): -47.5520 -47.5520 -47.5478 -47.5478 -19.6667 -19.6667 -19.6552 -19.6552 -19.4845 -19.4845 -19.4734 -19.4734 -19.3990 -19.3990 -19.3867 -19.3867 -15.8286 -15.8286 -15.5299 -15.5299 -3.4778 -3.4778 -2.4949 -2.4949 -0.1536 -0.1536 0.2502 0.2502 1.1816 1.1816 1.4163 1.4163 7.0616 7.0616 8.6702 8.6702 11.3804 11.3804 11.4276 11.4276 k = 0.2083 0.6967-0.0000 ( 4108 PWs) bands (ev): -47.5518 -47.5518 -47.5479 -47.5479 -19.6670 -19.6670 -19.6568 -19.6568 -19.4845 -19.4845 -19.4745 -19.4745 -19.3984 -19.3984 -19.3873 -19.3873 -15.8238 -15.8238 -15.5284 -15.5284 -3.4655 -3.4655 -2.5045 -2.5045 -0.1748 -0.1748 0.2342 0.2342 1.1844 1.1844 1.4137 1.4137 7.1572 7.1572 8.5889 8.5889 11.3525 11.3525 11.4012 11.4012 k = 0.2136 0.7145-0.0000 ( 4114 PWs) bands (ev): -47.5515 -47.5515 -47.5481 -47.5481 -19.6673 -19.6673 -19.6583 -19.6583 -19.4845 -19.4845 -19.4756 -19.4756 -19.3978 -19.3978 -19.3880 -19.3880 -15.8192 -15.8192 -15.5272 -15.5272 -3.4536 -3.4536 -2.5146 -2.5146 -0.1937 -0.1937 0.2205 0.2205 1.1871 1.1871 1.4110 1.4110 7.2522 7.2522 8.5096 8.5096 11.2738 11.2738 11.4247 11.4247 k = 0.2189 0.7324-0.0000 ( 4108 PWs) bands (ev): -47.5512 -47.5512 -47.5483 -47.5483 -19.6674 -19.6674 -19.6597 -19.6597 -19.4842 -19.4842 -19.4765 -19.4765 -19.3971 -19.3971 -19.3886 -19.3886 -15.8151 -15.8151 -15.5264 -15.5264 -3.4419 -3.4419 -2.5253 -2.5253 -0.2100 -0.2100 0.2091 0.2091 1.1899 1.1899 1.4084 1.4084 7.3459 7.3459 8.4330 8.4330 11.1927 11.1927 11.4510 11.4510 k = 0.2243 0.7503-0.0000 ( 4112 PWs) bands (ev): -47.5510 -47.5510 -47.5485 -47.5485 -19.6676 -19.6676 -19.6609 -19.6609 -19.4840 -19.4840 -19.4775 -19.4775 -19.3965 -19.3965 -19.3893 -19.3893 -15.8114 -15.8114 -15.5259 -15.5259 -3.4305 -3.4305 -2.5363 -2.5363 -0.2237 -0.2237 0.1998 0.1998 1.1925 1.1925 1.4058 1.4058 7.4371 7.4371 8.3606 8.3606 11.1101 11.1101 11.4797 11.4797 k = 0.2296 0.7681-0.0000 ( 4110 PWs) bands (ev): -47.5507 -47.5507 -47.5487 -47.5487 -19.6677 -19.6677 -19.6619 -19.6619 -19.4837 -19.4837 -19.4783 -19.4783 -19.3958 -19.3958 -19.3899 -19.3899 -15.8080 -15.8080 -15.5258 -15.5258 -3.4195 -3.4195 -2.5478 -2.5478 -0.2350 -0.2350 0.1929 0.1929 1.1952 1.1952 1.4032 1.4032 7.5235 7.5235 8.2948 8.2948 11.0266 11.0266 11.5109 11.5109 k = 0.2350 0.7860-0.0000 ( 4106 PWs) bands (ev): -47.5505 -47.5505 -47.5489 -47.5489 -19.6678 -19.6678 -19.6627 -19.6627 -19.4833 -19.4833 -19.4790 -19.4790 -19.3951 -19.3951 -19.3906 -19.3906 -15.8051 -15.8051 -15.5261 -15.5261 -3.4088 -3.4088 -2.5598 -2.5598 -0.2436 -0.2436 0.1884 0.1884 1.1978 1.1978 1.4005 1.4005 7.6009 7.6009 8.2398 8.2398 10.9425 10.9425 11.5444 11.5444 k = 0.2403 0.8039-0.0000 ( 4102 PWs) bands (ev): -47.5502 -47.5502 -47.5492 -47.5492 -19.6681 -19.6681 -19.6631 -19.6631 -19.4829 -19.4829 -19.4797 -19.4797 -19.3945 -19.3945 -19.3912 -19.3912 -15.8025 -15.8025 -15.5267 -15.5267 -3.3986 -3.3986 -2.5721 -2.5721 -0.2497 -0.2497 0.1862 0.1862 1.2004 1.2004 1.3979 1.3979 7.6620 7.6620 8.2030 8.2030 10.8580 10.8580 11.5802 11.5802 k = 0.2456 0.8217-0.0000 ( 4106 PWs) bands (ev): -47.5500 -47.5500 -47.5494 -47.5494 -19.6684 -19.6684 -19.6633 -19.6633 -19.4826 -19.4826 -19.4802 -19.4802 -19.3939 -19.3939 -19.3918 -19.3918 -15.8004 -15.8004 -15.5277 -15.5277 -3.3888 -3.3888 -2.5849 -2.5849 -0.2532 -0.2532 0.1863 0.1863 1.2029 1.2029 1.3952 1.3952 7.6962 7.6962 8.1952 8.1952 10.7734 10.7734 11.6182 11.6182 k = 0.2510 0.8396-0.0000 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5496 -47.5496 -19.6688 -19.6688 -19.6632 -19.6632 -19.4824 -19.4824 -19.4803 -19.4803 -19.3935 -19.3935 -19.3922 -19.3922 -15.7987 -15.7987 -15.5291 -15.5291 -3.3794 -3.3794 -2.5980 -2.5980 -0.2541 -0.2541 0.1888 0.1888 1.2054 1.2054 1.3925 1.3925 7.6968 7.6968 8.2229 8.2229 10.6887 10.6887 11.6583 11.6583 k = 0.2563 0.8574-0.0000 ( 4114 PWs) bands (ev): -47.5499 -47.5499 -47.5495 -47.5495 -19.6692 -19.6692 -19.6629 -19.6629 -19.4826 -19.4826 -19.4801 -19.4801 -19.3936 -19.3936 -19.3920 -19.3920 -15.7974 -15.7974 -15.5308 -15.5308 -3.3705 -3.3705 -2.6114 -2.6114 -0.2523 -0.2523 0.1936 0.1936 1.2078 1.2078 1.3899 1.3899 7.6684 7.6684 8.2818 8.2818 10.6042 10.6042 11.7004 11.7004 k = 0.2617 0.8753-0.0000 ( 4118 PWs) bands (ev): -47.5501 -47.5501 -47.5493 -47.5493 -19.6695 -19.6695 -19.6623 -19.6623 -19.4829 -19.4829 -19.4795 -19.4795 -19.3942 -19.3942 -19.3915 -19.3915 -15.7965 -15.7965 -15.5329 -15.5329 -3.3620 -3.3620 -2.6252 -2.6252 -0.2480 -0.2480 0.2007 0.2007 1.2102 1.2102 1.3872 1.3872 7.6214 7.6214 8.3614 8.3614 10.5199 10.5199 11.7444 11.7444 k = 0.2670 0.8932-0.0000 ( 4110 PWs) bands (ev): -47.5504 -47.5504 -47.5491 -47.5491 -19.6697 -19.6697 -19.6615 -19.6615 -19.4832 -19.4832 -19.4787 -19.4787 -19.3947 -19.3947 -19.3908 -19.3908 -15.7960 -15.7960 -15.5354 -15.5354 -3.3541 -3.3541 -2.6392 -2.6392 -0.2412 -0.2412 0.2102 0.2102 1.2126 1.2126 1.3846 1.3846 7.5643 7.5643 8.4533 8.4533 10.4359 10.4359 11.7904 11.7904 k = 0.2723 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5506 -47.5506 -47.5489 -47.5489 -19.6699 -19.6699 -19.6607 -19.6607 -19.4835 -19.4835 -19.4779 -19.4779 -19.3954 -19.3954 -19.3902 -19.3902 -15.7960 -15.7960 -15.5382 -15.5382 -3.3466 -3.3466 -2.6534 -2.6534 -0.2317 -0.2317 0.2219 0.2219 1.2148 1.2148 1.3820 1.3820 7.5017 7.5017 8.5528 8.5528 10.3521 10.3521 11.8382 11.8382 k = 0.2723 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5506 -47.5506 -47.5489 -47.5489 -19.6699 -19.6699 -19.6607 -19.6607 -19.4835 -19.4835 -19.4779 -19.4779 -19.3954 -19.3954 -19.3902 -19.3902 -15.7960 -15.7960 -15.5382 -15.5382 -3.3466 -3.3466 -2.6534 -2.6534 -0.2317 -0.2317 0.2219 0.2219 1.2148 1.2148 1.3820 1.3820 7.5017 7.5017 8.5528 8.5528 10.3521 10.3521 11.8382 11.8382 k = 0.2542 0.9110-0.0000 ( 4111 PWs) bands (ev): -47.5505 -47.5505 -47.5489 -47.5489 -19.6698 -19.6698 -19.6609 -19.6609 -19.4834 -19.4834 -19.4781 -19.4781 -19.3952 -19.3952 -19.3904 -19.3904 -15.7960 -15.7960 -15.5373 -15.5373 -3.3488 -3.3488 -2.6492 -2.6492 -0.2345 -0.2345 0.2182 0.2182 1.2141 1.2141 1.3828 1.3828 7.5196 7.5196 8.5235 8.5235 10.3771 10.3771 11.8239 11.8239 k = 0.2360 0.9110-0.0000 ( 4112 PWs) bands (ev): -47.5505 -47.5505 -47.5490 -47.5490 -19.6697 -19.6697 -19.6612 -19.6612 -19.4833 -19.4833 -19.4784 -19.4784 -19.3950 -19.3950 -19.3906 -19.3906 -15.7961 -15.7961 -15.5364 -15.5364 -3.3514 -3.3514 -2.6445 -2.6445 -0.2367 -0.2367 0.2143 0.2143 1.2134 1.2134 1.3837 1.3837 7.5377 7.5377 8.4930 8.4930 10.4048 10.4048 11.8083 11.8083 k = 0.2179 0.9110-0.0000 ( 4112 PWs) bands (ev): -47.5504 -47.5504 -47.5490 -47.5490 -19.6696 -19.6696 -19.6615 -19.6615 -19.4832 -19.4832 -19.4786 -19.4786 -19.3949 -19.3949 -19.3907 -19.3907 -15.7963 -15.7963 -15.5355 -15.5355 -3.3542 -3.3542 -2.6396 -2.6396 -0.2384 -0.2384 0.2101 0.2101 1.2125 1.2125 1.3846 1.3846 7.5558 7.5558 8.4616 8.4616 10.4348 10.4348 11.7916 11.7916 k = 0.1997 0.9110-0.0000 ( 4110 PWs) bands (ev): -47.5503 -47.5503 -47.5491 -47.5491 -19.6695 -19.6695 -19.6618 -19.6618 -19.4831 -19.4831 -19.4788 -19.4788 -19.3947 -19.3947 -19.3909 -19.3909 -15.7965 -15.7965 -15.5347 -15.5347 -3.3572 -3.3572 -2.6346 -2.6346 -0.2396 -0.2396 0.2059 0.2059 1.2116 1.2116 1.3856 1.3856 7.5740 7.5740 8.4298 8.4298 10.4664 10.4664 11.7738 11.7738 k = 0.1816 0.9110-0.0000 ( 4112 PWs) bands (ev): -47.5503 -47.5503 -47.5491 -47.5491 -19.6693 -19.6693 -19.6621 -19.6621 -19.4830 -19.4830 -19.4791 -19.4791 -19.3945 -19.3945 -19.3911 -19.3911 -15.7968 -15.7968 -15.5338 -15.5338 -3.3603 -3.3603 -2.6296 -2.6296 -0.2404 -0.2404 0.2016 0.2016 1.2107 1.2107 1.3867 1.3867 7.5923 7.5923 8.3978 8.3978 10.4989 10.4989 11.7552 11.7552 k = 0.1634 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5502 -47.5502 -47.5492 -47.5492 -19.6690 -19.6690 -19.6624 -19.6624 -19.4829 -19.4829 -19.4793 -19.4793 -19.3944 -19.3944 -19.3913 -19.3913 -15.7971 -15.7971 -15.5329 -15.5329 -3.3633 -3.3633 -2.6247 -2.6247 -0.2407 -0.2407 0.1974 0.1974 1.2098 1.2098 1.3877 1.3877 7.6106 7.6106 8.3662 8.3662 10.5316 10.5316 11.7361 11.7361 k = 0.1452 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5501 -47.5501 -47.5493 -47.5493 -19.6688 -19.6688 -19.6628 -19.6628 -19.4828 -19.4828 -19.4795 -19.4795 -19.3942 -19.3942 -19.3914 -19.3914 -15.7974 -15.7974 -15.5321 -15.5321 -3.3662 -3.3662 -2.6201 -2.6201 -0.2408 -0.2408 0.1932 0.1932 1.2089 1.2089 1.3887 1.3887 7.6288 7.6288 8.3354 8.3354 10.5639 10.5639 11.7168 11.7168 k = 0.1271 0.9110-0.0000 ( 4111 PWs) bands (ev): -47.5501 -47.5501 -47.5493 -47.5493 -19.6685 -19.6685 -19.6632 -19.6632 -19.4826 -19.4826 -19.4798 -19.4798 -19.3941 -19.3941 -19.3916 -19.3916 -15.7977 -15.7977 -15.5314 -15.5314 -3.3689 -3.3689 -2.6158 -2.6158 -0.2406 -0.2406 0.1892 0.1892 1.2080 1.2080 1.3896 1.3896 7.6465 7.6465 8.3058 8.3058 10.5950 10.5950 11.6978 11.6978 k = 0.1089 0.9110-0.0000 ( 4113 PWs) bands (ev): -47.5500 -47.5500 -47.5494 -47.5494 -19.6683 -19.6683 -19.6635 -19.6635 -19.4825 -19.4825 -19.4800 -19.4800 -19.3939 -19.3939 -19.3918 -19.3918 -15.7980 -15.7980 -15.5308 -15.5308 -3.3714 -3.3714 -2.6119 -2.6119 -0.2402 -0.2402 0.1855 0.1855 1.2073 1.2073 1.3904 1.3904 7.6636 7.6636 8.2780 8.2780 10.6242 10.6242 11.6795 11.6795 k = 0.0908 0.9110-0.0000 ( 4117 PWs) bands (ev): -47.5500 -47.5500 -47.5494 -47.5494 -19.6680 -19.6680 -19.6639 -19.6639 -19.4824 -19.4824 -19.4803 -19.4803 -19.3938 -19.3938 -19.3919 -19.3919 -15.7983 -15.7983 -15.5302 -15.5302 -3.3736 -3.3736 -2.6085 -2.6085 -0.2397 -0.2397 0.1821 0.1821 1.2066 1.2066 1.3912 1.3912 7.6797 7.6797 8.2527 8.2527 10.6507 10.6507 11.6625 11.6625 k = 0.0726 0.9110-0.0000 ( 4117 PWs) bands (ev): -47.5499 -47.5499 -47.5495 -47.5495 -19.6676 -19.6676 -19.6643 -19.6643 -19.4822 -19.4822 -19.4805 -19.4805 -19.3936 -19.3936 -19.3921 -19.3921 -15.7985 -15.7985 -15.5297 -15.5297 -3.3754 -3.3754 -2.6056 -2.6056 -0.2392 -0.2392 0.1793 0.1793 1.2061 1.2061 1.3918 1.3918 7.6941 7.6941 8.2303 8.2303 10.6738 10.6738 11.6474 11.6474 k = 0.0545 0.9110-0.0000 ( 4113 PWs) bands (ev): -47.5499 -47.5499 -47.5495 -47.5495 -19.6673 -19.6673 -19.6647 -19.6647 -19.4820 -19.4820 -19.4807 -19.4807 -19.3935 -19.3935 -19.3922 -19.3922 -15.7987 -15.7987 -15.5293 -15.5293 -3.3769 -3.3769 -2.6033 -2.6033 -0.2387 -0.2387 0.1769 0.1769 1.2056 1.2056 1.3923 1.3923 7.7064 7.7064 8.2118 8.2118 10.6927 10.6927 11.6349 11.6349 k = 0.0363 0.9110-0.0000 ( 4109 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6669 -19.6669 -19.6650 -19.6650 -19.4818 -19.4818 -19.4808 -19.4808 -19.3933 -19.3933 -19.3924 -19.3924 -15.7988 -15.7988 -15.5290 -15.5290 -3.3779 -3.3779 -2.6016 -2.6016 -0.2383 -0.2383 0.1752 0.1752 1.2053 1.2053 1.3927 1.3927 7.7158 7.7158 8.1979 8.1979 10.7068 10.7068 11.6254 11.6254 k = 0.0182 0.9110-0.0000 ( 4115 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6667 -19.6667 -19.6654 -19.6654 -19.4817 -19.4817 -19.4810 -19.4810 -19.3932 -19.3932 -19.3925 -19.3925 -15.7989 -15.7989 -15.5289 -15.5289 -3.3786 -3.3786 -2.6006 -2.6006 -0.2380 -0.2380 0.1742 0.1742 1.2051 1.2051 1.3929 1.3929 7.7217 7.7217 8.1892 8.1892 10.7155 10.7155 11.6195 11.6195 k = 0.0000 0.9110-0.0000 ( 4118 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6666 -19.6666 -19.6655 -19.6655 -19.4817 -19.4817 -19.4811 -19.4811 -19.3931 -19.3931 -19.3925 -19.3925 -15.7989 -15.7989 -15.5288 -15.5288 -3.3788 -3.3788 -2.6003 -2.6003 -0.2380 -0.2380 0.1738 0.1738 1.2050 1.2050 1.3930 1.3930 7.7238 7.7238 8.1862 8.1862 10.7184 10.7184 11.6175 11.6175 k = 0.0000 0.9110-0.0000 ( 4118 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6666 -19.6666 -19.6655 -19.6655 -19.4817 -19.4817 -19.4811 -19.4811 -19.3931 -19.3931 -19.3925 -19.3925 -15.7989 -15.7989 -15.5288 -15.5288 -3.3788 -3.3788 -2.6003 -2.6003 -0.2380 -0.2380 0.1738 0.1738 1.2050 1.2050 1.3930 1.3930 7.7238 7.7238 8.1862 8.1862 10.7184 10.7184 11.6175 11.6175 k = 0.0000 0.9110 0.0186 ( 4114 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6665 -19.6665 -19.6654 -19.6654 -19.4820 -19.4820 -19.4807 -19.4807 -19.3934 -19.3934 -19.3924 -19.3924 -15.7989 -15.7989 -15.5289 -15.5289 -3.3785 -3.3785 -2.6004 -2.6004 -0.2375 -0.2375 0.1741 0.1741 1.2039 1.2039 1.3916 1.3916 7.7257 7.7257 8.1870 8.1870 10.7196 10.7196 11.6174 11.6174 k = 0.0000 0.9110 0.0372 ( 4118 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6665 -19.6665 -19.6653 -19.6653 -19.4825 -19.4825 -19.4802 -19.4802 -19.3939 -19.3939 -19.3922 -19.3922 -15.7987 -15.7987 -15.5291 -15.5291 -3.3775 -3.3775 -2.6006 -2.6006 -0.2360 -0.2360 0.1748 0.1748 1.2006 1.2006 1.3877 1.3877 7.7316 7.7316 8.1895 8.1895 10.7231 10.7231 11.6170 11.6170 k = 0.0000 0.9110 0.0558 ( 4120 PWs) bands (ev): -47.5498 -47.5498 -47.5496 -47.5496 -19.6663 -19.6663 -19.6650 -19.6650 -19.4830 -19.4830 -19.4796 -19.4796 -19.3945 -19.3945 -19.3920 -19.3920 -15.7983 -15.7983 -15.5295 -15.5295 -3.3759 -3.3759 -2.6011 -2.6011 -0.2336 -0.2336 0.1761 0.1761 1.1952 1.1952 1.3812 1.3812 7.7414 7.7414 8.1937 8.1937 10.7290 10.7290 11.6163 11.6163 k = 0.0000 0.9110 0.0743 ( 4118 PWs) bands (ev): -47.5497 -47.5497 -47.5496 -47.5496 -19.6662 -19.6662 -19.6646 -19.6646 -19.4836 -19.4836 -19.4790 -19.4790 -19.3952 -19.3952 -19.3918 -19.3918 -15.7978 -15.7978 -15.5300 -15.5300 -3.3736 -3.3736 -2.6017 -2.6017 -0.2302 -0.2302 0.1779 0.1779 1.1876 1.1876 1.3722 1.3722 7.7550 7.7550 8.1995 8.1995 10.7371 10.7371 11.6154 11.6154 k = 0.0000 0.9110 0.0929 ( 4114 PWs) bands (ev): -47.5497 -47.5497 -47.5495 -47.5495 -19.6659 -19.6659 -19.6641 -19.6641 -19.4841 -19.4841 -19.4784 -19.4784 -19.3959 -19.3959 -19.3918 -19.3918 -15.7972 -15.7972 -15.5307 -15.5307 -3.3707 -3.3707 -2.6025 -2.6025 -0.2259 -0.2259 0.1801 0.1801 1.1779 1.1779 1.3607 1.3607 7.7725 7.7725 8.2070 8.2070 10.7474 10.7474 11.6142 11.6142 k = 0.0000 0.9110 0.1115 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5495 -47.5495 -19.6656 -19.6656 -19.6636 -19.6636 -19.4845 -19.4845 -19.4778 -19.4778 -19.3967 -19.3967 -19.3918 -19.3918 -15.7965 -15.7965 -15.5316 -15.5316 -3.3671 -3.3671 -2.6035 -2.6035 -0.2207 -0.2207 0.1828 0.1828 1.1663 1.1663 1.3469 1.3469 7.7936 7.7936 8.2161 8.2161 10.7597 10.7597 11.6128 11.6128 k = 0.0000 0.9110 0.1301 ( 4108 PWs) bands (ev): -47.5496 -47.5496 -47.5495 -47.5495 -19.6652 -19.6652 -19.6629 -19.6629 -19.4850 -19.4850 -19.4772 -19.4772 -19.3976 -19.3976 -19.3918 -19.3918 -15.7956 -15.7956 -15.5326 -15.5326 -3.3629 -3.3629 -2.6047 -2.6047 -0.2146 -0.2146 0.1860 0.1860 1.1528 1.1528 1.3307 1.3307 7.8183 7.8183 8.2269 8.2269 10.7739 10.7739 11.6111 11.6111 k = 0.0000 0.9110 0.1487 ( 4116 PWs) bands (ev): -47.5496 -47.5496 -47.5494 -47.5494 -19.6648 -19.6648 -19.6623 -19.6623 -19.4855 -19.4855 -19.4766 -19.4766 -19.3986 -19.3986 -19.3921 -19.3921 -15.7946 -15.7946 -15.5337 -15.5337 -3.3581 -3.3581 -2.6061 -2.6061 -0.2075 -0.2075 0.1895 0.1895 1.1374 1.1374 1.3124 1.3124 7.8464 7.8464 8.2393 8.2393 10.7898 10.7898 11.6091 11.6091 k = 0.0000 0.9110 0.1673 ( 4114 PWs) bands (ev): -47.5496 -47.5496 -47.5494 -47.5494 -19.6643 -19.6643 -19.6615 -19.6615 -19.4860 -19.4860 -19.4759 -19.4759 -19.3997 -19.3997 -19.3923 -19.3923 -15.7934 -15.7934 -15.5350 -15.5350 -3.3526 -3.3526 -2.6077 -2.6077 -0.1996 -0.1996 0.1935 0.1935 1.1203 1.1203 1.2922 1.2922 7.8780 7.8780 8.2533 8.2533 10.8072 10.8072 11.6069 11.6069 k = 0.0000 0.9110 0.1859 ( 4114 PWs) bands (ev): -47.5495 -47.5495 -47.5493 -47.5493 -19.6637 -19.6637 -19.6607 -19.6607 -19.4865 -19.4865 -19.4753 -19.4753 -19.4008 -19.4008 -19.3925 -19.3925 -15.7921 -15.7921 -15.5365 -15.5365 -3.3466 -3.3466 -2.6095 -2.6095 -0.1909 -0.1909 0.1978 0.1978 1.1015 1.1015 1.2701 1.2701 7.9127 7.9127 8.2690 8.2690 10.8260 10.8260 11.6044 11.6044 k = 0.0000 0.9110 0.2045 ( 4116 PWs) bands (ev): -47.5495 -47.5495 -47.5493 -47.5493 -19.6631 -19.6631 -19.6598 -19.6598 -19.4869 -19.4869 -19.4747 -19.4747 -19.4019 -19.4019 -19.3929 -19.3929 -15.7907 -15.7907 -15.5380 -15.5380 -3.3400 -3.3400 -2.6115 -2.6115 -0.1813 -0.1813 0.2024 0.2024 1.0812 1.0812 1.2463 1.2463 7.9505 7.9505 8.2864 8.2864 10.8459 10.8459 11.6016 11.6016 k = 0.0000 0.9110 0.2230 ( 4112 PWs) bands (ev): -47.5494 -47.5494 -47.5492 -47.5492 -19.6624 -19.6624 -19.6589 -19.6589 -19.4873 -19.4873 -19.4741 -19.4741 -19.4030 -19.4030 -19.3932 -19.3932 -15.7891 -15.7891 -15.5398 -15.5398 -3.3328 -3.3328 -2.6137 -2.6137 -0.1710 -0.1710 0.2073 0.2073 1.0596 1.0596 1.2211 1.2211 7.9913 7.9913 8.3053 8.3053 10.8667 10.8667 11.5985 11.5985 k = 0.0000 0.9110 0.2416 ( 4114 PWs) bands (ev): -47.5493 -47.5493 -47.5492 -47.5492 -19.6617 -19.6617 -19.6579 -19.6579 -19.4877 -19.4877 -19.4735 -19.4735 -19.4043 -19.4043 -19.3937 -19.3937 -15.7874 -15.7874 -15.5417 -15.5417 -3.3251 -3.3251 -2.6162 -2.6162 -0.1599 -0.1599 0.2124 0.2124 1.0367 1.0367 1.1944 1.1944 8.0348 8.0348 8.3259 8.3259 10.8880 10.8880 11.5951 11.5951 k = 0.0000 0.9110 0.2602 ( 4114 PWs) bands (ev): -47.5493 -47.5493 -47.5491 -47.5491 -19.6610 -19.6610 -19.6569 -19.6569 -19.4881 -19.4881 -19.4728 -19.4728 -19.4055 -19.4055 -19.3942 -19.3942 -15.7856 -15.7856 -15.5437 -15.5437 -3.3168 -3.3168 -2.6190 -2.6190 -0.1482 -0.1482 0.2177 0.2177 1.0128 1.0128 1.1667 1.1667 8.0809 8.0809 8.3482 8.3482 10.9096 10.9096 11.5914 11.5914 k = 0.0000 0.9110 0.2788 ( 4114 PWs) bands (ev): -47.5492 -47.5492 -47.5490 -47.5490 -19.6602 -19.6602 -19.6559 -19.6559 -19.4885 -19.4885 -19.4722 -19.4722 -19.4068 -19.4068 -19.3947 -19.3947 -15.7837 -15.7837 -15.5458 -15.5458 -3.3079 -3.3079 -2.6220 -2.6220 -0.1357 -0.1357 0.2231 0.2231 0.9878 0.9878 1.1379 1.1379 8.1294 8.1294 8.3720 8.3720 10.9312 10.9312 11.5872 11.5872 k = 0.0000 0.9110 0.2974 ( 4104 PWs) bands (ev): -47.5491 -47.5491 -47.5490 -47.5490 -19.6593 -19.6593 -19.6548 -19.6548 -19.4888 -19.4888 -19.4716 -19.4716 -19.4080 -19.4080 -19.3952 -19.3952 -15.7816 -15.7816 -15.5481 -15.5481 -3.2986 -3.2986 -2.6253 -2.6253 -0.1227 -0.1227 0.2286 0.2286 0.9621 0.9621 1.1085 1.1085 8.1802 8.1802 8.3975 8.3975 10.9524 10.9524 11.5827 11.5827 k = 0.0000 0.9110 0.3160 ( 4102 PWs) bands (ev): -47.5490 -47.5490 -47.5489 -47.5489 -19.6585 -19.6585 -19.6538 -19.6538 -19.4891 -19.4891 -19.4711 -19.4711 -19.4092 -19.4092 -19.3958 -19.3958 -15.7794 -15.7794 -15.5506 -15.5506 -3.2888 -3.2888 -2.6288 -2.6288 -0.1091 -0.1091 0.2341 0.2341 0.9357 0.9357 1.0784 1.0784 8.2331 8.2331 8.4246 8.4246 10.9730 10.9730 11.5778 11.5778 k = 0.0000 0.9110 0.3346 ( 4104 PWs) bands (ev): -47.5490 -47.5490 -47.5488 -47.5488 -19.6576 -19.6576 -19.6527 -19.6527 -19.4895 -19.4895 -19.4705 -19.4705 -19.4105 -19.4105 -19.3964 -19.3964 -15.7771 -15.7771 -15.5531 -15.5531 -3.2785 -3.2785 -2.6326 -2.6326 -0.0950 -0.0950 0.2395 0.2395 0.9088 0.9088 1.0480 1.0480 8.2880 8.2880 8.4533 8.4533 10.9925 10.9925 11.5722 11.5722 k = 0.0000 0.9110 0.3532 ( 4104 PWs) bands (ev): -47.5489 -47.5489 -47.5487 -47.5487 -19.6567 -19.6567 -19.6516 -19.6516 -19.4897 -19.4897 -19.4700 -19.4700 -19.4117 -19.4117 -19.3970 -19.3970 -15.7746 -15.7746 -15.5558 -15.5558 -3.2678 -3.2678 -2.6368 -2.6368 -0.0805 -0.0805 0.2447 0.2447 0.8816 0.8816 1.0173 1.0173 8.3446 8.3446 8.4837 8.4837 11.0106 11.0106 11.5660 11.5660 k = 0.0000 0.9110 0.3717 ( 4104 PWs) bands (ev): -47.5488 -47.5488 -47.5487 -47.5487 -19.6558 -19.6558 -19.6506 -19.6506 -19.4900 -19.4900 -19.4696 -19.4696 -19.4129 -19.4129 -19.3976 -19.3976 -15.7721 -15.7721 -15.5587 -15.5587 -3.2567 -3.2567 -2.6412 -2.6412 -0.0655 -0.0655 0.2498 0.2498 0.8542 0.8542 0.9866 0.9866 8.4029 8.4029 8.5157 8.5157 11.0269 11.0269 11.5590 11.5590 k = 0.0000 0.9110 0.3903 ( 4102 PWs) bands (ev): -47.5487 -47.5487 -47.5486 -47.5486 -19.6549 -19.6549 -19.6495 -19.6495 -19.4902 -19.4902 -19.4691 -19.4691 -19.4141 -19.4141 -19.3983 -19.3983 -15.7694 -15.7694 -15.5616 -15.5616 -3.2451 -3.2451 -2.6459 -2.6459 -0.0503 -0.0503 0.2545 0.2545 0.8267 0.8267 0.9562 0.9562 8.4627 8.4627 8.5493 8.5493 11.0410 11.0410 11.5511 11.5511 k = 0.0000 0.9110 0.4089 ( 4106 PWs) bands (ev): -47.5486 -47.5486 -47.5485 -47.5485 -19.6540 -19.6540 -19.6485 -19.6485 -19.4904 -19.4904 -19.4688 -19.4688 -19.4152 -19.4152 -19.3990 -19.3990 -15.7666 -15.7666 -15.5647 -15.5647 -3.2332 -3.2332 -2.6510 -2.6510 -0.0349 -0.0349 0.2588 0.2588 0.7993 0.7993 0.9261 0.9261 8.5238 8.5238 8.5846 8.5846 11.0525 11.0525 11.5420 11.5420 k = 0.0000 0.9110 0.4275 ( 4104 PWs) bands (ev): -47.5485 -47.5485 -47.5484 -47.5484 -19.6531 -19.6531 -19.6475 -19.6475 -19.4905 -19.4905 -19.4685 -19.4685 -19.4163 -19.4163 -19.3997 -19.3997 -15.7637 -15.7637 -15.5678 -15.5678 -3.2209 -3.2209 -2.6564 -2.6564 -0.0192 -0.0192 0.2626 0.2626 0.7722 0.7722 0.8966 0.8966 8.5861 8.5861 8.6216 8.6216 11.0609 11.0609 11.5315 11.5315 k = 0.0000 0.9110 0.4461 ( 4106 PWs) bands (ev): -47.5485 -47.5485 -47.5483 -47.5483 -19.6522 -19.6522 -19.6465 -19.6465 -19.4906 -19.4906 -19.4682 -19.4682 -19.4173 -19.4173 -19.4004 -19.4004 -15.7606 -15.7606 -15.5712 -15.5712 -3.2083 -3.2083 -2.6621 -2.6621 -0.0036 -0.0036 0.2659 0.2659 0.7456 0.7456 0.8678 0.8678 8.6493 8.6493 8.6604 8.6604 11.0659 11.0659 11.5191 11.5191 k = 0.0000 0.9110 0.4647 ( 4104 PWs) bands (ev): -47.5484 -47.5484 -47.5483 -47.5483 -19.6513 -19.6513 -19.6456 -19.6456 -19.4907 -19.4907 -19.4680 -19.4680 -19.4182 -19.4182 -19.4010 -19.4010 -15.7575 -15.7575 -15.5746 -15.5746 -3.1954 -3.1954 -2.6681 -2.6681 0.0121 0.0121 0.2685 0.2685 0.7195 0.7195 0.8399 0.8399 8.7001 8.7001 8.7142 8.7142 11.0670 11.0670 11.5045 11.5045 k = 0.0000 0.9110 0.4833 ( 4106 PWs) bands (ev): -47.5483 -47.5483 -47.5482 -47.5482 -19.6504 -19.6504 -19.6447 -19.6447 -19.4907 -19.4907 -19.4679 -19.4679 -19.4190 -19.4190 -19.4017 -19.4017 -15.7543 -15.7543 -15.5781 -15.5781 -3.1822 -3.1822 -2.6745 -2.6745 0.0276 0.0276 0.2704 0.2704 0.6942 0.6942 0.8130 0.8130 8.7422 8.7422 8.7792 8.7792 11.0641 11.0641 11.4870 11.4870 k = 0.0000 0.9110 0.5019 ( 4106 PWs) bands (ev): -47.5482 -47.5482 -47.5481 -47.5481 -19.6495 -19.6495 -19.6439 -19.6439 -19.4907 -19.4907 -19.4679 -19.4679 -19.4197 -19.4197 -19.4024 -19.4024 -15.7509 -15.7509 -15.5817 -15.5817 -3.1688 -3.1688 -2.6812 -2.6812 0.0429 0.0429 0.2715 0.2715 0.6698 0.6698 0.7874 0.7874 8.7859 8.7859 8.8450 8.8450 11.0568 11.0568 11.4661 11.4661 k = 0.0000 0.9110 0.5204 ( 4106 PWs) bands (ev): -47.5481 -47.5481 -47.5480 -47.5480 -19.6487 -19.6487 -19.6431 -19.6431 -19.4906 -19.4906 -19.4680 -19.4680 -19.4203 -19.4203 -19.4031 -19.4031 -15.7475 -15.7475 -15.5854 -15.5854 -3.1551 -3.1551 -2.6883 -2.6883 0.0578 0.0578 0.2716 0.2716 0.6465 0.6465 0.7632 0.7632 8.8312 8.8312 8.9114 8.9114 11.0450 11.0450 11.4408 11.4408 k = 0.0000 0.9110 0.5390 ( 4104 PWs) bands (ev): -47.5481 -47.5481 -47.5479 -47.5479 -19.6479 -19.6479 -19.6423 -19.6423 -19.4905 -19.4905 -19.4681 -19.4681 -19.4207 -19.4207 -19.4037 -19.4037 -15.7439 -15.7439 -15.5892 -15.5892 -3.1413 -3.1413 -2.6957 -2.6957 0.0722 0.0722 0.2708 0.2708 0.6244 0.6244 0.7404 0.7404 8.8783 8.8783 8.9782 8.9782 11.0286 11.0286 11.4105 11.4105 k = 0.0000 0.9110 0.5576 ( 4100 PWs) bands (ev): -47.5480 -47.5480 -47.5479 -47.5479 -19.6471 -19.6471 -19.6416 -19.6416 -19.4903 -19.4903 -19.4683 -19.4683 -19.4211 -19.4211 -19.4044 -19.4044 -15.7403 -15.7403 -15.5931 -15.5931 -3.1272 -3.1272 -2.7035 -2.7035 0.0861 0.0861 0.2691 0.2691 0.6037 0.6037 0.7191 0.7191 8.9271 8.9271 9.0454 9.0454 11.0077 11.0077 11.3742 11.3742 k = 0.0000 0.9110 0.5762 ( 4098 PWs) bands (ev): -47.5479 -47.5479 -47.5478 -47.5478 -19.6463 -19.6463 -19.6410 -19.6410 -19.4901 -19.4901 -19.4686 -19.4686 -19.4214 -19.4214 -19.4051 -19.4051 -15.7365 -15.7365 -15.5971 -15.5971 -3.1130 -3.1130 -2.7116 -2.7116 0.0992 0.0992 0.2664 0.2664 0.5846 0.5846 0.6994 0.6994 8.9777 8.9777 9.1128 9.1128 10.9823 10.9823 11.3312 11.3312 k = 0.0000 0.9110 0.5948 ( 4094 PWs) bands (ev): -47.5478 -47.5478 -47.5477 -47.5477 -19.6456 -19.6456 -19.6404 -19.6404 -19.4898 -19.4898 -19.4690 -19.4690 -19.4215 -19.4215 -19.4057 -19.4057 -15.7327 -15.7327 -15.6011 -15.6011 -3.0987 -3.0987 -2.7201 -2.7201 0.1115 0.1115 0.2627 0.2627 0.5672 0.5672 0.6813 0.6813 9.0300 9.0300 9.1803 9.1803 10.9527 10.9527 11.2810 11.2810 k = 0.0000 0.9110 0.6134 ( 4088 PWs) bands (ev): -47.5477 -47.5477 -47.5476 -47.5476 -19.6448 -19.6448 -19.6399 -19.6399 -19.4895 -19.4895 -19.4695 -19.4695 -19.4215 -19.4215 -19.4063 -19.4063 -15.7288 -15.7288 -15.6053 -15.6053 -3.0843 -3.0843 -2.7289 -2.7289 0.1227 0.1227 0.2582 0.2582 0.5517 0.5517 0.6648 0.6648 9.0841 9.0841 9.2479 9.2479 10.9191 10.9191 11.2235 11.2235 k = 0.0000 0.9110 0.6320 ( 4088 PWs) bands (ev): -47.5477 -47.5477 -47.5476 -47.5476 -19.6442 -19.6442 -19.6395 -19.6395 -19.4891 -19.4891 -19.4700 -19.4700 -19.4215 -19.4215 -19.4070 -19.4070 -15.7248 -15.7248 -15.6095 -15.6095 -3.0699 -3.0699 -2.7381 -2.7381 0.1328 0.1328 0.2529 0.2529 0.5383 0.5383 0.6497 0.6497 9.1400 9.1400 9.3153 9.3153 10.8819 10.8819 11.1590 11.1590 k = 0.0000 0.9110 0.6506 ( 4090 PWs) bands (ev): -47.5476 -47.5476 -47.5475 -47.5475 -19.6435 -19.6435 -19.6391 -19.6391 -19.4887 -19.4887 -19.4707 -19.4707 -19.4213 -19.4213 -19.4077 -19.4077 -15.7208 -15.7208 -15.6138 -15.6138 -3.0554 -3.0554 -2.7476 -2.7476 0.1417 0.1417 0.2470 0.2470 0.5269 0.5269 0.6360 0.6360 9.1977 9.1977 9.3826 9.3826 10.8415 10.8415 11.0883 11.0883 k = 0.0000 0.9110 0.6691 ( 4094 PWs) bands (ev): -47.5476 -47.5476 -47.5475 -47.5475 -19.6429 -19.6429 -19.6388 -19.6388 -19.4883 -19.4883 -19.4713 -19.4713 -19.4211 -19.4211 -19.4083 -19.4083 -15.7166 -15.7166 -15.6181 -15.6181 -3.0408 -3.0408 -2.7575 -2.7575 0.1493 0.1493 0.2406 0.2406 0.5178 0.5178 0.6235 0.6235 9.2572 9.2572 9.4496 9.4496 10.7981 10.7981 11.0123 11.0123 k = 0.0000 0.9110 0.6877 ( 4096 PWs) bands (ev): -47.5475 -47.5475 -47.5474 -47.5474 -19.6424 -19.6424 -19.6385 -19.6385 -19.4878 -19.4878 -19.4721 -19.4721 -19.4209 -19.4209 -19.4090 -19.4090 -15.7125 -15.7125 -15.6225 -15.6225 -3.0263 -3.0263 -2.7677 -2.7677 0.1556 0.1556 0.2339 0.2339 0.5108 0.5108 0.6121 0.6121 9.3185 9.3185 9.5161 9.5161 10.7523 10.7523 10.9323 10.9323 k = 0.0000 0.9110 0.7063 ( 4094 PWs) bands (ev): -47.5474 -47.5474 -47.5474 -47.5474 -19.6418 -19.6418 -19.6383 -19.6383 -19.4872 -19.4872 -19.4728 -19.4728 -19.4205 -19.4205 -19.4096 -19.4096 -15.7082 -15.7082 -15.6269 -15.6269 -3.0118 -3.0118 -2.7782 -2.7782 0.1607 0.1607 0.2270 0.2270 0.5060 0.5060 0.6017 0.6017 9.3816 9.3816 9.5821 9.5821 10.7042 10.7042 10.8494 10.8494 k = 0.0000 0.9110 0.7249 ( 4098 PWs) bands (ev): -47.5474 -47.5474 -47.5473 -47.5473 -19.6413 -19.6413 -19.6381 -19.6381 -19.4866 -19.4866 -19.4737 -19.4737 -19.4201 -19.4201 -19.4103 -19.4103 -15.7039 -15.7039 -15.6313 -15.6313 -2.9974 -2.9974 -2.7890 -2.7890 0.1647 0.1647 0.2202 0.2202 0.5033 0.5033 0.5921 0.5921 9.4463 9.4463 9.6474 9.6474 10.6542 10.6542 10.7647 10.7647 k = 0.0000 0.9110 0.7435 ( 4096 PWs) bands (ev): -47.5474 -47.5474 -47.5473 -47.5473 -19.6409 -19.6409 -19.6380 -19.6380 -19.4860 -19.4860 -19.4745 -19.4745 -19.4196 -19.4196 -19.4110 -19.4110 -15.6995 -15.6995 -15.6359 -15.6359 -2.9830 -2.9830 -2.8002 -2.8002 0.1677 0.1677 0.2135 0.2135 0.5025 0.5025 0.5832 0.5832 9.5128 9.5128 9.7117 9.7117 10.6027 10.6027 10.6792 10.6792 k = 0.0000 0.9110 0.7621 ( 4098 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6404 -19.6404 -19.6380 -19.6380 -19.4853 -19.4853 -19.4754 -19.4754 -19.4191 -19.4191 -19.4116 -19.4116 -15.6951 -15.6951 -15.6404 -15.6404 -2.9688 -2.9688 -2.8116 -2.8116 0.1700 0.1700 0.2072 0.2072 0.5033 0.5033 0.5747 0.5747 9.5808 9.5808 9.7747 9.7747 10.5499 10.5499 10.5941 10.5941 k = 0.0000 0.9110 0.7807 ( 4096 PWs) bands (ev): -47.5473 -47.5473 -47.5472 -47.5472 -19.6400 -19.6400 -19.6379 -19.6379 -19.4846 -19.4846 -19.4762 -19.4762 -19.4186 -19.4186 -19.4123 -19.4123 -15.6906 -15.6906 -15.6449 -15.6449 -2.9546 -2.9546 -2.8234 -2.8234 0.1718 0.1718 0.2013 0.2013 0.5055 0.5055 0.5667 0.5667 9.6501 9.6501 9.8358 9.8358 10.4963 10.4963 10.5103 10.5103 k = 0.0000 0.9110 0.7993 ( 4098 PWs) bands (ev): -47.5473 -47.5473 -47.5472 -47.5472 -19.6397 -19.6397 -19.6380 -19.6380 -19.4838 -19.4838 -19.4771 -19.4771 -19.4180 -19.4180 -19.4129 -19.4129 -15.6862 -15.6862 -15.6495 -15.6495 -2.9406 -2.9406 -2.8355 -2.8355 0.1733 0.1733 0.1960 0.1960 0.5090 0.5090 0.5590 0.5590 9.7204 9.7204 9.8938 9.8938 10.4295 10.4295 10.4425 10.4425 k = 0.0000 0.9110 0.8178 ( 4094 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6393 -19.6393 -19.6381 -19.6381 -19.4830 -19.4830 -19.4780 -19.4780 -19.4174 -19.4174 -19.4136 -19.4136 -15.6816 -15.6816 -15.6541 -15.6541 -2.9267 -2.9267 -2.8478 -2.8478 0.1748 0.1748 0.1912 0.1912 0.5135 0.5135 0.5515 0.5515 9.7910 9.7910 9.9461 9.9461 10.3546 10.3546 10.3890 10.3890 k = 0.0000 0.9110 0.8364 ( 4096 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6390 -19.6390 -19.6382 -19.6382 -19.4822 -19.4822 -19.4788 -19.4788 -19.4168 -19.4168 -19.4142 -19.4142 -15.6771 -15.6771 -15.6587 -15.6587 -2.9130 -2.9130 -2.8604 -2.8604 0.1764 0.1764 0.1871 0.1871 0.5187 0.5187 0.5444 0.5444 9.8605 9.8605 9.9867 9.9867 10.2920 10.2920 10.3376 10.3376 k = 0.0000 0.9110 0.8550 ( 4098 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6388 -19.6388 -19.6384 -19.6384 -19.4814 -19.4814 -19.4797 -19.4797 -19.4162 -19.4162 -19.4149 -19.4149 -15.6725 -15.6725 -15.6633 -15.6633 -2.8995 -2.8995 -2.8732 -2.8732 0.1783 0.1783 0.1836 0.1836 0.5245 0.5245 0.5374 0.5374 9.9256 9.9256 10.0018 10.0018 10.2556 10.2556 10.2914 10.2914 k = 0.0000 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6386 -19.6386 -19.6386 -19.6386 -19.4806 -19.4806 -19.4806 -19.4806 -19.4155 -19.4155 -19.4155 -19.4155 -15.6679 -15.6679 -15.6679 -15.6679 -2.8863 -2.8863 -2.8863 -2.8863 0.1807 0.1807 0.1807 0.1807 0.5308 0.5308 0.5308 0.5308 9.9781 9.9781 9.9781 9.9781 10.2586 10.2586 10.2586 10.2586 k = 0.0000 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6386 -19.6386 -19.6386 -19.6386 -19.4806 -19.4806 -19.4806 -19.4806 -19.4155 -19.4155 -19.4155 -19.4155 -15.6679 -15.6679 -15.6679 -15.6679 -2.8863 -2.8863 -2.8863 -2.8863 0.1807 0.1807 0.1807 0.1807 0.5308 0.5308 0.5308 0.5308 9.9781 9.9781 9.9781 9.9781 10.2586 10.2586 10.2586 10.2586 k = 0.0182 0.9110 0.8736 ( 4094 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6386 -19.6386 -19.6385 -19.6385 -19.4809 -19.4809 -19.4803 -19.4803 -19.4157 -19.4157 -19.4153 -19.4153 -15.6679 -15.6679 -15.6679 -15.6679 -2.8863 -2.8863 -2.8863 -2.8863 0.1807 0.1807 0.1810 0.1810 0.5306 0.5306 0.5310 0.5310 9.9783 9.9783 9.9784 9.9784 10.2580 10.2580 10.2583 10.2583 k = 0.0363 0.9110 0.8736 ( 4084 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6386 -19.6386 -19.6384 -19.6384 -19.4811 -19.4811 -19.4799 -19.4799 -19.4159 -19.4159 -19.4150 -19.4150 -15.6679 -15.6679 -15.6679 -15.6679 -2.8865 -2.8865 -2.8865 -2.8865 0.1810 0.1810 0.1815 0.1815 0.5304 0.5304 0.5311 0.5311 9.9789 9.9789 9.9792 9.9792 10.2565 10.2565 10.2571 10.2571 k = 0.0545 0.9110 0.8736 ( 4082 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6387 -19.6387 -19.6383 -19.6383 -19.4814 -19.4814 -19.4796 -19.4796 -19.4162 -19.4162 -19.4148 -19.4148 -15.6679 -15.6679 -15.6679 -15.6679 -2.8869 -2.8869 -2.8868 -2.8868 0.1815 0.1815 0.1823 0.1823 0.5302 0.5302 0.5312 0.5312 9.9801 9.9801 9.9805 9.9805 10.2539 10.2539 10.2550 10.2550 k = 0.0726 0.9110 0.8736 ( 4092 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6388 -19.6388 -19.6383 -19.6383 -19.4817 -19.4817 -19.4794 -19.4794 -19.4164 -19.4164 -19.4146 -19.4146 -15.6679 -15.6679 -15.6678 -15.6678 -2.8874 -2.8874 -2.8873 -2.8873 0.1823 0.1823 0.1834 0.1834 0.5299 0.5299 0.5312 0.5312 9.9820 9.9820 9.9824 9.9824 10.2503 10.2503 10.2516 10.2516 k = 0.0908 0.9110 0.8736 ( 4094 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6389 -19.6389 -19.6383 -19.6383 -19.4820 -19.4820 -19.4791 -19.4791 -19.4167 -19.4167 -19.4143 -19.4143 -15.6678 -15.6678 -15.6678 -15.6678 -2.8880 -2.8880 -2.8878 -2.8878 0.1833 0.1833 0.1846 0.1846 0.5296 0.5296 0.5313 0.5313 9.9846 9.9846 9.9851 9.9851 10.2454 10.2454 10.2470 10.2470 k = 0.1089 0.9110 0.8736 ( 4096 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6389 -19.6389 -19.6383 -19.6383 -19.4822 -19.4822 -19.4788 -19.4788 -19.4169 -19.4169 -19.4141 -19.4141 -15.6678 -15.6678 -15.6678 -15.6678 -2.8887 -2.8887 -2.8885 -2.8885 0.1846 0.1846 0.1861 0.1861 0.5293 0.5293 0.5313 0.5313 9.9882 9.9882 9.9888 9.9888 10.2389 10.2389 10.2408 10.2408 k = 0.1271 0.9110 0.8736 ( 4102 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6390 -19.6390 -19.6383 -19.6383 -19.4825 -19.4825 -19.4786 -19.4786 -19.4172 -19.4172 -19.4139 -19.4139 -15.6678 -15.6678 -15.6677 -15.6677 -2.8895 -2.8895 -2.8893 -2.8893 0.1860 0.1860 0.1878 0.1878 0.5289 0.5289 0.5312 0.5312 9.9929 9.9929 9.9936 9.9936 10.2308 10.2308 10.2330 10.2330 k = 0.1452 0.9110 0.8736 ( 4104 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6391 -19.6391 -19.6383 -19.6383 -19.4828 -19.4828 -19.4783 -19.4783 -19.4174 -19.4174 -19.4137 -19.4137 -15.6677 -15.6677 -15.6677 -15.6677 -2.8903 -2.8903 -2.8902 -2.8902 0.1877 0.1877 0.1897 0.1897 0.5286 0.5286 0.5311 0.5311 9.9989 9.9989 9.9996 9.9996 10.2209 10.2209 10.2232 10.2232 k = 0.1634 0.9110 0.8736 ( 4106 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6392 -19.6392 -19.6383 -19.6383 -19.4831 -19.4831 -19.4780 -19.4780 -19.4176 -19.4176 -19.4135 -19.4135 -15.6677 -15.6677 -15.6676 -15.6676 -2.8913 -2.8913 -2.8911 -2.8911 0.1895 0.1895 0.1917 0.1917 0.5282 0.5282 0.5310 0.5310 10.0064 10.0064 10.0071 10.0071 10.2090 10.2090 10.2115 10.2115 k = 0.1816 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6394 -19.6394 -19.6383 -19.6383 -19.4833 -19.4833 -19.4778 -19.4778 -19.4178 -19.4178 -19.4133 -19.4133 -15.6676 -15.6676 -15.6676 -15.6676 -2.8923 -2.8923 -2.8921 -2.8921 0.1915 0.1915 0.1939 0.1939 0.5279 0.5279 0.5309 0.5309 10.0153 10.0153 10.0160 10.0160 10.1951 10.1951 10.1978 10.1978 k = 0.1997 0.9110 0.8736 ( 4110 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6395 -19.6395 -19.6383 -19.6383 -19.4836 -19.4836 -19.4775 -19.4775 -19.4180 -19.4180 -19.4131 -19.4131 -15.6676 -15.6676 -15.6675 -15.6675 -2.8933 -2.8933 -2.8931 -2.8931 0.1936 0.1936 0.1961 0.1961 0.5275 0.5275 0.5307 0.5307 10.0257 10.0257 10.0264 10.0264 10.1793 10.1793 10.1821 10.1821 k = 0.2179 0.9110 0.8736 ( 4104 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6395 -19.6395 -19.6382 -19.6382 -19.4838 -19.4838 -19.4772 -19.4772 -19.4182 -19.4182 -19.4129 -19.4129 -15.6675 -15.6675 -15.6674 -15.6674 -2.8943 -2.8943 -2.8941 -2.8941 0.1957 0.1957 0.1984 0.1984 0.5272 0.5272 0.5305 0.5305 10.0373 10.0373 10.0378 10.0378 10.1621 10.1621 10.1649 10.1649 k = 0.2360 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6397 -19.6397 -19.6382 -19.6382 -19.4840 -19.4840 -19.4770 -19.4770 -19.4184 -19.4184 -19.4127 -19.4127 -15.6675 -15.6675 -15.6674 -15.6674 -2.8954 -2.8954 -2.8951 -2.8951 0.1979 0.1979 0.2006 0.2006 0.5269 0.5269 0.5303 0.5303 10.0488 10.0488 10.0491 10.0491 10.1449 10.1449 10.1474 10.1474 k = 0.2542 0.9110 0.8736 ( 4110 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6398 -19.6398 -19.6382 -19.6382 -19.4842 -19.4842 -19.4767 -19.4767 -19.4186 -19.4186 -19.4125 -19.4125 -15.6674 -15.6674 -15.6673 -15.6673 -2.8964 -2.8964 -2.8961 -2.8961 0.2000 0.2000 0.2028 0.2028 0.5267 0.5267 0.5302 0.5302 10.0562 10.0562 10.0568 10.0568 10.1316 10.1316 10.1335 10.1335 k = 0.2723 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6399 -19.6399 -19.6382 -19.6382 -19.4844 -19.4844 -19.4764 -19.4764 -19.4188 -19.4188 -19.4124 -19.4124 -15.6674 -15.6674 -15.6673 -15.6673 -2.8973 -2.8973 -2.8971 -2.8971 0.2021 0.2021 0.2049 0.2049 0.5265 0.5265 0.5301 0.5301 10.0513 10.0513 10.0532 10.0532 10.1306 10.1306 10.1311 10.1311 k = 0.2723 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6399 -19.6399 -19.6382 -19.6382 -19.4844 -19.4844 -19.4764 -19.4764 -19.4188 -19.4188 -19.4124 -19.4124 -15.6674 -15.6674 -15.6673 -15.6673 -2.8973 -2.8973 -2.8971 -2.8971 0.2021 0.2021 0.2049 0.2049 0.5265 0.5265 0.5301 0.5301 10.0513 10.0513 10.0532 10.0532 10.1306 10.1306 10.1311 10.1311 k = 0.2670 0.8932 0.8736 ( 4112 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6395 -19.6395 -19.6383 -19.6383 -19.4837 -19.4837 -19.4774 -19.4774 -19.4182 -19.4182 -19.4130 -19.4130 -15.6675 -15.6675 -15.6675 -15.6675 -2.8941 -2.8941 -2.8939 -2.8939 0.1951 0.1951 0.1979 0.1979 0.5272 0.5272 0.5306 0.5306 10.0323 10.0323 10.0336 10.0336 10.1700 10.1700 10.1736 10.1736 k = 0.2617 0.8753 0.8736 ( 4120 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6392 -19.6392 -19.6384 -19.6384 -19.4830 -19.4830 -19.4783 -19.4783 -19.4176 -19.4176 -19.4136 -19.4136 -15.6677 -15.6677 -15.6676 -15.6676 -2.8913 -2.8913 -2.8911 -2.8911 0.1887 0.1887 0.1914 0.1914 0.5282 0.5282 0.5316 0.5316 9.9717 9.9717 9.9733 9.9733 10.2537 10.2537 10.2573 10.2573 k = 0.2563 0.8574 0.8736 ( 4120 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6389 -19.6389 -19.6385 -19.6385 -19.4822 -19.4822 -19.4791 -19.4791 -19.4169 -19.4169 -19.4143 -19.4143 -15.6678 -15.6678 -15.6677 -15.6677 -2.8888 -2.8888 -2.8886 -2.8886 0.1829 0.1829 0.1856 0.1856 0.5297 0.5297 0.5330 0.5330 9.9081 9.9081 9.9098 9.9098 10.3425 10.3425 10.3460 10.3460 k = 0.2510 0.8396 0.8736 ( 4120 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6386 -19.6386 -19.6386 -19.6386 -19.4814 -19.4814 -19.4800 -19.4800 -19.4163 -19.4163 -19.4149 -19.4149 -15.6679 -15.6679 -15.6679 -15.6679 -2.8867 -2.8867 -2.8865 -2.8865 0.1778 0.1778 0.1804 0.1804 0.5315 0.5315 0.5348 0.5348 9.8441 9.8441 9.8460 9.8460 10.4337 10.4337 10.4370 10.4370 k = 0.2456 0.8217 0.8736 ( 4120 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6388 -19.6388 -19.6384 -19.6384 -19.4808 -19.4808 -19.4805 -19.4805 -19.4157 -19.4157 -19.4155 -19.4155 -15.6681 -15.6681 -15.6680 -15.6680 -2.8850 -2.8850 -2.8847 -2.8847 0.1732 0.1732 0.1759 0.1759 0.5337 0.5337 0.5369 0.5369 9.7806 9.7806 9.7825 9.7825 10.5267 10.5267 10.5299 10.5299 k = 0.2403 0.8039 0.8736 ( 4108 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6390 -19.6390 -19.6382 -19.6382 -19.4816 -19.4816 -19.4796 -19.4796 -19.4161 -19.4161 -19.4150 -19.4150 -15.6681 -15.6681 -15.6681 -15.6681 -2.8836 -2.8836 -2.8833 -2.8833 0.1694 0.1694 0.1720 0.1720 0.5363 0.5363 0.5394 0.5394 9.7177 9.7177 9.7197 9.7197 10.6215 10.6215 10.6245 10.6245 k = 0.2350 0.7860 0.8736 ( 4104 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6392 -19.6392 -19.6380 -19.6380 -19.4824 -19.4824 -19.4787 -19.4787 -19.4167 -19.4167 -19.4143 -19.4143 -15.6682 -15.6682 -15.6681 -15.6681 -2.8826 -2.8826 -2.8823 -2.8823 0.1660 0.1660 0.1686 0.1686 0.5394 0.5394 0.5423 0.5423 9.6555 9.6555 9.6577 9.6577 10.7179 10.7179 10.7207 10.7207 k = 0.2296 0.7681 0.8736 ( 4096 PWs) bands (ev): -47.5472 -47.5472 -47.5472 -47.5472 -19.6394 -19.6394 -19.6378 -19.6378 -19.4832 -19.4832 -19.4779 -19.4779 -19.4173 -19.4173 -19.4136 -19.4136 -15.6683 -15.6683 -15.6682 -15.6682 -2.8820 -2.8820 -2.8817 -2.8817 0.1632 0.1632 0.1657 0.1657 0.5430 0.5430 0.5458 0.5458 9.5943 9.5943 9.5965 9.5965 10.8160 10.8160 10.8186 10.8186 k = 0.2243 0.7503 0.8736 ( 4100 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6398 -19.6398 -19.6378 -19.6378 -19.4839 -19.4839 -19.4770 -19.4770 -19.4179 -19.4179 -19.4130 -19.4130 -15.6683 -15.6683 -15.6683 -15.6683 -2.8817 -2.8817 -2.8814 -2.8814 0.1606 0.1606 0.1631 0.1631 0.5472 0.5472 0.5499 0.5499 9.5339 9.5339 9.5363 9.5363 10.9158 10.9158 10.9182 10.9182 k = 0.2189 0.7324 0.8736 ( 4092 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6401 -19.6401 -19.6377 -19.6377 -19.4846 -19.4846 -19.4761 -19.4761 -19.4184 -19.4184 -19.4123 -19.4123 -15.6684 -15.6684 -15.6683 -15.6683 -2.8818 -2.8818 -2.8814 -2.8814 0.1583 0.1583 0.1608 0.1608 0.5521 0.5521 0.5548 0.5548 9.4746 9.4746 9.4771 9.4771 11.0172 11.0172 11.0193 11.0193 k = 0.2136 0.7145 0.8736 ( 4092 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6405 -19.6405 -19.6377 -19.6377 -19.4853 -19.4853 -19.4752 -19.4752 -19.4190 -19.4190 -19.4117 -19.4117 -15.6684 -15.6684 -15.6683 -15.6683 -2.8822 -2.8822 -2.8818 -2.8818 0.1561 0.1561 0.1585 0.1585 0.5580 0.5580 0.5606 0.5606 9.4163 9.4163 9.4188 9.4188 11.1202 11.1202 11.1221 11.1221 k = 0.2083 0.6967 0.8736 ( 4088 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6408 -19.6408 -19.6377 -19.6377 -19.4859 -19.4859 -19.4744 -19.4744 -19.4194 -19.4194 -19.4110 -19.4110 -15.6684 -15.6684 -15.6683 -15.6683 -2.8829 -2.8829 -2.8826 -2.8826 0.1538 0.1538 0.1562 0.1562 0.5648 0.5648 0.5673 0.5673 9.3591 9.3591 9.3617 9.3617 11.2247 11.2247 11.2263 11.2263 k = 0.2029 0.6788 0.8736 ( 4092 PWs) bands (ev): -47.5474 -47.5474 -47.5474 -47.5474 -19.6413 -19.6413 -19.6378 -19.6378 -19.4865 -19.4865 -19.4735 -19.4735 -19.4199 -19.4199 -19.4104 -19.4104 -15.6684 -15.6684 -15.6683 -15.6683 -2.8840 -2.8840 -2.8837 -2.8837 0.1514 0.1514 0.1536 0.1536 0.5728 0.5728 0.5752 0.5752 9.3029 9.3029 9.3056 9.3056 11.3306 11.3306 11.3318 11.3318 k = 0.1976 0.6609 0.8736 ( 4112 PWs) bands (ev): -47.5475 -47.5475 -47.5475 -47.5475 -19.6418 -19.6418 -19.6380 -19.6380 -19.4872 -19.4872 -19.4728 -19.4728 -19.4204 -19.4204 -19.4099 -19.4099 -15.6684 -15.6684 -15.6683 -15.6683 -2.8854 -2.8854 -2.8851 -2.8851 0.1485 0.1485 0.1507 0.1507 0.5820 0.5820 0.5843 0.5843 9.2478 9.2478 9.2506 9.2506 11.4374 11.4374 11.4380 11.4380 k = 0.1922 0.6431 0.8736 ( 4114 PWs) bands (ev): -47.5475 -47.5475 -47.5475 -47.5475 -19.6423 -19.6423 -19.6382 -19.6382 -19.4877 -19.4877 -19.4721 -19.4721 -19.4208 -19.4208 -19.4093 -19.4093 -15.6683 -15.6683 -15.6683 -15.6683 -2.8871 -2.8871 -2.8867 -2.8867 0.1453 0.1453 0.1474 0.1474 0.5927 0.5927 0.5949 0.5949 9.1938 9.1938 9.1966 9.1966 11.5433 11.5433 11.5437 11.5437 k = 0.1869 0.6252 0.8736 ( 4110 PWs) bands (ev): -47.5476 -47.5476 -47.5476 -47.5476 -19.6428 -19.6428 -19.6385 -19.6385 -19.4882 -19.4882 -19.4713 -19.4713 -19.4211 -19.4211 -19.4086 -19.4086 -15.6683 -15.6683 -15.6682 -15.6682 -2.8890 -2.8890 -2.8887 -2.8887 0.1414 0.1414 0.1435 0.1435 0.6048 0.6048 0.6069 0.6069 9.1409 9.1409 9.1437 9.1437 11.6424 11.6424 11.6447 11.6447 k = 0.1816 0.6074 0.8736 ( 4102 PWs) bands (ev): -47.5476 -47.5476 -47.5476 -47.5476 -19.6433 -19.6433 -19.6387 -19.6387 -19.4886 -19.4886 -19.4706 -19.4706 -19.4213 -19.4213 -19.4080 -19.4080 -15.6682 -15.6682 -15.6682 -15.6682 -2.8912 -2.8912 -2.8909 -2.8909 0.1369 0.1369 0.1390 0.1390 0.6185 0.6185 0.6205 0.6205 9.0891 9.0891 9.0919 9.0919 11.7127 11.7127 11.7176 11.7176 k = 0.1762 0.5895 0.8736 ( 4104 PWs) bands (ev): -47.5477 -47.5477 -47.5477 -47.5477 -19.6439 -19.6439 -19.6391 -19.6391 -19.4890 -19.4890 -19.4700 -19.4700 -19.4215 -19.4215 -19.4074 -19.4074 -15.6682 -15.6682 -15.6681 -15.6681 -2.8937 -2.8937 -2.8933 -2.8933 0.1317 0.1317 0.1337 0.1337 0.6337 0.6337 0.6356 0.6356 9.0383 9.0383 9.0412 9.0412 11.7261 11.7261 11.7300 11.7300 k = 0.1709 0.5716 0.8736 ( 4112 PWs) bands (ev): -47.5478 -47.5478 -47.5478 -47.5478 -19.6446 -19.6446 -19.6395 -19.6395 -19.4893 -19.4893 -19.4695 -19.4695 -19.4216 -19.4216 -19.4068 -19.4068 -15.6681 -15.6681 -15.6680 -15.6680 -2.8964 -2.8964 -2.8960 -2.8960 0.1258 0.1258 0.1277 0.1277 0.6505 0.6505 0.6523 0.6523 8.9885 8.9885 8.9915 8.9915 11.7120 11.7120 11.7145 11.7145 k = 0.1655 0.5538 0.8736 ( 4112 PWs) bands (ev): -47.5478 -47.5478 -47.5478 -47.5478 -19.6452 -19.6452 -19.6400 -19.6400 -19.4896 -19.4896 -19.4690 -19.4690 -19.4216 -19.4216 -19.4062 -19.4062 -15.6680 -15.6680 -15.6679 -15.6679 -2.8993 -2.8993 -2.8989 -2.8989 0.1191 0.1191 0.1209 0.1209 0.6689 0.6689 0.6705 0.6705 8.9399 8.9399 8.9428 8.9428 11.6907 11.6907 11.6925 11.6925 k = 0.1602 0.5359 0.8736 ( 4108 PWs) bands (ev): -47.5479 -47.5479 -47.5479 -47.5479 -19.6458 -19.6458 -19.6405 -19.6405 -19.4899 -19.4899 -19.4686 -19.4686 -19.4214 -19.4214 -19.4055 -19.4055 -15.6679 -15.6679 -15.6678 -15.6678 -2.9024 -2.9024 -2.9020 -2.9020 0.1117 0.1117 0.1134 0.1134 0.6887 0.6887 0.6903 0.6903 8.8922 8.8922 8.8952 8.8952 11.6672 11.6672 11.6686 11.6686 k = 0.1549 0.5180 0.8736 ( 4108 PWs) bands (ev): -47.5480 -47.5480 -47.5480 -47.5480 -19.6465 -19.6465 -19.6411 -19.6411 -19.4900 -19.4900 -19.4683 -19.4683 -19.4212 -19.4212 -19.4049 -19.4049 -15.6678 -15.6678 -15.6677 -15.6677 -2.9056 -2.9056 -2.9053 -2.9053 0.1036 0.1036 0.1053 0.1053 0.7100 0.7100 0.7114 0.7114 8.8457 8.8457 8.8487 8.8487 11.6430 11.6430 11.6441 11.6441 k = 0.1495 0.5002 0.8736 ( 4110 PWs) bands (ev): -47.5481 -47.5481 -47.5481 -47.5481 -19.6472 -19.6472 -19.6417 -19.6417 -19.4902 -19.4902 -19.4681 -19.4681 -19.4208 -19.4208 -19.4043 -19.4043 -15.6677 -15.6677 -15.6676 -15.6676 -2.9090 -2.9090 -2.9087 -2.9087 0.0949 0.0949 0.0965 0.0965 0.7326 0.7326 0.7339 0.7339 8.8001 8.8001 8.8031 8.8031 11.6186 11.6186 11.6194 11.6194 k = 0.1442 0.4823 0.8736 ( 4112 PWs) bands (ev): -47.5481 -47.5481 -47.5481 -47.5481 -19.6480 -19.6480 -19.6424 -19.6424 -19.4903 -19.4903 -19.4680 -19.4680 -19.4204 -19.4204 -19.4037 -19.4037 -15.6676 -15.6676 -15.6675 -15.6675 -2.9126 -2.9126 -2.9122 -2.9122 0.0856 0.0856 0.0871 0.0871 0.7564 0.7564 0.7576 0.7576 8.7556 8.7556 8.7586 8.7586 11.5942 11.5942 11.5949 11.5949 k = 0.1388 0.4644 0.8736 ( 4120 PWs) bands (ev): -47.5482 -47.5482 -47.5482 -47.5482 -19.6488 -19.6488 -19.6431 -19.6431 -19.4904 -19.4904 -19.4680 -19.4680 -19.4199 -19.4199 -19.4031 -19.4031 -15.6675 -15.6675 -15.6674 -15.6674 -2.9162 -2.9162 -2.9159 -2.9159 0.0758 0.0758 0.0772 0.0772 0.7813 0.7813 0.7824 0.7824 8.7122 8.7122 8.7152 8.7152 11.5700 11.5700 11.5705 11.5705 k = 0.1335 0.4466 0.8736 ( 4124 PWs) bands (ev): -47.5483 -47.5483 -47.5483 -47.5483 -19.6496 -19.6496 -19.6439 -19.6439 -19.4904 -19.4904 -19.4680 -19.4680 -19.4192 -19.4192 -19.4025 -19.4025 -15.6673 -15.6673 -15.6673 -15.6673 -2.9199 -2.9199 -2.9196 -2.9196 0.0656 0.0656 0.0669 0.0669 0.8071 0.8071 0.8082 0.8082 8.6698 8.6698 8.6728 8.6728 11.5461 11.5461 11.5465 11.5465 k = 0.1282 0.4287 0.8736 ( 4128 PWs) bands (ev): -47.5484 -47.5484 -47.5484 -47.5484 -19.6504 -19.6504 -19.6448 -19.6448 -19.4904 -19.4904 -19.4682 -19.4682 -19.4185 -19.4185 -19.4019 -19.4019 -15.6672 -15.6672 -15.6672 -15.6672 -2.9237 -2.9237 -2.9234 -2.9234 0.0550 0.0550 0.0563 0.0563 0.8338 0.8338 0.8348 0.8348 8.6285 8.6285 8.6315 8.6315 11.5226 11.5226 11.5229 11.5229 k = 0.1228 0.4109 0.8736 ( 4120 PWs) bands (ev): -47.5485 -47.5485 -47.5485 -47.5485 -19.6511 -19.6511 -19.6456 -19.6456 -19.4903 -19.4903 -19.4684 -19.4684 -19.4176 -19.4176 -19.4012 -19.4012 -15.6671 -15.6671 -15.6670 -15.6670 -2.9275 -2.9275 -2.9272 -2.9272 0.0442 0.0442 0.0454 0.0454 0.8612 0.8612 0.8621 0.8621 8.5883 8.5883 8.5912 8.5912 11.4995 11.4995 11.4997 11.4997 k = 0.1175 0.3930 0.8736 ( 4126 PWs) bands (ev): -47.5486 -47.5486 -47.5486 -47.5486 -19.6519 -19.6519 -19.6465 -19.6465 -19.4902 -19.4902 -19.4687 -19.4687 -19.4167 -19.4167 -19.4006 -19.4006 -15.6670 -15.6670 -15.6669 -15.6669 -2.9314 -2.9314 -2.9311 -2.9311 0.0331 0.0331 0.0343 0.0343 0.8890 0.8890 0.8899 0.8899 8.5492 8.5492 8.5521 8.5521 11.4768 11.4768 11.4769 11.4769 k = 0.1121 0.3751 0.8736 ( 4126 PWs) bands (ev): -47.5487 -47.5487 -47.5487 -47.5487 -19.6528 -19.6528 -19.6474 -19.6474 -19.4900 -19.4900 -19.4691 -19.4691 -19.4156 -19.4156 -19.4000 -19.4000 -15.6668 -15.6668 -15.6668 -15.6668 -2.9352 -2.9352 -2.9349 -2.9349 0.0220 0.0220 0.0232 0.0232 0.9173 0.9173 0.9180 0.9180 8.5113 8.5113 8.5141 8.5141 11.4547 11.4547 11.4547 11.4547 k = 0.1068 0.3573 0.8736 ( 4134 PWs) bands (ev): -47.5487 -47.5487 -47.5487 -47.5487 -19.6536 -19.6536 -19.6483 -19.6483 -19.4899 -19.4899 -19.4695 -19.4695 -19.4146 -19.4146 -19.3994 -19.3994 -15.6667 -15.6667 -15.6666 -15.6666 -2.9390 -2.9390 -2.9388 -2.9388 0.0109 0.0109 0.0120 0.0120 0.9457 0.9457 0.9464 0.9464 8.4745 8.4745 8.4772 8.4772 11.4330 11.4330 11.4330 11.4330 k = 0.1015 0.3394 0.8736 ( 4130 PWs) bands (ev): -47.5488 -47.5488 -47.5488 -47.5488 -19.6544 -19.6544 -19.6493 -19.6493 -19.4897 -19.4897 -19.4700 -19.4700 -19.4134 -19.4134 -19.3988 -19.3988 -15.6666 -15.6666 -15.6665 -15.6665 -2.9428 -2.9428 -2.9425 -2.9425 -0.0002 -0.0002 0.0008 0.0008 0.9742 0.9742 0.9748 0.9748 8.4389 8.4389 8.4416 8.4416 11.4119 11.4119 11.4120 11.4120 k = 0.0961 0.3215 0.8736 ( 4138 PWs) bands (ev): -47.5489 -47.5489 -47.5489 -47.5489 -19.6552 -19.6552 -19.6503 -19.6503 -19.4895 -19.4895 -19.4705 -19.4705 -19.4123 -19.4123 -19.3982 -19.3982 -15.6664 -15.6664 -15.6664 -15.6664 -2.9465 -2.9465 -2.9463 -2.9463 -0.0112 -0.0112 -0.0102 -0.0102 1.0025 1.0025 1.0031 1.0031 8.4046 8.4046 8.4072 8.4072 11.3915 11.3915 11.3916 11.3916 k = 0.0908 0.3037 0.8736 ( 4138 PWs) bands (ev): -47.5490 -47.5490 -47.5490 -47.5490 -19.6560 -19.6560 -19.6513 -19.6513 -19.4892 -19.4892 -19.4711 -19.4711 -19.4111 -19.4111 -19.3976 -19.3976 -15.6663 -15.6663 -15.6663 -15.6663 -2.9501 -2.9501 -2.9499 -2.9499 -0.0220 -0.0220 -0.0210 -0.0210 1.0305 1.0305 1.0311 1.0311 8.3716 8.3716 8.3741 8.3741 11.3717 11.3717 11.3719 11.3719 k = 0.0854 0.2858 0.8736 ( 4130 PWs) bands (ev): -47.5490 -47.5490 -47.5490 -47.5490 -19.6567 -19.6567 -19.6522 -19.6522 -19.4889 -19.4889 -19.4716 -19.4716 -19.4099 -19.4099 -19.3971 -19.3971 -15.6662 -15.6662 -15.6661 -15.6661 -2.9537 -2.9537 -2.9534 -2.9534 -0.0325 -0.0325 -0.0316 -0.0316 1.0581 1.0581 1.0586 1.0586 8.3400 8.3400 8.3424 8.3424 11.3527 11.3527 11.3529 11.3529 k = 0.0801 0.2680 0.8736 ( 4126 PWs) bands (ev): -47.5491 -47.5491 -47.5491 -47.5491 -19.6574 -19.6574 -19.6531 -19.6531 -19.4886 -19.4886 -19.4722 -19.4722 -19.4086 -19.4086 -19.3965 -19.3965 -15.6661 -15.6661 -15.6660 -15.6660 -2.9571 -2.9571 -2.9569 -2.9569 -0.0426 -0.0426 -0.0418 -0.0418 1.0850 1.0850 1.0855 1.0855 8.3098 8.3098 8.3121 8.3121 11.3344 11.3344 11.3347 11.3347 k = 0.0748 0.2501 0.8736 ( 4126 PWs) bands (ev): -47.5492 -47.5492 -47.5492 -47.5492 -19.6581 -19.6581 -19.6540 -19.6540 -19.4882 -19.4882 -19.4728 -19.4728 -19.4075 -19.4075 -19.3961 -19.3961 -15.6659 -15.6659 -15.6659 -15.6659 -2.9603 -2.9603 -2.9601 -2.9601 -0.0524 -0.0524 -0.0517 -0.0517 1.1112 1.1112 1.1116 1.1116 8.2811 8.2811 8.2833 8.2833 11.3170 11.3170 11.3173 11.3173 k = 0.0694 0.2322 0.8736 ( 4118 PWs) bands (ev): -47.5492 -47.5492 -47.5492 -47.5492 -19.6588 -19.6588 -19.6549 -19.6549 -19.4878 -19.4878 -19.4734 -19.4734 -19.4062 -19.4062 -19.3956 -19.3956 -15.6658 -15.6658 -15.6658 -15.6658 -2.9634 -2.9634 -2.9633 -2.9633 -0.0618 -0.0618 -0.0611 -0.0611 1.1364 1.1364 1.1367 1.1367 8.2540 8.2540 8.2561 8.2561 11.3005 11.3005 11.3008 11.3008 k = 0.0641 0.2144 0.8736 ( 4114 PWs) bands (ev): -47.5493 -47.5493 -47.5493 -47.5493 -19.6594 -19.6594 -19.6558 -19.6558 -19.4875 -19.4875 -19.4740 -19.4740 -19.4050 -19.4050 -19.3952 -19.3952 -15.6657 -15.6657 -15.6657 -15.6657 -2.9664 -2.9664 -2.9662 -2.9662 -0.0707 -0.0707 -0.0700 -0.0700 1.1604 1.1604 1.1608 1.1608 8.2285 8.2285 8.2304 8.2304 11.2849 11.2849 11.2852 11.2852 k = 0.0587 0.1965 0.8736 ( 4114 PWs) bands (ev): -47.5494 -47.5494 -47.5494 -47.5494 -19.6600 -19.6600 -19.6566 -19.6566 -19.4871 -19.4871 -19.4747 -19.4747 -19.4039 -19.4039 -19.3948 -19.3948 -15.6656 -15.6656 -15.6656 -15.6656 -2.9692 -2.9692 -2.9690 -2.9690 -0.0790 -0.0790 -0.0784 -0.0784 1.1832 1.1832 1.1835 1.1835 8.2047 8.2047 8.2065 8.2065 11.2703 11.2703 11.2706 11.2706 k = 0.0534 0.1786 0.8736 ( 4118 PWs) bands (ev): -47.5494 -47.5494 -47.5494 -47.5494 -19.6605 -19.6605 -19.6575 -19.6575 -19.4866 -19.4866 -19.4753 -19.4753 -19.4028 -19.4028 -19.3945 -19.3945 -15.6655 -15.6655 -15.6655 -15.6655 -2.9718 -2.9718 -2.9716 -2.9716 -0.0868 -0.0868 -0.0862 -0.0862 1.2046 1.2046 1.2049 1.2049 8.1826 8.1826 8.1843 8.1843 11.2568 11.2568 11.2571 11.2571 k = 0.0481 0.1608 0.8736 ( 4106 PWs) bands (ev): -47.5494 -47.5494 -47.5494 -47.5494 -19.6610 -19.6610 -19.6582 -19.6582 -19.4862 -19.4862 -19.4760 -19.4760 -19.4017 -19.4017 -19.3942 -19.3942 -15.6654 -15.6654 -15.6654 -15.6654 -2.9741 -2.9741 -2.9740 -2.9740 -0.0939 -0.0939 -0.0934 -0.0934 1.2245 1.2245 1.2247 1.2247 8.1624 8.1624 8.1639 8.1639 11.2443 11.2443 11.2447 11.2447 k = 0.0427 0.1429 0.8736 ( 4094 PWs) bands (ev): -47.5495 -47.5495 -47.5495 -47.5495 -19.6614 -19.6614 -19.6589 -19.6589 -19.4857 -19.4857 -19.4766 -19.4766 -19.4006 -19.4006 -19.3940 -19.3940 -15.6654 -15.6654 -15.6653 -15.6653 -2.9763 -2.9763 -2.9762 -2.9762 -0.1004 -0.1004 -0.1000 -0.1000 1.2427 1.2427 1.2429 1.2429 8.1441 8.1441 8.1455 8.1455 11.2331 11.2331 11.2334 11.2334 k = 0.0374 0.1250 0.8736 ( 4098 PWs) bands (ev): -47.5495 -47.5495 -47.5495 -47.5495 -19.6618 -19.6618 -19.6596 -19.6596 -19.4852 -19.4852 -19.4772 -19.4772 -19.3996 -19.3996 -19.3938 -19.3938 -15.6653 -15.6653 -15.6653 -15.6653 -2.9782 -2.9782 -2.9781 -2.9781 -0.1062 -0.1062 -0.1058 -0.1058 1.2590 1.2590 1.2591 1.2591 8.1278 8.1278 8.1290 8.1290 11.2230 11.2230 11.2233 11.2233 k = 0.0320 0.1072 0.8736 ( 4102 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6621 -19.6621 -19.6602 -19.6602 -19.4848 -19.4848 -19.4779 -19.4779 -19.3988 -19.3988 -19.3938 -19.3938 -15.6652 -15.6652 -15.6652 -15.6652 -2.9799 -2.9799 -2.9798 -2.9798 -0.1113 -0.1113 -0.1110 -0.1110 1.2733 1.2733 1.2735 1.2735 8.1136 8.1136 8.1146 8.1146 11.2141 11.2141 11.2144 11.2144 k = 0.0267 0.0893 0.8736 ( 4110 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6623 -19.6623 -19.6608 -19.6608 -19.4843 -19.4843 -19.4786 -19.4786 -19.3980 -19.3980 -19.3938 -19.3938 -15.6652 -15.6652 -15.6652 -15.6652 -2.9813 -2.9813 -2.9813 -2.9813 -0.1157 -0.1157 -0.1154 -0.1154 1.2857 1.2857 1.2858 1.2858 8.1014 8.1014 8.1023 8.1023 11.2066 11.2066 11.2068 11.2068 k = 0.0214 0.0715 0.8736 ( 4122 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6625 -19.6625 -19.6613 -19.6613 -19.4838 -19.4838 -19.4793 -19.4793 -19.3973 -19.3973 -19.3940 -19.3940 -15.6651 -15.6651 -15.6651 -15.6651 -2.9825 -2.9825 -2.9825 -2.9825 -0.1192 -0.1192 -0.1190 -0.1190 1.2959 1.2959 1.2960 1.2960 8.0914 8.0914 8.0921 8.0921 11.2004 11.2004 11.2006 11.2006 k = 0.0160 0.0536 0.8736 ( 4126 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6626 -19.6626 -19.6617 -19.6617 -19.4833 -19.4833 -19.4799 -19.4799 -19.3966 -19.3966 -19.3942 -19.3942 -15.6651 -15.6651 -15.6651 -15.6651 -2.9835 -2.9835 -2.9834 -2.9834 -0.1220 -0.1220 -0.1219 -0.1219 1.3039 1.3039 1.3040 1.3040 8.0836 8.0836 8.0841 8.0841 11.1955 11.1955 11.1957 11.1957 k = 0.0107 0.0357 0.8736 ( 4118 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6626 -19.6626 -19.6620 -19.6620 -19.4827 -19.4827 -19.4805 -19.4805 -19.3960 -19.3960 -19.3943 -19.3943 -15.6651 -15.6651 -15.6651 -15.6651 -2.9841 -2.9841 -2.9841 -2.9841 -0.1240 -0.1240 -0.1239 -0.1239 1.3097 1.3097 1.3097 1.3097 8.0780 8.0780 8.0784 8.0784 11.1920 11.1920 11.1921 11.1921 k = 0.0053 0.0179 0.8736 ( 4118 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6626 -19.6626 -19.6623 -19.6623 -19.4822 -19.4822 -19.4811 -19.4811 -19.3954 -19.3954 -19.3946 -19.3946 -15.6651 -15.6651 -15.6651 -15.6651 -2.9845 -2.9845 -2.9845 -2.9845 -0.1252 -0.1252 -0.1252 -0.1252 1.3132 1.3132 1.3132 1.3132 8.0747 8.0747 8.0749 8.0749 11.1900 11.1900 11.1900 11.1900 k = 0.0000 0.0000 0.8736 ( 4124 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6625 -19.6625 -19.6625 -19.6625 -19.4816 -19.4816 -19.4816 -19.4816 -19.3950 -19.3950 -19.3950 -19.3950 -15.6651 -15.6651 -15.6651 -15.6651 -2.9846 -2.9846 -2.9846 -2.9846 -0.1256 -0.1256 -0.1256 -0.1256 1.3143 1.3143 1.3143 1.3143 8.0736 8.0736 8.0736 8.0736 11.1893 11.1893 11.1893 11.1893 k = 0.0000 0.0000 0.8736 ( 4124 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6625 -19.6625 -19.6625 -19.6625 -19.4816 -19.4816 -19.4816 -19.4816 -19.3950 -19.3950 -19.3950 -19.3950 -15.6651 -15.6651 -15.6651 -15.6651 -2.9846 -2.9846 -2.9846 -2.9846 -0.1256 -0.1256 -0.1256 -0.1256 1.3143 1.3143 1.3143 1.3143 8.0736 8.0736 8.0736 8.0736 11.1893 11.1893 11.1893 11.1893 k = 0.0000 0.0000 0.8550 ( 4116 PWs) bands (ev): -47.5499 -47.5499 -47.5494 -47.5494 -19.6631 -19.6631 -19.6617 -19.6617 -19.4823 -19.4823 -19.4809 -19.4809 -19.3956 -19.3956 -19.3943 -19.3943 -15.6718 -15.6718 -15.6587 -15.6587 -3.0092 -3.0092 -2.9604 -2.9604 -0.1251 -0.1251 -0.1235 -0.1235 1.3143 1.3143 1.3144 1.3144 7.9666 7.9666 8.1814 8.1814 11.1377 11.1377 11.2421 11.2421 k = 0.0000 0.0000 0.8364 ( 4116 PWs) bands (ev): -47.5502 -47.5502 -47.5492 -47.5492 -19.6636 -19.6636 -19.6609 -19.6609 -19.4829 -19.4829 -19.4801 -19.4801 -19.3963 -19.3963 -19.3937 -19.3937 -15.6789 -15.6789 -15.6528 -15.6528 -3.0340 -3.0340 -2.9365 -2.9365 -0.1221 -0.1221 -0.1189 -0.1189 1.3142 1.3142 1.3144 1.3144 7.8604 7.8604 8.2898 8.2898 11.0874 11.0874 11.2961 11.2961 k = 0.0000 0.0000 0.8178 ( 4118 PWs) bands (ev): -47.5504 -47.5504 -47.5490 -47.5490 -19.6641 -19.6641 -19.6599 -19.6599 -19.4834 -19.4834 -19.4792 -19.4792 -19.3970 -19.3970 -19.3930 -19.3930 -15.6863 -15.6863 -15.6473 -15.6473 -3.0590 -3.0590 -2.9130 -2.9130 -0.1165 -0.1165 -0.1117 -0.1117 1.3140 1.3140 1.3144 1.3144 7.7550 7.7550 8.3990 8.3990 11.0386 11.0386 11.3511 11.3511 k = 0.0000 0.0000 0.7993 ( 4118 PWs) bands (ev): -47.5507 -47.5507 -47.5488 -47.5488 -19.6644 -19.6644 -19.6588 -19.6588 -19.4839 -19.4839 -19.4782 -19.4782 -19.3976 -19.3976 -19.3923 -19.3923 -15.6942 -15.6942 -15.6422 -15.6422 -3.0843 -3.0843 -2.8898 -2.8898 -0.1085 -0.1085 -0.1019 -0.1019 1.3138 1.3138 1.3144 1.3144 7.6503 7.6503 8.5089 8.5089 10.9911 10.9911 11.4069 11.4069 k = 0.0000 0.0000 0.7807 ( 4118 PWs) bands (ev): -47.5509 -47.5509 -47.5486 -47.5486 -19.6646 -19.6646 -19.6576 -19.6576 -19.4842 -19.4842 -19.4772 -19.4772 -19.3983 -19.3983 -19.3917 -19.3917 -15.7024 -15.7024 -15.6375 -15.6375 -3.1098 -3.1098 -2.8671 -2.8671 -0.0981 -0.0981 -0.0896 -0.0896 1.3136 1.3136 1.3143 1.3143 7.5464 7.5464 8.6194 8.6194 10.9451 10.9451 11.4635 11.4635 k = 0.0000 0.0000 0.7621 ( 4112 PWs) bands (ev): -47.5512 -47.5512 -47.5484 -47.5484 -19.6647 -19.6647 -19.6562 -19.6562 -19.4845 -19.4845 -19.4761 -19.4761 -19.3989 -19.3989 -19.3909 -19.3909 -15.7109 -15.7109 -15.6332 -15.6332 -3.1353 -3.1353 -2.8448 -2.8448 -0.0852 -0.0852 -0.0747 -0.0747 1.3134 1.3134 1.3142 1.3142 7.4433 7.4433 8.7306 8.7306 10.9006 10.9006 11.5205 11.5205 k = 0.0000 0.0000 0.7435 ( 4104 PWs) bands (ev): -47.5514 -47.5514 -47.5482 -47.5482 -19.6648 -19.6648 -19.6548 -19.6548 -19.4847 -19.4847 -19.4750 -19.4750 -19.3995 -19.3995 -19.3902 -19.3902 -15.7197 -15.7197 -15.6293 -15.6293 -3.1610 -3.1610 -2.8229 -2.8229 -0.0700 -0.0700 -0.0573 -0.0573 1.3131 1.3131 1.3141 1.3141 7.3410 7.3410 8.8423 8.8423 10.8576 10.8576 11.5776 11.5776 k = 0.0000 0.0000 0.7249 ( 4096 PWs) bands (ev): -47.5517 -47.5517 -47.5480 -47.5480 -19.6647 -19.6647 -19.6533 -19.6533 -19.4848 -19.4848 -19.4738 -19.4738 -19.4001 -19.4001 -19.3895 -19.3895 -15.7289 -15.7289 -15.6258 -15.6258 -3.1868 -3.1868 -2.8015 -2.8015 -0.0525 -0.0525 -0.0375 -0.0375 1.3128 1.3128 1.3139 1.3139 7.2394 7.2394 8.9545 8.9545 10.8160 10.8160 11.6346 11.6346 k = 0.0000 0.0000 0.7063 ( 4098 PWs) bands (ev): -47.5520 -47.5520 -47.5478 -47.5478 -19.6645 -19.6645 -19.6518 -19.6518 -19.4848 -19.4848 -19.4726 -19.4726 -19.4007 -19.4007 -19.3888 -19.3888 -15.7383 -15.7383 -15.6228 -15.6228 -3.2126 -3.2126 -2.7805 -2.7805 -0.0328 -0.0328 -0.0152 -0.0152 1.3125 1.3125 1.3137 1.3137 7.1387 7.1387 9.0672 9.0672 10.7760 10.7760 11.6908 11.6908 k = 0.0000 0.0000 0.6877 ( 4102 PWs) bands (ev): -47.5523 -47.5523 -47.5476 -47.5476 -19.6643 -19.6643 -19.6501 -19.6501 -19.4848 -19.4848 -19.4713 -19.4713 -19.4012 -19.4012 -19.3882 -19.3882 -15.7480 -15.7480 -15.6201 -15.6201 -3.2383 -3.2383 -2.7601 -2.7601 -0.0110 -0.0110 0.0095 0.0095 1.3122 1.3122 1.3135 1.3135 7.0388 7.0388 9.1801 9.1801 10.7374 10.7374 11.7456 11.7456 k = 0.0000 0.0000 0.6691 ( 4114 PWs) bands (ev): -47.5526 -47.5526 -47.5475 -47.5475 -19.6641 -19.6641 -19.6485 -19.6485 -19.4847 -19.4847 -19.4700 -19.4700 -19.4018 -19.4018 -19.3876 -19.3876 -15.7579 -15.7579 -15.6177 -15.6177 -3.2640 -3.2640 -2.7402 -2.7402 0.0129 0.0129 0.0365 0.0365 1.3118 1.3118 1.3132 1.3132 6.9397 6.9397 9.2932 9.2932 10.7003 10.7003 11.7984 11.7984 k = 0.0000 0.0000 0.6506 ( 4110 PWs) bands (ev): -47.5528 -47.5528 -47.5473 -47.5473 -19.6638 -19.6638 -19.6467 -19.6467 -19.4845 -19.4845 -19.4687 -19.4687 -19.4022 -19.4022 -19.3869 -19.3869 -15.7680 -15.7680 -15.6158 -15.6158 -3.2896 -3.2896 -2.7207 -2.7207 0.0389 0.0389 0.0659 0.0659 1.3115 1.3115 1.3129 1.3129 6.8414 6.8414 9.4063 9.4063 10.6646 10.6646 11.8480 11.8480 k = 0.0000 0.0000 0.6320 ( 4111 PWs) bands (ev): -47.5531 -47.5531 -47.5472 -47.5472 -19.6634 -19.6634 -19.6449 -19.6449 -19.4842 -19.4842 -19.4673 -19.4673 -19.4027 -19.4027 -19.3862 -19.3862 -15.7784 -15.7784 -15.6142 -15.6142 -3.3151 -3.3151 -2.7018 -2.7018 0.0667 0.0667 0.0975 0.0975 1.3111 1.3111 1.3126 1.3126 6.7440 6.7440 9.5191 9.5191 10.6303 10.6303 11.8931 11.8931 k = 0.0000 0.0000 0.6134 ( 4107 PWs) bands (ev): -47.5534 -47.5534 -47.5470 -47.5470 -19.6629 -19.6629 -19.6430 -19.6430 -19.4838 -19.4838 -19.4658 -19.4658 -19.4030 -19.4030 -19.3855 -19.3855 -15.7888 -15.7888 -15.6130 -15.6130 -3.3403 -3.3403 -2.6834 -2.6834 0.0963 0.0963 0.1313 0.1313 1.3107 1.3107 1.3123 1.3123 6.6474 6.6474 9.6314 9.6314 10.5974 10.5974 11.9321 11.9321 k = 0.0000 0.0000 0.5948 ( 4115 PWs) bands (ev): -47.5537 -47.5537 -47.5469 -47.5469 -19.6625 -19.6625 -19.6411 -19.6411 -19.4834 -19.4834 -19.4643 -19.4643 -19.4034 -19.4034 -19.3849 -19.3849 -15.7995 -15.7995 -15.6121 -15.6121 -3.3654 -3.3654 -2.6656 -2.6656 0.1277 0.1277 0.1671 0.1671 1.3102 1.3102 1.3119 1.3119 6.5517 6.5517 9.7427 9.7427 10.5659 10.5659 11.9632 11.9632 k = 0.0000 0.0000 0.5762 ( 4111 PWs) bands (ev): -47.5539 -47.5539 -47.5468 -47.5468 -19.6620 -19.6620 -19.6391 -19.6391 -19.4829 -19.4829 -19.4628 -19.4628 -19.4037 -19.4037 -19.3842 -19.3842 -15.8102 -15.8102 -15.6115 -15.6115 -3.3901 -3.3901 -2.6482 -2.6482 0.1606 0.1606 0.2050 0.2050 1.3098 1.3098 1.3115 1.3115 6.4569 6.4569 9.8527 9.8527 10.5357 10.5357 11.9845 11.9845 k = 0.0000 0.0000 0.5576 ( 4119 PWs) bands (ev): -47.5542 -47.5542 -47.5466 -47.5466 -19.6615 -19.6615 -19.6371 -19.6371 -19.4823 -19.4823 -19.4613 -19.4613 -19.4040 -19.4040 -19.3836 -19.3836 -15.8210 -15.8210 -15.6112 -15.6112 -3.4146 -3.4146 -2.6315 -2.6315 0.1950 0.1950 0.2448 0.2448 1.3093 1.3093 1.3110 1.3110 6.3630 6.3630 9.9607 9.9607 10.5067 10.5067 11.9948 11.9948 k = 0.0000 0.0000 0.5390 ( 4121 PWs) bands (ev): -47.5545 -47.5545 -47.5465 -47.5465 -19.6610 -19.6610 -19.6352 -19.6352 -19.4817 -19.4817 -19.4597 -19.4597 -19.4042 -19.4042 -19.3830 -19.3830 -15.8319 -15.8319 -15.6112 -15.6112 -3.4387 -3.4387 -2.6153 -2.6153 0.2308 0.2308 0.2865 0.2865 1.3089 1.3089 1.3106 1.3106 6.2700 6.2700 10.0658 10.0658 10.4790 10.4790 11.9943 11.9943 k = 0.0000 0.0000 0.5204 ( 4121 PWs) bands (ev): -47.5548 -47.5548 -47.5464 -47.5464 -19.6605 -19.6605 -19.6332 -19.6332 -19.4811 -19.4811 -19.4581 -19.4581 -19.4043 -19.4043 -19.3822 -19.3822 -15.8428 -15.8428 -15.6114 -15.6114 -3.4624 -3.4624 -2.5996 -2.5996 0.2678 0.2678 0.3299 0.3299 1.3085 1.3085 1.3102 1.3102 6.1780 6.1780 10.1672 10.1672 10.4526 10.4526 11.9846 11.9846 k = 0.0000 0.0000 0.5019 ( 4125 PWs) bands (ev): -47.5551 -47.5551 -47.5463 -47.5463 -19.6600 -19.6600 -19.6312 -19.6312 -19.4804 -19.4804 -19.4564 -19.4564 -19.4044 -19.4044 -19.3815 -19.3815 -15.8537 -15.8537 -15.6119 -15.6119 -3.4857 -3.4857 -2.5845 -2.5845 0.3058 0.3058 0.3749 0.3749 1.3080 1.3080 1.3097 1.3097 6.0871 6.0871 10.2635 10.2635 10.4273 10.4273 11.9684 11.9684 k = 0.0000 0.0000 0.4833 ( 4119 PWs) bands (ev): -47.5553 -47.5553 -47.5462 -47.5462 -19.6595 -19.6595 -19.6292 -19.6292 -19.4797 -19.4797 -19.4547 -19.4547 -19.4044 -19.4044 -19.3807 -19.3807 -15.8645 -15.8645 -15.6127 -15.6127 -3.5086 -3.5086 -2.5700 -2.5700 0.3448 0.3448 0.4214 0.4214 1.3076 1.3076 1.3093 1.3093 5.9972 5.9972 10.3532 10.3532 10.4033 10.4033 11.9496 11.9496 k = 0.0000 0.0000 0.4647 ( 4123 PWs) bands (ev): -47.5556 -47.5556 -47.5461 -47.5461 -19.6591 -19.6591 -19.6272 -19.6272 -19.4790 -19.4790 -19.4531 -19.4531 -19.4044 -19.4044 -19.3799 -19.3799 -15.8753 -15.8753 -15.6136 -15.6136 -3.5308 -3.5308 -2.5560 -2.5560 0.3847 0.3847 0.4693 0.4693 1.3071 1.3071 1.3088 1.3088 5.9085 5.9085 10.3800 10.3800 10.4348 10.4348 11.9319 11.9319 k = 0.0000 0.0000 0.4461 ( 4127 PWs) bands (ev): -47.5559 -47.5559 -47.5460 -47.5460 -19.6586 -19.6586 -19.6252 -19.6252 -19.4783 -19.4783 -19.4514 -19.4514 -19.4044 -19.4044 -19.3792 -19.3792 -15.8860 -15.8860 -15.6147 -15.6147 -3.5526 -3.5526 -2.5426 -2.5426 0.4251 0.4251 0.5184 0.5184 1.3067 1.3067 1.3083 1.3083 5.8209 5.8209 10.3581 10.3581 10.5056 10.5056 11.9191 11.9191 k = 0.0000 0.0000 0.4275 ( 4133 PWs) bands (ev): -47.5561 -47.5561 -47.5460 -47.5460 -19.6582 -19.6582 -19.6233 -19.6233 -19.4776 -19.4776 -19.4497 -19.4497 -19.4043 -19.4043 -19.3784 -19.3784 -15.8965 -15.8965 -15.6160 -15.6160 -3.5737 -3.5737 -2.5298 -2.5298 0.4660 0.4660 0.5686 0.5686 1.3062 1.3062 1.3078 1.3078 5.7346 5.7346 10.3372 10.3372 10.5638 10.5638 11.9144 11.9144 k = 0.0000 0.0000 0.4089 ( 4125 PWs) bands (ev): -47.5564 -47.5564 -47.5459 -47.5459 -19.6577 -19.6577 -19.6214 -19.6214 -19.4769 -19.4769 -19.4479 -19.4479 -19.4041 -19.4041 -19.3775 -19.3775 -15.9069 -15.9069 -15.6174 -15.6174 -3.5942 -3.5942 -2.5175 -2.5175 0.5072 0.5072 0.6198 0.6198 1.3058 1.3058 1.3073 1.3073 5.6497 5.6497 10.3174 10.3174 10.6078 10.6078 11.9204 11.9204 k = 0.0000 0.0000 0.3903 ( 4127 PWs) bands (ev): -47.5566 -47.5566 -47.5458 -47.5458 -19.6574 -19.6574 -19.6195 -19.6195 -19.4762 -19.4762 -19.4462 -19.4462 -19.4040 -19.4040 -19.3766 -19.3766 -15.9171 -15.9171 -15.6190 -15.6190 -3.6141 -3.6141 -2.5058 -2.5058 0.5485 0.5485 0.6718 0.6718 1.3053 1.3053 1.3068 1.3068 5.5661 5.5661 10.2986 10.2986 10.6364 10.6364 11.9384 11.9384 k = 0.0000 0.0000 0.3717 ( 4119 PWs) bands (ev): -47.5568 -47.5568 -47.5457 -47.5457 -19.6570 -19.6570 -19.6177 -19.6177 -19.4755 -19.4755 -19.4444 -19.4444 -19.4038 -19.4038 -19.3756 -19.3756 -15.9270 -15.9270 -15.6207 -15.6207 -3.6332 -3.6332 -2.4946 -2.4946 0.5898 0.5898 0.7243 0.7243 1.3049 1.3049 1.3063 1.3063 5.4841 5.4841 10.2807 10.2807 10.6498 10.6498 11.9684 11.9684 k = 0.0000 0.0000 0.3532 ( 4123 PWs) bands (ev): -47.5571 -47.5571 -47.5457 -47.5457 -19.6566 -19.6566 -19.6159 -19.6159 -19.4749 -19.4749 -19.4427 -19.4427 -19.4036 -19.4036 -19.3747 -19.3747 -15.9367 -15.9367 -15.6224 -15.6224 -3.6517 -3.6517 -2.4840 -2.4840 0.6309 0.6309 0.7772 0.7772 1.3045 1.3045 1.3058 1.3058 5.4038 5.4038 10.2638 10.2638 10.6492 10.6492 12.0091 12.0091 k = 0.0000 0.0000 0.3346 ( 4115 PWs) bands (ev): -47.5573 -47.5573 -47.5456 -47.5456 -19.6563 -19.6563 -19.6142 -19.6142 -19.4743 -19.4743 -19.4409 -19.4409 -19.4034 -19.4034 -19.3736 -19.3736 -15.9461 -15.9461 -15.6242 -15.6242 -3.6693 -3.6693 -2.4740 -2.4740 0.6715 0.6715 0.8302 0.8302 1.3041 1.3041 1.3054 1.3054 5.3252 5.3252 10.2478 10.2478 10.6367 10.6367 12.0583 12.0583 k = 0.0000 0.0000 0.3160 ( 4113 PWs) bands (ev): -47.5575 -47.5575 -47.5456 -47.5456 -19.6561 -19.6561 -19.6126 -19.6126 -19.4738 -19.4738 -19.4392 -19.4392 -19.4032 -19.4032 -19.3725 -19.3725 -15.9552 -15.9552 -15.6260 -15.6260 -3.6862 -3.6862 -2.4645 -2.4645 0.7115 0.7115 0.8832 0.8832 1.3037 1.3037 1.3049 1.3049 5.2486 5.2486 10.2328 10.2328 10.6147 10.6147 12.1131 12.1131 k = 0.0000 0.0000 0.2974 ( 4117 PWs) bands (ev): -47.5577 -47.5577 -47.5455 -47.5455 -19.6559 -19.6559 -19.6110 -19.6110 -19.4733 -19.4733 -19.4375 -19.4375 -19.4031 -19.4031 -19.3714 -19.3714 -15.9639 -15.9639 -15.6279 -15.6279 -3.7023 -3.7023 -2.4556 -2.4556 0.7506 0.7506 0.9359 0.9359 1.3033 1.3033 1.3045 1.3045 5.1740 5.1740 10.2186 10.2186 10.5856 10.5856 12.1710 12.1710 k = 0.0000 0.0000 0.2788 ( 4119 PWs) bands (ev): -47.5579 -47.5579 -47.5455 -47.5455 -19.6557 -19.6557 -19.6095 -19.6095 -19.4729 -19.4729 -19.4359 -19.4359 -19.4030 -19.4030 -19.3703 -19.3703 -15.9723 -15.9723 -15.6297 -15.6297 -3.7175 -3.7175 -2.4473 -2.4473 0.7887 0.7887 0.9880 0.9880 1.3030 1.3030 1.3040 1.3040 5.1018 5.1018 10.2053 10.2053 10.5514 10.5514 12.2295 12.2295 k = 0.0000 0.0000 0.2602 ( 4123 PWs) bands (ev): -47.5581 -47.5581 -47.5455 -47.5455 -19.6555 -19.6555 -19.6081 -19.6081 -19.4725 -19.4725 -19.4342 -19.4342 -19.4030 -19.4030 -19.3692 -19.3692 -15.9803 -15.9803 -15.6315 -15.6315 -3.7319 -3.7319 -2.4395 -2.4395 0.8255 0.8255 1.0392 1.0392 1.3026 1.3026 1.3037 1.3037 5.0321 5.0321 10.1930 10.1930 10.5140 10.5140 12.2866 12.2866 k = 0.0000 0.0000 0.2416 ( 4113 PWs) bands (ev): -47.5583 -47.5583 -47.5454 -47.5454 -19.6553 -19.6553 -19.6067 -19.6067 -19.4721 -19.4721 -19.4326 -19.4326 -19.4029 -19.4029 -19.3680 -19.3680 -15.9878 -15.9878 -15.6333 -15.6333 -3.7454 -3.7454 -2.4322 -2.4322 0.8610 0.8610 1.0893 1.0893 1.3023 1.3023 1.3034 1.3034 4.9651 4.9651 10.1815 10.1815 10.4749 10.4749 12.3408 12.3408 k = 0.0000 0.0000 0.2230 ( 4115 PWs) bands (ev): -47.5584 -47.5584 -47.5454 -47.5454 -19.6552 -19.6552 -19.6054 -19.6054 -19.4718 -19.4718 -19.4310 -19.4310 -19.4029 -19.4029 -19.3668 -19.3668 -15.9949 -15.9949 -15.6351 -15.6351 -3.7580 -3.7580 -2.4255 -2.4255 0.8948 0.8948 1.1378 1.1378 1.3020 1.3020 1.3031 1.3031 4.9011 4.9011 10.1708 10.1708 10.4352 10.4352 12.3912 12.3912 k = 0.0000 0.0000 0.2045 ( 4117 PWs) bands (ev): -47.5586 -47.5586 -47.5454 -47.5454 -19.6551 -19.6551 -19.6043 -19.6043 -19.4716 -19.4716 -19.4295 -19.4295 -19.4030 -19.4030 -19.3657 -19.3657 -16.0015 -16.0015 -15.6367 -15.6367 -3.7696 -3.7696 -2.4194 -2.4194 0.9267 0.9267 1.1844 1.1844 1.3018 1.3018 1.3030 1.3030 4.8404 4.8404 10.1610 10.1610 10.3960 10.3960 12.4370 12.4370 k = 0.0000 0.0000 0.1859 ( 4119 PWs) bands (ev): -47.5587 -47.5587 -47.5453 -47.5453 -19.6550 -19.6550 -19.6032 -19.6032 -19.4714 -19.4714 -19.4280 -19.4280 -19.4031 -19.4031 -19.3646 -19.3646 -16.0076 -16.0076 -15.6383 -15.6383 -3.7803 -3.7803 -2.4137 -2.4137 0.9567 0.9567 1.2284 1.2284 1.3015 1.3015 1.3033 1.3033 4.7833 4.7833 10.1521 10.1521 10.3581 10.3581 12.4779 12.4779 k = 0.0000 0.0000 0.1673 ( 4123 PWs) bands (ev): -47.5588 -47.5588 -47.5453 -47.5453 -19.6550 -19.6550 -19.6022 -19.6022 -19.4712 -19.4712 -19.4267 -19.4267 -19.4033 -19.4033 -19.3636 -19.3636 -16.0132 -16.0132 -15.6397 -15.6397 -3.7900 -3.7900 -2.4087 -2.4087 0.9843 0.9843 1.2685 1.2685 1.3013 1.3013 1.3050 1.3050 4.7302 4.7302 10.1440 10.1440 10.3221 10.3221 12.5139 12.5139 k = 0.0000 0.0000 0.1487 ( 4135 PWs) bands (ev): -47.5590 -47.5590 -47.5453 -47.5453 -19.6549 -19.6549 -19.6014 -19.6014 -19.4711 -19.4711 -19.4254 -19.4254 -19.4035 -19.4035 -19.3627 -19.3627 -16.0182 -16.0182 -15.6411 -15.6411 -3.7988 -3.7988 -2.4042 -2.4042 1.0096 1.0096 1.2940 1.2940 1.3011 1.3011 1.3183 1.3183 4.6813 4.6813 10.1368 10.1368 10.2886 10.2886 12.5451 12.5451 k = 0.0000 0.0000 0.1301 ( 4131 PWs) bands (ev): -47.5591 -47.5591 -47.5453 -47.5453 -19.6549 -19.6549 -19.6006 -19.6006 -19.4709 -19.4709 -19.4241 -19.4241 -19.4038 -19.4038 -19.3618 -19.3618 -16.0227 -16.0227 -15.6423 -15.6423 -3.8065 -3.8065 -2.4002 -2.4002 1.0324 1.0324 1.2983 1.2983 1.3010 1.3010 1.3496 1.3496 4.6370 4.6370 10.1304 10.1304 10.2580 10.2580 12.5717 12.5717 k = 0.0000 0.0000 0.1115 ( 4135 PWs) bands (ev): -47.5592 -47.5592 -47.5453 -47.5453 -19.6548 -19.6548 -19.5999 -19.5999 -19.4708 -19.4708 -19.4230 -19.4230 -19.4040 -19.4040 -19.3610 -19.3610 -16.0267 -16.0267 -15.6434 -15.6434 -3.8133 -3.8133 -2.3967 -2.3967 1.0525 1.0525 1.2990 1.2990 1.3008 1.3008 1.3806 1.3806 4.5977 4.5977 10.1249 10.1249 10.2308 10.2308 12.5940 12.5940 k = 0.0000 0.0000 0.0929 ( 4135 PWs) bands (ev): -47.5592 -47.5592 -47.5453 -47.5453 -19.6548 -19.6548 -19.5993 -19.5993 -19.4708 -19.4708 -19.4220 -19.4220 -19.4043 -19.4043 -19.3603 -19.3603 -16.0300 -16.0300 -15.6443 -15.6443 -3.8190 -3.8190 -2.3938 -2.3938 1.0696 1.0696 1.2992 1.2992 1.3007 1.3007 1.4081 1.4081 4.5637 4.5637 10.1202 10.1202 10.2073 10.2073 12.6122 12.6122 k = 0.0000 0.0000 0.0743 ( 4135 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6548 -19.6548 -19.5988 -19.5988 -19.4707 -19.4707 -19.4211 -19.4211 -19.4046 -19.4046 -19.3597 -19.3597 -16.0328 -16.0328 -15.6451 -15.6451 -3.8237 -3.8237 -2.3914 -2.3914 1.0839 1.0839 1.2992 1.2992 1.3007 1.3007 1.4313 1.4313 4.5354 4.5354 10.1164 10.1164 10.1877 10.1877 12.6267 12.6267 k = 0.0000 0.0000 0.0558 ( 4139 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6548 -19.6548 -19.5984 -19.5984 -19.4707 -19.4707 -19.4204 -19.4204 -19.4049 -19.4049 -19.3592 -19.3592 -16.0349 -16.0349 -15.6457 -15.6457 -3.8273 -3.8273 -2.3896 -2.3896 1.0951 1.0951 1.2992 1.2992 1.3006 1.3006 1.4497 1.4497 4.5130 4.5130 10.1134 10.1134 10.1722 10.1722 12.6377 12.6377 k = 0.0000 0.0000 0.0372 ( 4139 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5982 -19.5982 -19.4707 -19.4707 -19.4199 -19.4199 -19.4051 -19.4051 -19.3589 -19.3589 -16.0365 -16.0365 -15.6461 -15.6461 -3.8300 -3.8300 -2.3883 -2.3883 1.1031 1.1031 1.2992 1.2992 1.3006 1.3006 1.4631 1.4631 4.4969 4.4969 10.1113 10.1113 10.1611 10.1611 12.6454 12.6454 k = 0.0000 0.0000 0.0186 ( 4149 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6549 -19.6549 -19.5980 -19.5980 -19.4707 -19.4707 -19.4195 -19.4195 -19.4053 -19.4053 -19.3587 -19.3587 -16.0374 -16.0374 -15.6464 -15.6464 -3.8315 -3.8315 -2.3875 -2.3875 1.1079 1.1079 1.2992 1.2992 1.3005 1.3005 1.4712 1.4712 4.4871 4.4871 10.1100 10.1100 10.1543 10.1543 12.6499 12.6499 k = 0.0000 0.0000 0.0000 ( 4141 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5979 -19.5979 -19.4707 -19.4707 -19.4194 -19.4194 -19.4053 -19.4053 -19.3586 -19.3586 -16.0377 -16.0377 -15.6465 -15.6465 -3.8320 -3.8320 -2.3872 -2.3872 1.1096 1.1096 1.2991 1.2991 1.3005 1.3005 1.4739 1.4739 4.4838 4.4838 10.1096 10.1096 10.1521 10.1521 12.6515 12.6515 k = 0.0000 0.0000 0.0000 ( 4141 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5979 -19.5979 -19.4707 -19.4707 -19.4194 -19.4194 -19.4053 -19.4053 -19.3586 -19.3586 -16.0377 -16.0377 -15.6465 -15.6465 -3.8320 -3.8320 -2.3872 -2.3872 1.1096 1.1096 1.2991 1.2991 1.3005 1.3005 1.4739 1.4739 4.4838 4.4838 10.1096 10.1096 10.1521 10.1521 12.6515 12.6515 k =-0.0179 0.0053-0.0000 ( 4148 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5980 -19.5980 -19.4707 -19.4707 -19.4194 -19.4194 -19.4053 -19.4053 -19.3586 -19.3586 -16.0375 -16.0375 -15.6467 -15.6467 -3.8312 -3.8312 -2.3887 -2.3887 1.1098 1.1098 1.2914 1.2914 1.3083 1.3083 1.4736 1.4736 4.4863 4.4863 10.0325 10.0325 10.2278 10.2278 12.6496 12.6496 k =-0.0357 0.0107-0.0000 ( 4144 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6548 -19.6548 -19.5981 -19.5981 -19.4707 -19.4707 -19.4195 -19.4195 -19.4053 -19.4053 -19.3586 -19.3586 -16.0367 -16.0367 -15.6474 -15.6474 -3.8286 -3.8286 -2.3932 -2.3932 1.1106 1.1106 1.2831 1.2831 1.3167 1.3167 1.4727 1.4727 4.4936 4.4936 9.9364 9.9364 10.3199 10.3199 12.6439 12.6439 k =-0.0536 0.0160-0.0000 ( 4140 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6547 -19.6547 -19.5982 -19.5982 -19.4706 -19.4706 -19.4195 -19.4195 -19.4053 -19.4053 -19.3586 -19.3586 -16.0355 -16.0355 -15.6485 -15.6485 -3.8244 -3.8244 -2.4006 -2.4006 1.1119 1.1119 1.2748 1.2748 1.3252 1.3252 1.4712 1.4712 4.5057 4.5057 9.8384 9.8384 10.4113 10.4113 12.6348 12.6348 k =-0.0714 0.0214-0.0000 ( 4140 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6546 -19.6546 -19.5984 -19.5984 -19.4706 -19.4706 -19.4196 -19.4196 -19.4053 -19.4053 -19.3586 -19.3586 -16.0338 -16.0338 -15.6500 -15.6500 -3.8184 -3.8184 -2.4110 -2.4110 1.1137 1.1137 1.2667 1.2667 1.3335 1.3335 1.4692 1.4692 4.5226 4.5226 9.7393 9.7393 10.5013 10.5013 12.6225 12.6225 k =-0.0893 0.0267-0.0000 ( 4138 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6545 -19.6545 -19.5986 -19.5986 -19.4705 -19.4705 -19.4197 -19.4197 -19.4053 -19.4053 -19.3586 -19.3586 -16.0316 -16.0316 -15.6520 -15.6520 -3.8108 -3.8108 -2.4241 -2.4241 1.1159 1.1159 1.2586 1.2586 1.3418 1.3418 1.4666 1.4666 4.5441 4.5441 9.6393 9.6393 10.5898 10.5898 12.6072 12.6072 k =-0.1071 0.0320-0.0000 ( 4138 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6543 -19.6543 -19.5989 -19.5989 -19.4704 -19.4704 -19.4199 -19.4199 -19.4052 -19.4052 -19.3586 -19.3586 -16.0289 -16.0289 -15.6544 -15.6544 -3.8014 -3.8014 -2.4401 -2.4401 1.1187 1.1187 1.2508 1.2508 1.3500 1.3500 1.4634 1.4634 4.5701 4.5701 9.5387 9.5387 10.6768 10.6768 12.5895 12.5895 k =-0.1250 0.0374-0.0000 ( 4130 PWs) bands (ev): -47.5594 -47.5594 -47.5453 -47.5453 -19.6541 -19.6541 -19.5992 -19.5992 -19.4703 -19.4703 -19.4201 -19.4201 -19.4051 -19.4051 -19.3586 -19.3586 -16.0258 -16.0258 -15.6572 -15.6572 -3.7905 -3.7905 -2.4586 -2.4586 1.1220 1.1220 1.2431 1.2431 1.3580 1.3580 1.4597 1.4597 4.6003 4.6003 9.4376 9.4376 10.7624 10.7624 12.5697 12.5697 k =-0.1429 0.0427-0.0000 ( 4128 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6540 -19.6540 -19.5995 -19.5995 -19.4702 -19.4702 -19.4202 -19.4202 -19.4052 -19.4052 -19.3586 -19.3586 -16.0223 -16.0223 -15.6604 -15.6604 -3.7778 -3.7778 -2.4795 -2.4795 1.1257 1.1257 1.2357 1.2357 1.3659 1.3659 1.4555 1.4555 4.6346 4.6346 9.3363 9.3363 10.8464 10.8464 12.5480 12.5480 k =-0.1607 0.0480-0.0000 ( 4132 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6538 -19.6538 -19.5999 -19.5999 -19.4701 -19.4701 -19.4205 -19.4205 -19.4051 -19.4051 -19.3586 -19.3586 -16.0184 -16.0184 -15.6639 -15.6639 -3.7636 -3.7636 -2.5029 -2.5029 1.1298 1.1298 1.2285 1.2285 1.3736 1.3736 1.4508 1.4508 4.6727 4.6727 9.2350 9.2350 10.9291 10.9291 12.5250 12.5250 k =-0.1786 0.0534-0.0000 ( 4128 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6536 -19.6536 -19.6004 -19.6004 -19.4700 -19.4700 -19.4207 -19.4207 -19.4051 -19.4051 -19.3586 -19.3586 -16.0141 -16.0141 -15.6678 -15.6678 -3.7478 -3.7478 -2.5284 -2.5284 1.1345 1.1345 1.2215 1.2215 1.3810 1.3810 1.4456 1.4456 4.7144 4.7144 9.1340 9.1340 11.0104 11.0104 12.5009 12.5009 k =-0.1964 0.0587-0.0000 ( 4118 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6532 -19.6532 -19.6008 -19.6008 -19.4698 -19.4698 -19.4209 -19.4209 -19.4051 -19.4051 -19.3586 -19.3586 -16.0095 -16.0095 -15.6721 -15.6721 -3.7305 -3.7305 -2.5560 -2.5560 1.1395 1.1395 1.2149 1.2149 1.3881 1.3881 1.4401 1.4401 4.7592 4.7592 9.0336 9.0336 11.0905 11.0905 12.4760 12.4760 k =-0.2143 0.0641-0.0000 ( 4118 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6530 -19.6530 -19.6013 -19.6013 -19.4697 -19.4697 -19.4211 -19.4211 -19.4051 -19.4051 -19.3586 -19.3586 -16.0045 -16.0045 -15.6766 -15.6766 -3.7116 -3.7116 -2.5854 -2.5854 1.1449 1.1449 1.2085 1.2085 1.3948 1.3948 1.4342 1.4342 4.8069 4.8069 8.9340 8.9340 11.1693 11.1693 12.4508 12.4508 k =-0.2321 0.0694-0.0000 ( 4118 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6527 -19.6527 -19.6018 -19.6018 -19.4696 -19.4696 -19.4214 -19.4214 -19.4051 -19.4051 -19.3586 -19.3586 -15.9993 -15.9993 -15.6814 -15.6814 -3.6912 -3.6912 -2.6165 -2.6165 1.1507 1.1507 1.2025 1.2025 1.4008 1.4008 1.4282 1.4282 4.8570 4.8570 8.8356 8.8356 11.2470 11.2470 12.4255 12.4255 k =-0.2500 0.0747-0.0000 ( 4116 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6524 -19.6524 -19.6023 -19.6023 -19.4694 -19.4694 -19.4217 -19.4217 -19.4051 -19.4051 -19.3587 -19.3587 -15.9939 -15.9939 -15.6864 -15.6864 -3.6694 -3.6694 -2.6491 -2.6491 1.1567 1.1567 1.1969 1.1969 1.4055 1.4055 1.4230 1.4230 4.9091 4.9091 8.7387 8.7387 11.3236 11.3236 12.4003 12.4003 k =-0.2679 0.0801-0.0000 ( 4118 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6521 -19.6521 -19.6029 -19.6029 -19.4693 -19.4693 -19.4219 -19.4219 -19.4051 -19.4051 -19.3587 -19.3587 -15.9882 -15.9882 -15.6916 -15.6916 -3.6462 -3.6462 -2.6831 -2.6831 1.1629 1.1629 1.1919 1.1919 1.4061 1.4061 1.4210 1.4210 4.9628 4.9628 8.6439 8.6439 11.3989 11.3989 12.3757 12.3757 k =-0.2857 0.0854-0.0000 ( 4122 PWs) bands (ev): -47.5593 -47.5593 -47.5453 -47.5453 -19.6519 -19.6519 -19.6034 -19.6034 -19.4692 -19.4692 -19.4222 -19.4222 -19.4051 -19.4051 -19.3586 -19.3586 -15.9825 -15.9825 -15.6969 -15.6969 -3.6218 -3.6218 -2.7181 -2.7181 1.1687 1.1687 1.1880 1.1880 1.4014 1.4014 1.4238 1.4238 5.0174 5.0174 8.5514 8.5514 11.4730 11.4730 12.3518 12.3518 k =-0.3036 0.0907-0.0000 ( 4116 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6516 -19.6516 -19.6039 -19.6039 -19.4691 -19.4691 -19.4224 -19.4224 -19.4051 -19.4051 -19.3586 -19.3586 -15.9766 -15.9766 -15.7023 -15.7023 -3.5961 -3.5961 -2.7540 -2.7540 1.1725 1.1725 1.1866 1.1866 1.3944 1.3944 1.4282 1.4282 5.0724 5.0724 8.4619 8.4619 11.5456 11.5456 12.3289 12.3289 k =-0.3214 0.0961-0.0000 ( 4110 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6513 -19.6513 -19.6043 -19.6043 -19.4690 -19.4690 -19.4226 -19.4226 -19.4051 -19.4051 -19.3586 -19.3586 -15.9708 -15.9708 -15.7077 -15.7077 -3.5692 -3.5692 -2.7905 -2.7905 1.1723 1.1723 1.1900 1.1900 1.3866 1.3866 1.4327 1.4327 5.1272 5.1272 8.3760 8.3760 11.6166 11.6166 12.3073 12.3073 k =-0.3393 0.1014-0.0000 ( 4108 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6510 -19.6510 -19.6048 -19.6048 -19.4688 -19.4688 -19.4228 -19.4228 -19.4050 -19.4050 -19.3586 -19.3586 -15.9650 -15.9650 -15.7131 -15.7131 -3.5414 -3.5414 -2.8275 -2.8275 1.1697 1.1697 1.1964 1.1964 1.3784 1.3784 1.4370 1.4370 5.1809 5.1809 8.2942 8.2942 11.6854 11.6854 12.2870 12.2870 k =-0.3571 0.1068-0.0000 ( 4108 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6507 -19.6507 -19.6053 -19.6053 -19.4687 -19.4687 -19.4230 -19.4230 -19.4050 -19.4050 -19.3586 -19.3586 -15.9594 -15.9594 -15.7184 -15.7184 -3.5128 -3.5128 -2.8647 -2.8647 1.1666 1.1666 1.2038 1.2038 1.3700 1.3700 1.4410 1.4410 5.2329 5.2329 8.2174 8.2174 11.7516 11.7516 12.2685 12.2685 k =-0.3750 0.1121-0.0000 ( 4108 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6505 -19.6505 -19.6058 -19.6058 -19.4686 -19.4686 -19.4232 -19.4232 -19.4050 -19.4050 -19.3586 -19.3586 -15.9541 -15.9541 -15.7234 -15.7234 -3.4835 -3.4835 -2.9018 -2.9018 1.1637 1.1637 1.2115 1.2115 1.3616 1.3616 1.4446 1.4446 5.2821 5.2821 8.1464 8.1464 11.8145 11.8145 12.2516 12.2516 k =-0.3929 0.1174-0.0000 ( 4112 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6502 -19.6502 -19.6062 -19.6062 -19.4685 -19.4685 -19.4235 -19.4235 -19.4050 -19.4050 -19.3586 -19.3586 -15.9491 -15.9491 -15.7280 -15.7280 -3.4539 -3.4539 -2.9383 -2.9383 1.1610 1.1610 1.2194 1.2194 1.3531 1.3531 1.4477 1.4477 5.3277 5.3277 8.0820 8.0820 11.8732 11.8732 12.2367 12.2367 k =-0.4107 0.1228-0.0000 ( 4118 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6500 -19.6500 -19.6067 -19.6067 -19.4684 -19.4684 -19.4237 -19.4237 -19.4050 -19.4050 -19.3587 -19.3587 -15.9446 -15.9446 -15.7323 -15.7323 -3.4244 -3.4244 -2.9737 -2.9737 1.1588 1.1588 1.2273 1.2273 1.3448 1.3448 1.4504 1.4504 5.3687 5.3687 8.0252 8.0252 11.9266 11.9266 12.2239 12.2239 k =-0.4286 0.1281-0.0000 ( 4116 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6499 -19.6499 -19.6070 -19.6070 -19.4684 -19.4684 -19.4237 -19.4237 -19.4050 -19.4050 -19.3586 -19.3586 -15.9407 -15.9407 -15.7360 -15.7360 -3.3957 -3.3957 -3.0074 -3.0074 1.1569 1.1569 1.2348 1.2348 1.3368 1.3368 1.4527 1.4527 5.4040 5.4040 7.9770 7.9770 11.9733 11.9733 12.2132 12.2132 k =-0.4464 0.1335-0.0000 ( 4116 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6498 -19.6498 -19.6072 -19.6072 -19.4683 -19.4683 -19.4238 -19.4238 -19.4050 -19.4050 -19.3586 -19.3586 -15.9376 -15.9376 -15.7390 -15.7390 -3.3690 -3.3690 -3.0381 -3.0381 1.1554 1.1554 1.2418 1.2418 1.3296 1.3296 1.4544 1.4544 5.4328 5.4328 7.9383 7.9383 12.0120 12.0120 12.2047 12.2047 k =-0.4643 0.1388-0.0000 ( 4124 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6498 -19.6498 -19.6074 -19.6074 -19.4683 -19.4683 -19.4239 -19.4239 -19.4050 -19.4050 -19.3586 -19.3586 -15.9352 -15.9352 -15.7412 -15.7412 -3.3461 -3.3461 -3.0638 -3.0638 1.1543 1.1543 1.2477 1.2477 1.3234 1.3234 1.4557 1.4557 5.4540 5.4540 7.9100 7.9100 12.0412 12.0412 12.1985 12.1985 k =-0.4821 0.1441-0.0000 ( 4124 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6075 -19.6075 -19.4683 -19.4683 -19.4240 -19.4240 -19.4050 -19.4050 -19.3586 -19.3586 -15.9337 -15.9337 -15.7426 -15.7426 -3.3299 -3.3299 -3.0816 -3.0816 1.1536 1.1536 1.2517 1.2517 1.3192 1.3192 1.4564 1.4564 5.4670 5.4670 7.8927 7.8927 12.0593 12.0593 12.1947 12.1947 k =-0.5000 0.1495-0.0000 ( 4120 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6075 -19.6075 -19.4683 -19.4683 -19.4240 -19.4240 -19.4050 -19.4050 -19.3586 -19.3586 -15.9332 -15.9332 -15.7431 -15.7431 -3.3240 -3.3240 -3.0881 -3.0881 1.1534 1.1534 1.2532 1.2532 1.3177 1.3177 1.4567 1.4567 5.4715 5.4715 7.8869 7.8869 12.0655 12.0655 12.1934 12.1934 k =-0.5000 0.1495-0.0000 ( 4120 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6075 -19.6075 -19.4683 -19.4683 -19.4240 -19.4240 -19.4050 -19.4050 -19.3586 -19.3586 -15.9332 -15.9332 -15.7431 -15.7431 -3.3240 -3.3240 -3.0881 -3.0881 1.1534 1.1534 1.2532 1.2532 1.3177 1.3177 1.4567 1.4567 5.4715 5.4715 7.8869 7.8869 12.0655 12.0655 12.1934 12.1934 k =-0.4947 0.1672-0.0000 ( 4128 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6076 -19.6076 -19.4683 -19.4683 -19.4241 -19.4241 -19.4050 -19.4050 -19.3587 -19.3587 -15.9331 -15.9331 -15.7429 -15.7429 -3.3239 -3.3239 -3.0878 -3.0878 1.1514 1.1514 1.2532 1.2532 1.3177 1.3177 1.4550 1.4550 5.4733 5.4733 7.8890 7.8890 12.0664 12.0664 12.1918 12.1918 k =-0.4894 0.1849-0.0000 ( 4120 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6077 -19.6077 -19.4683 -19.4683 -19.4244 -19.4244 -19.4049 -19.4049 -19.3589 -19.3589 -15.9325 -15.9325 -15.7422 -15.7422 -3.3236 -3.3236 -3.0869 -3.0869 1.1454 1.1454 1.2531 1.2531 1.3178 1.3178 1.4502 1.4502 5.4790 5.4790 7.8952 7.8952 12.0689 12.0689 12.1868 12.1868 k =-0.4841 0.2026-0.0000 ( 4124 PWs) bands (ev): -47.5591 -47.5591 -47.5454 -47.5454 -19.6497 -19.6497 -19.6080 -19.6080 -19.4683 -19.4683 -19.4249 -19.4249 -19.4047 -19.4047 -19.3592 -19.3592 -15.9317 -15.9317 -15.7412 -15.7412 -3.3232 -3.3232 -3.0854 -3.0854 1.1354 1.1354 1.2531 1.2531 1.3180 1.3180 1.4423 1.4423 5.4883 5.4883 7.9057 7.9057 12.0732 12.0732 12.1784 12.1784 k =-0.4788 0.2203-0.0000 ( 4120 PWs) bands (ev): -47.5591 -47.5591 -47.5454 -47.5454 -19.6497 -19.6497 -19.6083 -19.6083 -19.4684 -19.4684 -19.4255 -19.4255 -19.4045 -19.4045 -19.3596 -19.3596 -15.9305 -15.9305 -15.7397 -15.7397 -3.3225 -3.3225 -3.0832 -3.0832 1.1216 1.1216 1.2529 1.2529 1.3182 1.3182 1.4313 1.4313 5.5013 5.5013 7.9202 7.9202 12.0792 12.0792 12.1663 12.1663 k =-0.4735 0.2380-0.0000 ( 4124 PWs) bands (ev): -47.5590 -47.5590 -47.5454 -47.5454 -19.6499 -19.6499 -19.6088 -19.6088 -19.4685 -19.4685 -19.4263 -19.4263 -19.4043 -19.4043 -19.3601 -19.3601 -15.9290 -15.9290 -15.7377 -15.7377 -3.3218 -3.3218 -3.0805 -3.0805 1.1041 1.1041 1.2528 1.2528 1.3185 1.3185 1.4172 1.4172 5.5179 5.5179 7.9388 7.9388 12.0869 12.0869 12.1503 12.1503 k =-0.4682 0.2557-0.0000 ( 4132 PWs) bands (ev): -47.5590 -47.5590 -47.5454 -47.5454 -19.6500 -19.6500 -19.6094 -19.6094 -19.4686 -19.4686 -19.4273 -19.4273 -19.4041 -19.4041 -19.3608 -19.3608 -15.9271 -15.9271 -15.7354 -15.7354 -3.3208 -3.3208 -3.0771 -3.0771 1.0829 1.0829 1.2525 1.2525 1.3189 1.3189 1.4003 1.4003 5.5378 5.5378 7.9612 7.9612 12.0962 12.0962 12.1301 12.1301 k =-0.4629 0.2734-0.0000 ( 4130 PWs) bands (ev): -47.5589 -47.5589 -47.5455 -47.5455 -19.6502 -19.6502 -19.6100 -19.6100 -19.4687 -19.4687 -19.4283 -19.4283 -19.4039 -19.4039 -19.3615 -19.3615 -15.9249 -15.9249 -15.7327 -15.7327 -3.3196 -3.3196 -3.0732 -3.0732 1.0584 1.0584 1.2522 1.2522 1.3193 1.3193 1.3806 1.3806 5.5611 5.5611 7.9876 7.9876 12.1050 12.1050 12.1075 12.1075 k =-0.4576 0.2912-0.0000 ( 4122 PWs) bands (ev): -47.5588 -47.5588 -47.5455 -47.5455 -19.6503 -19.6503 -19.6107 -19.6107 -19.4689 -19.4689 -19.4294 -19.4294 -19.4036 -19.4036 -19.3622 -19.3622 -15.9225 -15.9225 -15.7296 -15.7296 -3.3184 -3.3184 -3.0686 -3.0686 1.0307 1.0307 1.2518 1.2518 1.3199 1.3199 1.3584 1.3584 5.5874 5.5874 8.0176 8.0176 12.0754 12.0754 12.1200 12.1200 k =-0.4524 0.3089-0.0000 ( 4118 PWs) bands (ev): -47.5587 -47.5587 -47.5455 -47.5455 -19.6505 -19.6505 -19.6115 -19.6115 -19.4690 -19.4690 -19.4307 -19.4307 -19.4034 -19.4034 -19.3631 -19.3631 -15.9197 -15.9197 -15.7261 -15.7261 -3.3170 -3.3170 -3.0635 -3.0635 1.0000 1.0000 1.2513 1.2513 1.3205 1.3205 1.3337 1.3337 5.6168 5.6168 8.0512 8.0512 12.0401 12.0401 12.1344 12.1344 k =-0.4471 0.3266-0.0000 ( 4114 PWs) bands (ev): -47.5585 -47.5585 -47.5455 -47.5455 -19.6508 -19.6508 -19.6124 -19.6124 -19.4693 -19.4693 -19.4319 -19.4319 -19.4032 -19.4032 -19.3640 -19.3640 -15.9167 -15.9167 -15.7222 -15.7222 -3.3155 -3.3155 -3.0578 -3.0578 0.9666 0.9666 1.2503 1.2503 1.3071 1.3071 1.3213 1.3213 5.6489 5.6489 8.0882 8.0882 11.9990 11.9990 12.1504 12.1504 k =-0.4418 0.3443-0.0000 ( 4110 PWs) bands (ev): -47.5584 -47.5584 -47.5455 -47.5455 -19.6511 -19.6511 -19.6133 -19.6133 -19.4695 -19.4695 -19.4333 -19.4333 -19.4030 -19.4030 -19.3649 -19.3649 -15.9133 -15.9133 -15.7180 -15.7180 -3.3138 -3.3138 -3.0515 -3.0515 0.9307 0.9307 1.2478 1.2478 1.2797 1.2797 1.3220 1.3220 5.6837 5.6837 8.1285 8.1285 11.9516 11.9516 12.1680 12.1680 k =-0.4365 0.3620-0.0000 ( 4106 PWs) bands (ev): -47.5582 -47.5582 -47.5455 -47.5455 -19.6514 -19.6514 -19.6144 -19.6144 -19.4698 -19.4698 -19.4347 -19.4347 -19.4029 -19.4029 -19.3659 -19.3659 -15.9098 -15.9098 -15.7135 -15.7135 -3.3122 -3.3122 -3.0447 -3.0447 0.8926 0.8926 1.2362 1.2362 1.2596 1.2596 1.3229 1.3229 5.7208 5.7208 8.1719 8.1719 11.8976 11.8976 12.1871 12.1871 k =-0.4312 0.3797-0.0000 ( 4108 PWs) bands (ev): -47.5581 -47.5581 -47.5456 -47.5456 -19.6517 -19.6517 -19.6155 -19.6155 -19.4701 -19.4701 -19.4362 -19.4362 -19.4027 -19.4027 -19.3669 -19.3669 -15.9060 -15.9060 -15.7086 -15.7086 -3.3104 -3.3104 -3.0374 -3.0374 0.8525 0.8525 1.2079 1.2079 1.2543 1.2543 1.3238 1.3238 5.7603 5.7603 8.2183 8.2183 11.8368 11.8368 12.2079 12.2079 k =-0.4259 0.3974-0.0000 ( 4120 PWs) bands (ev): -47.5579 -47.5579 -47.5456 -47.5456 -19.6522 -19.6522 -19.6168 -19.6168 -19.4706 -19.4706 -19.4378 -19.4378 -19.4027 -19.4027 -19.3680 -19.3680 -15.9020 -15.9020 -15.7035 -15.7035 -3.3086 -3.3086 -3.0295 -3.0295 0.8106 0.8106 1.1741 1.1741 1.2526 1.2526 1.3249 1.3249 5.8019 5.8019 8.2674 8.2674 11.7691 11.7691 12.2301 12.2301 k =-0.4206 0.4151-0.0000 ( 4114 PWs) bands (ev): -47.5577 -47.5577 -47.5456 -47.5456 -19.6526 -19.6526 -19.6181 -19.6181 -19.4710 -19.4710 -19.4393 -19.4393 -19.4027 -19.4027 -19.3690 -19.3690 -15.8978 -15.8978 -15.6981 -15.6981 -3.3068 -3.3068 -3.0211 -3.0211 0.7674 0.7674 1.1383 1.1383 1.2517 1.2517 1.3260 1.3260 5.8454 5.8454 8.3192 8.3192 11.6945 11.6945 12.2539 12.2539 k =-0.4153 0.4328-0.0000 ( 4118 PWs) bands (ev): -47.5576 -47.5576 -47.5457 -47.5457 -19.6531 -19.6531 -19.6194 -19.6194 -19.4715 -19.4715 -19.4408 -19.4408 -19.4027 -19.4027 -19.3700 -19.3700 -15.8934 -15.8934 -15.6925 -15.6925 -3.3050 -3.3050 -3.0122 -3.0122 0.7230 0.7230 1.1010 1.1010 1.2509 1.2509 1.3272 1.3272 5.8907 5.8907 8.3735 8.3735 11.6132 11.6132 12.2790 12.2790 k =-0.4100 0.4506-0.0000 ( 4126 PWs) bands (ev): -47.5574 -47.5574 -47.5457 -47.5457 -19.6537 -19.6537 -19.6209 -19.6209 -19.4720 -19.4720 -19.4425 -19.4425 -19.4027 -19.4027 -19.3710 -19.3710 -15.8889 -15.8889 -15.6867 -15.6867 -3.3033 -3.3033 -3.0028 -3.0028 0.6776 0.6776 1.0626 1.0626 1.2502 1.2502 1.3284 1.3284 5.9377 5.9377 8.4301 8.4301 11.5255 11.5255 12.3056 12.3056 k =-0.4047 0.4683-0.0000 ( 4128 PWs) bands (ev): -47.5572 -47.5572 -47.5458 -47.5458 -19.6543 -19.6543 -19.6223 -19.6223 -19.4726 -19.4726 -19.4441 -19.4441 -19.4028 -19.4028 -19.3720 -19.3720 -15.8843 -15.8843 -15.6806 -15.6806 -3.3015 -3.3015 -2.9929 -2.9929 0.6315 0.6315 1.0233 1.0233 1.2496 1.2496 1.3297 1.3297 5.9862 5.9862 8.4888 8.4888 11.4318 11.4318 12.3335 12.3335 k =-0.3994 0.4860-0.0000 ( 4132 PWs) bands (ev): -47.5570 -47.5570 -47.5458 -47.5458 -19.6549 -19.6549 -19.6239 -19.6239 -19.4732 -19.4732 -19.4457 -19.4457 -19.4028 -19.4028 -19.3730 -19.3730 -15.8795 -15.8795 -15.6744 -15.6744 -3.2999 -3.2999 -2.9825 -2.9825 0.5850 0.5850 0.9834 0.9834 1.2488 1.2488 1.3311 1.3311 6.0361 6.0361 8.5496 8.5496 11.3328 11.3328 12.3627 12.3627 k =-0.3941 0.5037-0.0000 ( 4132 PWs) bands (ev): -47.5567 -47.5567 -47.5459 -47.5459 -19.6556 -19.6556 -19.6255 -19.6255 -19.4739 -19.4739 -19.4473 -19.4473 -19.4028 -19.4028 -19.3739 -19.3739 -15.8747 -15.8747 -15.6680 -15.6680 -3.2983 -3.2983 -2.9718 -2.9718 0.5382 0.5382 0.9429 0.9429 1.2481 1.2481 1.3326 1.3326 6.0873 6.0873 8.6122 8.6122 11.2289 11.2289 12.3931 12.3931 k =-0.3888 0.5214-0.0000 ( 4132 PWs) bands (ev): -47.5565 -47.5565 -47.5460 -47.5460 -19.6563 -19.6563 -19.6271 -19.6271 -19.4746 -19.4746 -19.4489 -19.4489 -19.4029 -19.4029 -19.3748 -19.3748 -15.8698 -15.8698 -15.6615 -15.6615 -3.2969 -3.2969 -2.9606 -2.9606 0.4914 0.4914 0.9022 0.9022 1.2473 1.2473 1.3341 1.3341 6.1398 6.1398 8.6766 8.6766 11.1208 11.1208 12.4245 12.4245 k =-0.3835 0.5391-0.0000 ( 4132 PWs) bands (ev): -47.5563 -47.5563 -47.5460 -47.5460 -19.6571 -19.6571 -19.6287 -19.6287 -19.4753 -19.4753 -19.4504 -19.4504 -19.4029 -19.4029 -19.3757 -19.3757 -15.8649 -15.8649 -15.6549 -15.6549 -3.2956 -3.2956 -2.9490 -2.9490 0.4447 0.4447 0.8614 0.8614 1.2465 1.2465 1.3358 1.3358 6.1934 6.1934 8.7426 8.7426 11.0092 11.0092 12.4571 12.4571 k =-0.3782 0.5568-0.0000 ( 4138 PWs) bands (ev): -47.5560 -47.5560 -47.5461 -47.5461 -19.6579 -19.6579 -19.6304 -19.6304 -19.4761 -19.4761 -19.4520 -19.4520 -19.4029 -19.4029 -19.3765 -19.3765 -15.8599 -15.8599 -15.6483 -15.6483 -3.2946 -3.2946 -2.9369 -2.9369 0.3984 0.3984 0.8206 0.8206 1.2456 1.2456 1.3374 1.3374 6.2480 6.2480 8.8100 8.8100 10.8946 10.8946 12.4905 12.4905 k =-0.3729 0.5745-0.0000 ( 4128 PWs) bands (ev): -47.5558 -47.5558 -47.5462 -47.5462 -19.6587 -19.6587 -19.6320 -19.6320 -19.4768 -19.4768 -19.4536 -19.4536 -19.4028 -19.4028 -19.3773 -19.3773 -15.8550 -15.8550 -15.6416 -15.6416 -3.2937 -3.2937 -2.9246 -2.9246 0.3527 0.3527 0.7801 0.7801 1.2447 1.2447 1.3392 1.3392 6.3037 6.3037 8.8789 8.8789 10.7777 10.7777 12.5247 12.5247 k =-0.3676 0.5922-0.0000 ( 4124 PWs) bands (ev): -47.5555 -47.5555 -47.5463 -47.5463 -19.6595 -19.6595 -19.6337 -19.6337 -19.4775 -19.4775 -19.4551 -19.4551 -19.4028 -19.4028 -19.3781 -19.3781 -15.8501 -15.8501 -15.6348 -15.6348 -3.2930 -3.2930 -2.9119 -2.9119 0.3077 0.3077 0.7399 0.7399 1.2437 1.2437 1.3410 1.3410 6.3603 6.3603 8.9490 8.9490 10.6588 10.6588 12.5595 12.5595 k =-0.3623 0.6099-0.0000 ( 4124 PWs) bands (ev): -47.5552 -47.5552 -47.5464 -47.5464 -19.6604 -19.6604 -19.6354 -19.6354 -19.4783 -19.4783 -19.4566 -19.4566 -19.4027 -19.4027 -19.3788 -19.3788 -15.8453 -15.8453 -15.6281 -15.6281 -3.2927 -3.2927 -2.8988 -2.8988 0.2636 0.2636 0.7002 0.7002 1.2427 1.2427 1.3428 1.3428 6.4179 6.4179 9.0204 9.0204 10.5387 10.5387 12.5948 12.5948 k =-0.3571 0.6277-0.0000 ( 4128 PWs) bands (ev): -47.5550 -47.5550 -47.5465 -47.5465 -19.6613 -19.6613 -19.6372 -19.6372 -19.4791 -19.4791 -19.4581 -19.4581 -19.4025 -19.4025 -19.3796 -19.3796 -15.8406 -15.8406 -15.6215 -15.6215 -3.2926 -3.2926 -2.8855 -2.8855 0.2205 0.2205 0.6612 0.6612 1.2416 1.2416 1.3448 1.3448 6.4763 6.4763 9.0928 9.0928 10.4175 10.4175 12.6304 12.6304 k =-0.3518 0.6454-0.0000 ( 4126 PWs) bands (ev): -47.5547 -47.5547 -47.5465 -47.5465 -19.6621 -19.6621 -19.6389 -19.6389 -19.4797 -19.4797 -19.4596 -19.4596 -19.4023 -19.4023 -19.3803 -19.3803 -15.8360 -15.8360 -15.6149 -15.6149 -3.2928 -3.2928 -2.8719 -2.8719 0.1786 0.1786 0.6231 0.6231 1.2404 1.2404 1.3467 1.3467 6.5356 6.5356 9.1662 9.1662 10.2957 10.2957 12.6660 12.6660 k =-0.3465 0.6631-0.0000 ( 4128 PWs) bands (ev): -47.5544 -47.5544 -47.5466 -47.5466 -19.6630 -19.6630 -19.6407 -19.6407 -19.4804 -19.4804 -19.4611 -19.4611 -19.4021 -19.4021 -19.3810 -19.3810 -15.8316 -15.8316 -15.6083 -15.6083 -3.2934 -3.2934 -2.8580 -2.8580 0.1381 0.1381 0.5858 0.5858 1.2392 1.2392 1.3488 1.3488 6.5956 6.5956 9.2406 9.2406 10.1737 10.1737 12.6435 12.6435 k =-0.3412 0.6808-0.0000 ( 4128 PWs) bands (ev): -47.5542 -47.5542 -47.5468 -47.5468 -19.6639 -19.6639 -19.6424 -19.6424 -19.4810 -19.4810 -19.4625 -19.4625 -19.4019 -19.4019 -19.3817 -19.3817 -15.8273 -15.8273 -15.6019 -15.6019 -3.2943 -3.2943 -2.8439 -2.8439 0.0990 0.0990 0.5497 0.5497 1.2379 1.2379 1.3508 1.3508 6.6565 6.6565 9.3158 9.3158 10.0516 10.0516 12.5798 12.5798 k =-0.3359 0.6985-0.0000 ( 4130 PWs) bands (ev): -47.5539 -47.5539 -47.5469 -47.5469 -19.6648 -19.6648 -19.6441 -19.6441 -19.4817 -19.4817 -19.4639 -19.4639 -19.4016 -19.4016 -19.3824 -19.3824 -15.8232 -15.8232 -15.5956 -15.5956 -3.2956 -3.2956 -2.8296 -2.8296 0.0614 0.0614 0.5147 0.5147 1.2365 1.2365 1.3530 1.3530 6.7182 6.7182 9.3918 9.3918 9.9298 9.9298 12.5167 12.5167 k =-0.3306 0.7162-0.0000 ( 4122 PWs) bands (ev): -47.5536 -47.5536 -47.5470 -47.5470 -19.6656 -19.6656 -19.6457 -19.6457 -19.4822 -19.4822 -19.4653 -19.4653 -19.4012 -19.4012 -19.3830 -19.3830 -15.8193 -15.8193 -15.5895 -15.5895 -3.2973 -3.2973 -2.8152 -2.8152 0.0256 0.0256 0.4810 0.4810 1.2351 1.2351 1.3552 1.3552 6.7806 6.7806 9.4686 9.4686 9.8084 9.8084 12.4543 12.4543 k =-0.3253 0.7339-0.0000 ( 4106 PWs) bands (ev): -47.5533 -47.5533 -47.5471 -47.5471 -19.6663 -19.6663 -19.6473 -19.6473 -19.4826 -19.4826 -19.4665 -19.4665 -19.4008 -19.4008 -19.3836 -19.3836 -15.8156 -15.8156 -15.5836 -15.5836 -3.2994 -3.2994 -2.8006 -2.8006 -0.0084 -0.0084 0.4488 0.4488 1.2337 1.2337 1.3575 1.3575 6.8438 6.8438 9.5462 9.5462 9.6877 9.6877 12.3927 12.3927 k =-0.3200 0.7516-0.0000 ( 4108 PWs) bands (ev): -47.5530 -47.5530 -47.5473 -47.5473 -19.6670 -19.6670 -19.6489 -19.6489 -19.4830 -19.4830 -19.4679 -19.4679 -19.4003 -19.4003 -19.3843 -19.3843 -15.8122 -15.8122 -15.5778 -15.5778 -3.3020 -3.3020 -2.7859 -2.7859 -0.0405 -0.0405 0.4180 0.4180 1.2321 1.2321 1.3598 1.3598 6.9078 6.9078 9.5676 9.5676 9.6244 9.6244 12.3319 12.3319 k =-0.3147 0.7693-0.0000 ( 4110 PWs) bands (ev): -47.5528 -47.5528 -47.5474 -47.5474 -19.6677 -19.6677 -19.6505 -19.6505 -19.4834 -19.4834 -19.4691 -19.4691 -19.3999 -19.3999 -19.3849 -19.3849 -15.8091 -15.8091 -15.5723 -15.5723 -3.3050 -3.3050 -2.7711 -2.7711 -0.0706 -0.0706 0.3887 0.3887 1.2304 1.2304 1.3621 1.3621 6.9724 6.9724 9.4487 9.4487 9.7031 9.7031 12.2721 12.2721 k =-0.3094 0.7871-0.0000 ( 4102 PWs) bands (ev): -47.5525 -47.5525 -47.5476 -47.5476 -19.6682 -19.6682 -19.6520 -19.6520 -19.4836 -19.4836 -19.4703 -19.4703 -19.3994 -19.3994 -19.3855 -19.3855 -15.8062 -15.8062 -15.5670 -15.5670 -3.3085 -3.3085 -2.7562 -2.7562 -0.0987 -0.0987 0.3613 0.3613 1.2287 1.2287 1.3645 1.3645 7.0377 7.0377 9.3308 9.3308 9.7825 9.7825 12.2133 12.2133 k =-0.3041 0.8048-0.0000 ( 4098 PWs) bands (ev): -47.5522 -47.5522 -47.5477 -47.5477 -19.6687 -19.6687 -19.6535 -19.6535 -19.4838 -19.4838 -19.4716 -19.4716 -19.3988 -19.3988 -19.3862 -19.3862 -15.8037 -15.8037 -15.5620 -15.5620 -3.3124 -3.3124 -2.7413 -2.7413 -0.1246 -0.1246 0.3355 0.3355 1.2270 1.2270 1.3669 1.3669 7.1035 7.1035 9.2141 9.2141 9.8625 9.8625 12.1556 12.1556 k =-0.2988 0.8225-0.0000 ( 4110 PWs) bands (ev): -47.5519 -47.5519 -47.5479 -47.5479 -19.6692 -19.6692 -19.6549 -19.6549 -19.4840 -19.4840 -19.4728 -19.4728 -19.3983 -19.3983 -19.3869 -19.3869 -15.8015 -15.8015 -15.5573 -15.5573 -3.3169 -3.3169 -2.7265 -2.7265 -0.1483 -0.1483 0.3115 0.3115 1.2251 1.2251 1.3693 1.3693 7.1699 7.1699 9.0987 9.0987 9.9429 9.9429 12.0992 12.0992 k =-0.2935 0.8402-0.0000 ( 4106 PWs) bands (ev): -47.5517 -47.5517 -47.5481 -47.5481 -19.6695 -19.6695 -19.6562 -19.6562 -19.4840 -19.4840 -19.4739 -19.4739 -19.3978 -19.3978 -19.3875 -19.3875 -15.7997 -15.7997 -15.5528 -15.5528 -3.3218 -3.3218 -2.7117 -2.7117 -0.1698 -0.1698 0.2896 0.2896 1.2232 1.2232 1.3718 1.3718 7.2367 7.2367 8.9850 8.9850 10.0239 10.0239 12.0440 12.0440 k =-0.2882 0.8579-0.0000 ( 4112 PWs) bands (ev): -47.5514 -47.5514 -47.5483 -47.5483 -19.6698 -19.6698 -19.6575 -19.6575 -19.4840 -19.4840 -19.4750 -19.4750 -19.3972 -19.3972 -19.3882 -19.3882 -15.7982 -15.7982 -15.5487 -15.5487 -3.3273 -3.3273 -2.6969 -2.6969 -0.1889 -0.1889 0.2695 0.2695 1.2212 1.2212 1.3743 1.3743 7.3037 7.3037 8.8731 8.8731 10.1053 10.1053 11.9903 11.9903 k =-0.2829 0.8756-0.0000 ( 4112 PWs) bands (ev): -47.5511 -47.5511 -47.5485 -47.5485 -19.6699 -19.6699 -19.6586 -19.6586 -19.4839 -19.4839 -19.4760 -19.4760 -19.3966 -19.3966 -19.3889 -19.3889 -15.7971 -15.7971 -15.5448 -15.5448 -3.3332 -3.3332 -2.6823 -2.6823 -0.2056 -0.2056 0.2515 0.2515 1.2191 1.2191 1.3769 1.3769 7.3706 7.3706 8.7634 8.7634 10.1872 10.1872 11.9380 11.9380 k =-0.2776 0.8933-0.0000 ( 4104 PWs) bands (ev): -47.5509 -47.5509 -47.5486 -47.5486 -19.6699 -19.6699 -19.6597 -19.6597 -19.4837 -19.4837 -19.4769 -19.4769 -19.3959 -19.3959 -19.3895 -19.3895 -15.7963 -15.7963 -15.5413 -15.5413 -3.3396 -3.3396 -2.6678 -2.6678 -0.2199 -0.2199 0.2356 0.2356 1.2170 1.2170 1.3794 1.3794 7.4368 7.4368 8.6563 8.6563 10.2695 10.2695 11.8873 11.8873 k =-0.2723 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5506 -47.5506 -47.5489 -47.5489 -19.6699 -19.6699 -19.6607 -19.6607 -19.4835 -19.4835 -19.4779 -19.4779 -19.3954 -19.3954 -19.3902 -19.3902 -15.7960 -15.7960 -15.5382 -15.5382 -3.3466 -3.3466 -2.6534 -2.6534 -0.2317 -0.2317 0.2219 0.2219 1.2148 1.2148 1.3820 1.3820 7.5017 7.5017 8.5528 8.5528 10.3521 10.3521 11.8382 11.8382 k =-0.2723 0.9110-0.0000 ( 4108 PWs) bands (ev): -47.5506 -47.5506 -47.5489 -47.5489 -19.6699 -19.6699 -19.6607 -19.6607 -19.4835 -19.4835 -19.4779 -19.4779 -19.3954 -19.3954 -19.3902 -19.3902 -15.7960 -15.7960 -15.5382 -15.5382 -3.3466 -3.3466 -2.6534 -2.6534 -0.2317 -0.2317 0.2219 0.2219 1.2148 1.2148 1.3820 1.3820 7.5017 7.5017 8.5528 8.5528 10.3521 10.3521 11.8382 11.8382 k =-0.2723 0.9110 0.0186 ( 4112 PWs) bands (ev): -47.5506 -47.5506 -47.5489 -47.5489 -19.6698 -19.6698 -19.6606 -19.6606 -19.4835 -19.4835 -19.4778 -19.4778 -19.3954 -19.3954 -19.3902 -19.3902 -15.7959 -15.7959 -15.5383 -15.5383 -3.3463 -3.3463 -2.6535 -2.6535 -0.2312 -0.2312 0.2221 0.2221 1.2137 1.2137 1.3806 1.3806 7.5035 7.5035 8.5537 8.5537 10.3532 10.3532 11.8382 11.8382 k =-0.2723 0.9110 0.0372 ( 4110 PWs) bands (ev): -47.5506 -47.5506 -47.5488 -47.5488 -19.6697 -19.6697 -19.6605 -19.6605 -19.4837 -19.4837 -19.4777 -19.4777 -19.3956 -19.3956 -19.3902 -19.3902 -15.7957 -15.7957 -15.5385 -15.5385 -3.3453 -3.3453 -2.6537 -2.6537 -0.2297 -0.2297 0.2228 0.2228 1.2105 1.2105 1.3766 1.3766 7.5089 7.5089 8.5564 8.5564 10.3565 10.3565 11.8383 11.8383 k =-0.2723 0.9110 0.0558 ( 4108 PWs) bands (ev): -47.5506 -47.5506 -47.5488 -47.5488 -19.6695 -19.6695 -19.6604 -19.6604 -19.4839 -19.4839 -19.4774 -19.4774 -19.3960 -19.3960 -19.3903 -19.3903 -15.7954 -15.7954 -15.5388 -15.5388 -3.3438 -3.3438 -2.6540 -2.6540 -0.2273 -0.2273 0.2240 0.2240 1.2053 1.2053 1.3699 1.3699 7.5179 7.5179 8.5609 8.5609 10.3618 10.3618 11.8385 11.8385 k =-0.2723 0.9110 0.0743 ( 4112 PWs) bands (ev): -47.5506 -47.5506 -47.5488 -47.5488 -19.6692 -19.6692 -19.6601 -19.6601 -19.4842 -19.4842 -19.4771 -19.4771 -19.3965 -19.3965 -19.3903 -19.3903 -15.7949 -15.7949 -15.5393 -15.5393 -3.3417 -3.3417 -2.6545 -2.6545 -0.2238 -0.2238 0.2256 0.2256 1.1979 1.1979 1.3606 1.3606 7.5305 7.5305 8.5672 8.5672 10.3693 10.3693 11.8387 11.8387 k =-0.2723 0.9110 0.0929 ( 4116 PWs) bands (ev): -47.5505 -47.5505 -47.5488 -47.5488 -19.6688 -19.6688 -19.6599 -19.6599 -19.4845 -19.4845 -19.4767 -19.4767 -19.3971 -19.3971 -19.3905 -19.3905 -15.7943 -15.7943 -15.5399 -15.5399 -3.3390 -3.3390 -2.6552 -2.6552 -0.2194 -0.2194 0.2276 0.2276 1.1885 1.1885 1.3487 1.3487 7.5465 7.5465 8.5753 8.5753 10.3786 10.3786 11.8390 11.8390 k =-0.2723 0.9110 0.1115 ( 4116 PWs) bands (ev): -47.5505 -47.5505 -47.5488 -47.5488 -19.6684 -19.6684 -19.6595 -19.6595 -19.4848 -19.4848 -19.4763 -19.4763 -19.3978 -19.3978 -19.3906 -19.3906 -15.7935 -15.7935 -15.5407 -15.5407 -3.3356 -3.3356 -2.6559 -2.6559 -0.2140 -0.2140 0.2301 0.2301 1.1772 1.1772 1.3345 1.3345 7.5659 7.5659 8.5851 8.5851 10.3899 10.3899 11.8395 11.8395 k =-0.2723 0.9110 0.1301 ( 4116 PWs) bands (ev): -47.5505 -47.5505 -47.5488 -47.5488 -19.6678 -19.6678 -19.6591 -19.6591 -19.4852 -19.4852 -19.4758 -19.4758 -19.3986 -19.3986 -19.3908 -19.3908 -15.7926 -15.7926 -15.5416 -15.5416 -3.3317 -3.3317 -2.6569 -2.6569 -0.2077 -0.2077 0.2330 0.2330 1.1639 1.1639 1.3179 1.3179 7.5887 7.5887 8.5968 8.5968 10.4029 10.4029 11.8400 11.8400 k =-0.2723 0.9110 0.1487 ( 4120 PWs) bands (ev): -47.5504 -47.5504 -47.5487 -47.5487 -19.6672 -19.6672 -19.6586 -19.6586 -19.4856 -19.4856 -19.4753 -19.4753 -19.3995 -19.3995 -19.3911 -19.3911 -15.7916 -15.7916 -15.5426 -15.5426 -3.3272 -3.3272 -2.6579 -2.6579 -0.2004 -0.2004 0.2363 0.2363 1.1489 1.1489 1.2991 1.2991 7.6146 7.6146 8.6102 8.6102 10.4174 10.4174 11.8407 11.8407 k =-0.2723 0.9110 0.1673 ( 4114 PWs) bands (ev): -47.5504 -47.5504 -47.5487 -47.5487 -19.6666 -19.6666 -19.6580 -19.6580 -19.4860 -19.4860 -19.4748 -19.4748 -19.4004 -19.4004 -19.3913 -19.3913 -15.7904 -15.7904 -15.5438 -15.5438 -3.3222 -3.3222 -2.6592 -2.6592 -0.1923 -0.1923 0.2399 0.2399 1.1323 1.1323 1.2782 1.2782 7.6435 7.6435 8.6255 8.6255 10.4333 10.4333 11.8415 11.8415 k =-0.2723 0.9110 0.1859 ( 4114 PWs) bands (ev): -47.5503 -47.5503 -47.5487 -47.5487 -19.6658 -19.6658 -19.6574 -19.6574 -19.4864 -19.4864 -19.4742 -19.4742 -19.4014 -19.4014 -19.3917 -19.3917 -15.7891 -15.7891 -15.5451 -15.5451 -3.3166 -3.3166 -2.6606 -2.6606 -0.1833 -0.1833 0.2439 0.2439 1.1141 1.1141 1.2554 1.2554 7.6755 7.6755 8.6424 8.6424 10.4504 10.4504 11.8424 11.8424 k =-0.2723 0.9110 0.2045 ( 4116 PWs) bands (ev): -47.5502 -47.5502 -47.5486 -47.5486 -19.6650 -19.6650 -19.6568 -19.6568 -19.4867 -19.4867 -19.4737 -19.4737 -19.4025 -19.4025 -19.3921 -19.3921 -15.7876 -15.7876 -15.5465 -15.5465 -3.3104 -3.3104 -2.6622 -2.6622 -0.1735 -0.1735 0.2481 0.2481 1.0944 1.0944 1.2308 1.2308 7.7102 7.7102 8.6611 8.6611 10.4686 10.4686 11.8436 11.8436 k =-0.2723 0.9110 0.2230 ( 4116 PWs) bands (ev): -47.5502 -47.5502 -47.5486 -47.5486 -19.6642 -19.6642 -19.6561 -19.6561 -19.4871 -19.4871 -19.4732 -19.4732 -19.4036 -19.4036 -19.3925 -19.3925 -15.7861 -15.7861 -15.5481 -15.5481 -3.3037 -3.3037 -2.6640 -2.6640 -0.1629 -0.1629 0.2527 0.2527 1.0735 1.0735 1.2046 1.2046 7.7476 7.7476 8.6815 8.6815 10.4874 10.4874 11.8449 11.8449 k =-0.2723 0.9110 0.2416 ( 4116 PWs) bands (ev): -47.5501 -47.5501 -47.5485 -47.5485 -19.6633 -19.6633 -19.6554 -19.6554 -19.4875 -19.4875 -19.4726 -19.4726 -19.4048 -19.4048 -19.3930 -19.3930 -15.7844 -15.7844 -15.5498 -15.5498 -3.2965 -3.2965 -2.6659 -2.6659 -0.1516 -0.1516 0.2574 0.2574 1.0514 1.0514 1.1770 1.1770 7.7875 7.7875 8.7037 8.7037 10.5068 10.5068 11.8465 11.8465 k =-0.2723 0.9110 0.2602 ( 4118 PWs) bands (ev): -47.5500 -47.5500 -47.5485 -47.5485 -19.6623 -19.6623 -19.6547 -19.6547 -19.4878 -19.4878 -19.4721 -19.4721 -19.4060 -19.4060 -19.3935 -19.3935 -15.7825 -15.7825 -15.5517 -15.5517 -3.2888 -3.2888 -2.6681 -2.6681 -0.1395 -0.1395 0.2623 0.2623 1.0283 1.0283 1.1482 1.1482 7.8297 7.8297 8.7275 8.7275 10.5265 10.5265 11.8484 11.8484 k =-0.2723 0.9110 0.2788 ( 4112 PWs) bands (ev): -47.5499 -47.5499 -47.5484 -47.5484 -19.6614 -19.6614 -19.6538 -19.6538 -19.4882 -19.4882 -19.4715 -19.4715 -19.4072 -19.4072 -19.3941 -19.3941 -15.7806 -15.7806 -15.5536 -15.5536 -3.2807 -3.2807 -2.6705 -2.6705 -0.1268 -0.1268 0.2673 0.2673 1.0043 1.0043 1.1183 1.1183 7.8743 7.8743 8.7530 8.7530 10.5463 10.5463 11.8506 11.8506 k =-0.2723 0.9110 0.2974 ( 4116 PWs) bands (ev): -47.5499 -47.5499 -47.5483 -47.5483 -19.6604 -19.6604 -19.6530 -19.6530 -19.4885 -19.4885 -19.4710 -19.4710 -19.4084 -19.4084 -19.3947 -19.3947 -15.7785 -15.7785 -15.5557 -15.5557 -3.2720 -3.2720 -2.6732 -2.6732 -0.1135 -0.1135 0.2723 0.2723 0.9796 0.9796 1.0875 1.0875 7.9209 7.9209 8.7802 8.7802 10.5657 10.5657 11.8531 11.8531 k =-0.2723 0.9110 0.3160 ( 4108 PWs) bands (ev): -47.5498 -47.5498 -47.5483 -47.5483 -19.6594 -19.6594 -19.6522 -19.6522 -19.4888 -19.4888 -19.4705 -19.4705 -19.4096 -19.4096 -19.3952 -19.3952 -15.7763 -15.7763 -15.5579 -15.5579 -3.2629 -3.2629 -2.6760 -2.6760 -0.0996 -0.0996 0.2774 0.2774 0.9545 0.9545 1.0559 1.0559 7.9694 7.9694 8.8089 8.8089 10.5848 10.5848 11.8560 11.8560 k =-0.2723 0.9110 0.3346 ( 4107 PWs) bands (ev): -47.5497 -47.5497 -47.5482 -47.5482 -19.6583 -19.6583 -19.6513 -19.6513 -19.4891 -19.4891 -19.4700 -19.4700 -19.4108 -19.4108 -19.3958 -19.3958 -15.7739 -15.7739 -15.5603 -15.5603 -3.2534 -3.2534 -2.6791 -2.6791 -0.0852 -0.0852 0.2824 0.2824 0.9289 0.9289 1.0239 1.0239 8.0199 8.0199 8.8393 8.8393 10.6030 10.6030 11.8592 11.8592 k =-0.2723 0.9110 0.3532 ( 4105 PWs) bands (ev): -47.5496 -47.5496 -47.5481 -47.5481 -19.6573 -19.6573 -19.6504 -19.6504 -19.4893 -19.4893 -19.4696 -19.4696 -19.4120 -19.4120 -19.3965 -19.3965 -15.7715 -15.7715 -15.5627 -15.5627 -3.2435 -3.2435 -2.6824 -2.6824 -0.0704 -0.0704 0.2873 0.2873 0.9031 0.9031 0.9915 0.9915 8.0720 8.0720 8.8712 8.8712 10.6202 10.6202 11.8630 11.8630 k =-0.2723 0.9110 0.3717 ( 4109 PWs) bands (ev): -47.5495 -47.5495 -47.5481 -47.5481 -19.6563 -19.6563 -19.6496 -19.6496 -19.4896 -19.4896 -19.4692 -19.4692 -19.4132 -19.4132 -19.3972 -19.3972 -15.7689 -15.7689 -15.5653 -15.5653 -3.2332 -3.2332 -2.6861 -2.6861 -0.0552 -0.0552 0.2919 0.2919 0.8773 0.8773 0.9589 0.9589 8.1257 8.1257 8.9047 8.9047 10.6361 10.6361 11.8672 11.8672 k =-0.2723 0.9110 0.3903 ( 4104 PWs) bands (ev): -47.5494 -47.5494 -47.5480 -47.5480 -19.6553 -19.6553 -19.6487 -19.6487 -19.4898 -19.4898 -19.4688 -19.4688 -19.4144 -19.4144 -19.3978 -19.3978 -15.7663 -15.7663 -15.5680 -15.5680 -3.2225 -3.2225 -2.6900 -2.6900 -0.0397 -0.0397 0.2962 0.2962 0.8517 0.8517 0.9263 0.9263 8.1809 8.1809 8.9396 8.9396 10.6504 10.6504 11.8720 11.8720 k =-0.2723 0.9110 0.4089 ( 4108 PWs) bands (ev): -47.5493 -47.5493 -47.5480 -47.5480 -19.6543 -19.6543 -19.6478 -19.6478 -19.4900 -19.4900 -19.4685 -19.4685 -19.4155 -19.4155 -19.3985 -19.3985 -15.7635 -15.7635 -15.5708 -15.5708 -3.2115 -3.2115 -2.6941 -2.6941 -0.0241 -0.0241 0.3001 0.3001 0.8264 0.8264 0.8940 0.8940 8.2376 8.2376 8.9759 8.9759 10.6629 10.6629 11.8773 11.8773 k =-0.2723 0.9110 0.4275 ( 4101 PWs) bands (ev): -47.5492 -47.5492 -47.5479 -47.5479 -19.6533 -19.6533 -19.6470 -19.6470 -19.4901 -19.4901 -19.4682 -19.4682 -19.4165 -19.4165 -19.3991 -19.3991 -15.7605 -15.7605 -15.5737 -15.5737 -3.2002 -3.2002 -2.6985 -2.6985 -0.0082 -0.0082 0.3035 0.3035 0.8016 0.8016 0.8619 0.8619 8.2955 8.2955 9.0137 9.0137 10.6733 10.6733 11.8833 11.8833 k =-0.2723 0.9110 0.4461 ( 4103 PWs) bands (ev): -47.5491 -47.5491 -47.5478 -47.5478 -19.6523 -19.6523 -19.6461 -19.6461 -19.4903 -19.4903 -19.4680 -19.4680 -19.4175 -19.4175 -19.3998 -19.3998 -15.7575 -15.7575 -15.5767 -15.5767 -3.1886 -3.1886 -2.7033 -2.7033 0.0077 0.0077 0.3064 0.3064 0.7774 0.7774 0.8304 0.8304 8.3547 8.3547 9.0527 9.0527 10.6815 10.6815 11.8900 11.8900 k =-0.2723 0.9110 0.4647 ( 4097 PWs) bands (ev): -47.5489 -47.5489 -47.5478 -47.5478 -19.6514 -19.6514 -19.6453 -19.6453 -19.4903 -19.4903 -19.4678 -19.4678 -19.4183 -19.4183 -19.4005 -19.4005 -15.7544 -15.7544 -15.5799 -15.5799 -3.1767 -3.1767 -2.7083 -2.7083 0.0236 0.0236 0.3085 0.3085 0.7542 0.7542 0.7996 0.7996 8.4151 8.4151 9.0931 9.0931 10.6871 10.6871 11.8973 11.8973 k =-0.2723 0.9110 0.4833 ( 4101 PWs) bands (ev): -47.5488 -47.5488 -47.5477 -47.5477 -19.6505 -19.6505 -19.6446 -19.6446 -19.4904 -19.4904 -19.4677 -19.4677 -19.4191 -19.4191 -19.4012 -19.4012 -15.7512 -15.7512 -15.5831 -15.5831 -3.1646 -3.1646 -2.7137 -2.7137 0.0393 0.0393 0.3098 0.3098 0.7319 0.7319 0.7696 0.7696 8.4767 8.4767 9.1346 9.1346 10.6900 10.6900 11.9054 11.9054 k =-0.2723 0.9110 0.5019 ( 4095 PWs) bands (ev): -47.5487 -47.5487 -47.5477 -47.5477 -19.6496 -19.6496 -19.6438 -19.6438 -19.4904 -19.4904 -19.4677 -19.4677 -19.4198 -19.4198 -19.4018 -19.4018 -15.7479 -15.7479 -15.5864 -15.5864 -3.1523 -3.1523 -2.7193 -2.7193 0.0549 0.0549 0.3103 0.3103 0.7109 0.7109 0.7407 0.7407 8.5393 8.5393 9.1772 9.1772 10.6901 10.6901 11.9142 11.9142 k =-0.2723 0.9110 0.5204 ( 4091 PWs) bands (ev): -47.5486 -47.5486 -47.5476 -47.5476 -19.6487 -19.6487 -19.6431 -19.6431 -19.4903 -19.4903 -19.4677 -19.4677 -19.4204 -19.4204 -19.4025 -19.4025 -15.7445 -15.7445 -15.5899 -15.5899 -3.1397 -3.1397 -2.7253 -2.7253 0.0701 0.0701 0.3097 0.3097 0.6912 0.6912 0.7129 0.7129 8.6031 8.6031 9.2209 9.2209 10.6871 10.6871 11.9236 11.9236 k =-0.2723 0.9110 0.5390 ( 4087 PWs) bands (ev): -47.5485 -47.5485 -47.5475 -47.5475 -19.6479 -19.6479 -19.6424 -19.6424 -19.4902 -19.4902 -19.4678 -19.4678 -19.4209 -19.4209 -19.4031 -19.4031 -15.7410 -15.7410 -15.5934 -15.5934 -3.1271 -3.1271 -2.7315 -2.7315 0.0848 0.0848 0.3081 0.3081 0.6729 0.6729 0.6864 0.6864 8.6679 8.6679 9.2656 9.2656 10.6811 10.6811 11.8767 11.8767 k =-0.2723 0.9110 0.5576 ( 4083 PWs) bands (ev): -47.5484 -47.5484 -47.5475 -47.5475 -19.6471 -19.6471 -19.6418 -19.6418 -19.4901 -19.4901 -19.4680 -19.4680 -19.4213 -19.4213 -19.4038 -19.4038 -15.7374 -15.7374 -15.5970 -15.5970 -3.1142 -3.1142 -2.7381 -2.7381 0.0990 0.0990 0.3054 0.3054 0.6560 0.6560 0.6616 0.6616 8.7339 8.7339 9.3111 9.3111 10.6719 10.6719 11.7822 11.7822 k =-0.2723 0.9110 0.5762 ( 4087 PWs) bands (ev): -47.5483 -47.5483 -47.5474 -47.5474 -19.6463 -19.6463 -19.6412 -19.6412 -19.4900 -19.4900 -19.4683 -19.4683 -19.4216 -19.4216 -19.4044 -19.4044 -15.7337 -15.7337 -15.6007 -15.6007 -3.1013 -3.1013 -2.7450 -2.7450 0.1125 0.1125 0.3017 0.3017 0.6376 0.6376 0.6415 0.6415 8.8009 8.8009 9.3575 9.3575 10.6596 10.6596 11.6835 11.6835 k =-0.2723 0.9110 0.5948 ( 4089 PWs) bands (ev): -47.5482 -47.5482 -47.5474 -47.5474 -19.6456 -19.6456 -19.6407 -19.6407 -19.4898 -19.4898 -19.4687 -19.4687 -19.4218 -19.4218 -19.4051 -19.4051 -15.7300 -15.7300 -15.6045 -15.6045 -3.0883 -3.0883 -2.7522 -2.7522 0.1252 0.1252 0.2969 0.2969 0.6163 0.6163 0.6276 0.6276 8.8690 8.8690 9.4045 9.4045 10.6441 10.6441 11.5817 11.5817 k =-0.2723 0.9110 0.6134 ( 4087 PWs) bands (ev): -47.5481 -47.5481 -47.5473 -47.5473 -19.6450 -19.6450 -19.6402 -19.6402 -19.4895 -19.4895 -19.4691 -19.4691 -19.4219 -19.4219 -19.4057 -19.4057 -15.7262 -15.7262 -15.6083 -15.6083 -3.0752 -3.0752 -2.7598 -2.7598 0.1370 0.1370 0.2911 0.2911 0.5967 0.5967 0.6155 0.6155 8.9383 8.9383 9.4522 9.4522 10.6255 10.6255 11.4775 11.4775 k =-0.2723 0.9110 0.6320 ( 4087 PWs) bands (ev): -47.5480 -47.5480 -47.5473 -47.5473 -19.6443 -19.6443 -19.6398 -19.6398 -19.4892 -19.4892 -19.4696 -19.4696 -19.4219 -19.4219 -19.4063 -19.4063 -15.7223 -15.7223 -15.6122 -15.6122 -3.0620 -3.0620 -2.7677 -2.7677 0.1477 0.1477 0.2846 0.2846 0.5792 0.5792 0.6047 0.6047 9.0087 9.0087 9.5003 9.5003 10.6040 10.6040 11.3718 11.3718 k =-0.2723 0.9110 0.6506 ( 4087 PWs) bands (ev): -47.5479 -47.5479 -47.5473 -47.5473 -19.6437 -19.6437 -19.6394 -19.6394 -19.4889 -19.4889 -19.4701 -19.4701 -19.4218 -19.4218 -19.4069 -19.4069 -15.7183 -15.7183 -15.6162 -15.6162 -3.0489 -3.0489 -2.7759 -2.7759 0.1573 0.1573 0.2775 0.2775 0.5639 0.5639 0.5953 0.5953 9.0803 9.0803 9.5489 9.5489 10.5797 10.5797 11.2652 11.2652 k =-0.2723 0.9110 0.6691 ( 4088 PWs) bands (ev): -47.5479 -47.5479 -47.5472 -47.5472 -19.6432 -19.6432 -19.6391 -19.6391 -19.4885 -19.4885 -19.4707 -19.4707 -19.4217 -19.4217 -19.4075 -19.4075 -15.7143 -15.7143 -15.6202 -15.6202 -3.0357 -3.0357 -2.7844 -2.7844 0.1657 0.1657 0.2699 0.2699 0.5508 0.5508 0.5869 0.5869 9.1532 9.1532 9.5978 9.5978 10.5526 10.5526 11.1584 11.1584 k =-0.2723 0.9110 0.6877 ( 4090 PWs) bands (ev): -47.5478 -47.5478 -47.5472 -47.5472 -19.6427 -19.6427 -19.6389 -19.6389 -19.4881 -19.4881 -19.4714 -19.4714 -19.4215 -19.4215 -19.4082 -19.4082 -15.7102 -15.7102 -15.6243 -15.6243 -3.0226 -3.0226 -2.7932 -2.7932 0.1728 0.1728 0.2621 0.2621 0.5399 0.5399 0.5795 0.5795 9.2274 9.2274 9.6469 9.6469 10.5231 10.5231 11.0518 11.0518 k =-0.2723 0.9110 0.7063 ( 4096 PWs) bands (ev): -47.5477 -47.5477 -47.5472 -47.5472 -19.6422 -19.6422 -19.6387 -19.6387 -19.4877 -19.4877 -19.4720 -19.4720 -19.4212 -19.4212 -19.4088 -19.4088 -15.7061 -15.7061 -15.6285 -15.6285 -3.0095 -3.0095 -2.8023 -2.8023 0.1788 0.1788 0.2543 0.2543 0.5313 0.5313 0.5728 0.5728 9.3030 9.3030 9.6961 9.6961 10.4912 10.4912 10.9459 10.9459 k =-0.2723 0.9110 0.7249 ( 4096 PWs) bands (ev): -47.5476 -47.5476 -47.5472 -47.5472 -19.6418 -19.6418 -19.6385 -19.6385 -19.4872 -19.4872 -19.4727 -19.4727 -19.4209 -19.4209 -19.4094 -19.4094 -15.7019 -15.7019 -15.6327 -15.6327 -2.9965 -2.9965 -2.8118 -2.8118 0.1836 0.1836 0.2466 0.2466 0.5249 0.5249 0.5667 0.5667 9.3800 9.3800 9.7454 9.7454 10.4571 10.4571 10.8409 10.8409 k =-0.2723 0.9110 0.7435 ( 4094 PWs) bands (ev): -47.5476 -47.5476 -47.5472 -47.5472 -19.6414 -19.6414 -19.6384 -19.6384 -19.4868 -19.4868 -19.4734 -19.4734 -19.4205 -19.4205 -19.4099 -19.4099 -15.6977 -15.6977 -15.6369 -15.6369 -2.9836 -2.9836 -2.8215 -2.8215 0.1874 0.1874 0.2392 0.2392 0.5206 0.5206 0.5610 0.5610 9.4585 9.4585 9.7946 9.7946 10.4210 10.4210 10.7371 10.7371 k =-0.2723 0.9110 0.7621 ( 4094 PWs) bands (ev): -47.5475 -47.5475 -47.5472 -47.5472 -19.6410 -19.6410 -19.6383 -19.6383 -19.4863 -19.4863 -19.4740 -19.4740 -19.4202 -19.4202 -19.4104 -19.4104 -15.6934 -15.6934 -15.6412 -15.6412 -2.9708 -2.9708 -2.8315 -2.8315 0.1904 0.1904 0.2323 0.2323 0.5180 0.5180 0.5558 0.5558 9.5385 9.5385 9.8436 9.8436 10.3831 10.3831 10.6348 10.6348 k =-0.2723 0.9110 0.7807 ( 4092 PWs) bands (ev): -47.5475 -47.5475 -47.5472 -47.5472 -19.6406 -19.6406 -19.6382 -19.6382 -19.4858 -19.4858 -19.4746 -19.4746 -19.4198 -19.4198 -19.4109 -19.4109 -15.6891 -15.6891 -15.6455 -15.6455 -2.9581 -2.9581 -2.8418 -2.8418 0.1927 0.1927 0.2259 0.2259 0.5171 0.5171 0.5507 0.5507 9.6201 9.6201 9.8925 9.8925 10.3435 10.3435 10.5341 10.5341 k =-0.2723 0.9110 0.7993 ( 4092 PWs) bands (ev): -47.5474 -47.5474 -47.5472 -47.5472 -19.6404 -19.6404 -19.6382 -19.6382 -19.4854 -19.4854 -19.4752 -19.4752 -19.4195 -19.4195 -19.4114 -19.4114 -15.6848 -15.6848 -15.6498 -15.6498 -2.9456 -2.9456 -2.8524 -2.8524 0.1947 0.1947 0.2201 0.2201 0.5175 0.5175 0.5459 0.5459 9.7033 9.7033 9.9409 9.9409 10.3023 10.3023 10.4353 10.4353 k =-0.2723 0.9110 0.8178 ( 4098 PWs) bands (ev): -47.5474 -47.5474 -47.5472 -47.5472 -19.6402 -19.6402 -19.6382 -19.6382 -19.4850 -19.4850 -19.4757 -19.4757 -19.4192 -19.4192 -19.4117 -19.4117 -15.6804 -15.6804 -15.6542 -15.6542 -2.9332 -2.9332 -2.8632 -2.8632 0.1966 0.1966 0.2150 0.2150 0.5190 0.5190 0.5413 0.5413 9.7882 9.7882 9.9890 9.9890 10.2592 10.2592 10.3387 10.3387 k =-0.2723 0.9110 0.8364 ( 4104 PWs) bands (ev): -47.5473 -47.5473 -47.5472 -47.5472 -19.6400 -19.6400 -19.6382 -19.6382 -19.4847 -19.4847 -19.4761 -19.4761 -19.4190 -19.4190 -19.4121 -19.4121 -15.6761 -15.6761 -15.6586 -15.6586 -2.9210 -2.9210 -2.8743 -2.8743 0.1985 0.1985 0.2106 0.2106 0.5213 0.5213 0.5368 0.5368 9.8747 9.8747 10.0367 10.0367 10.2120 10.2120 10.2468 10.2468 k =-0.2723 0.9110 0.8550 ( 4108 PWs) bands (ev): -47.5473 -47.5473 -47.5472 -47.5472 -19.6399 -19.6399 -19.6382 -19.6382 -19.4845 -19.4845 -19.4764 -19.4764 -19.4188 -19.4188 -19.4123 -19.4123 -15.6717 -15.6717 -15.6629 -15.6629 -2.9090 -2.9090 -2.8856 -2.8856 0.2005 0.2005 0.2069 0.2069 0.5243 0.5243 0.5327 0.5327 9.9628 9.9628 10.0839 10.0839 10.1413 10.1413 10.1793 10.1793 k =-0.2723 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6399 -19.6399 -19.6382 -19.6382 -19.4844 -19.4844 -19.4764 -19.4764 -19.4188 -19.4188 -19.4124 -19.4124 -15.6674 -15.6674 -15.6673 -15.6673 -2.8973 -2.8973 -2.8971 -2.8971 0.2021 0.2021 0.2049 0.2049 0.5265 0.5265 0.5301 0.5301 10.0513 10.0513 10.0532 10.0532 10.1306 10.1306 10.1311 10.1311 k =-0.2723 0.9110 0.8736 ( 4108 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6399 -19.6399 -19.6382 -19.6382 -19.4844 -19.4844 -19.4764 -19.4764 -19.4188 -19.4188 -19.4124 -19.4124 -15.6674 -15.6674 -15.6673 -15.6673 -2.8973 -2.8973 -2.8971 -2.8971 0.2021 0.2021 0.2049 0.2049 0.5265 0.5265 0.5301 0.5301 10.0513 10.0513 10.0532 10.0532 10.1306 10.1306 10.1311 10.1311 k =-0.2776 0.8933 0.8736 ( 4100 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6402 -19.6402 -19.6382 -19.6382 -19.4851 -19.4851 -19.4756 -19.4756 -19.4193 -19.4193 -19.4117 -19.4117 -15.6672 -15.6672 -15.6671 -15.6671 -2.9008 -2.9008 -2.9006 -2.9006 0.2094 0.2094 0.2122 0.2122 0.5265 0.5265 0.5301 0.5301 9.9808 9.9808 9.9844 9.9844 10.1801 10.1801 10.1809 10.1809 k =-0.2829 0.8756 0.8736 ( 4096 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6407 -19.6407 -19.6383 -19.6383 -19.4858 -19.4858 -19.4747 -19.4747 -19.4198 -19.4198 -19.4110 -19.4110 -15.6670 -15.6670 -15.6669 -15.6669 -2.9047 -2.9047 -2.9045 -2.9045 0.2170 0.2170 0.2199 0.2199 0.5271 0.5271 0.5308 0.5308 9.8995 9.8995 9.9033 9.9033 10.2424 10.2424 10.2434 10.2434 k =-0.2882 0.8579 0.8736 ( 4092 PWs) bands (ev): -47.5473 -47.5473 -47.5473 -47.5473 -19.6411 -19.6411 -19.6384 -19.6384 -19.4864 -19.4864 -19.4738 -19.4738 -19.4203 -19.4203 -19.4104 -19.4104 -15.6668 -15.6668 -15.6667 -15.6667 -2.9089 -2.9089 -2.9087 -2.9087 0.2248 0.2248 0.2277 0.2277 0.5286 0.5286 0.5324 0.5324 9.8178 9.8178 9.8218 9.8218 10.3062 10.3062 10.3070 10.3070 k =-0.2935 0.8402 0.8736 ( 4096 PWs) bands (ev): -47.5474 -47.5474 -47.5474 -47.5474 -19.6416 -19.6416 -19.6385 -19.6385 -19.4870 -19.4870 -19.4730 -19.4730 -19.4208 -19.4208 -19.4098 -19.4098 -15.6666 -15.6666 -15.6665 -15.6665 -2.9134 -2.9134 -2.9132 -2.9132 0.2325 0.2325 0.2353 0.2353 0.5313 0.5313 0.5350 0.5350 9.7369 9.7369 9.7410 9.7410 10.3698 10.3698 10.3705 10.3705 k =-0.2988 0.8225 0.8736 ( 4100 PWs) bands (ev): -47.5474 -47.5474 -47.5474 -47.5474 -19.6422 -19.6422 -19.6388 -19.6388 -19.4876 -19.4876 -19.4722 -19.4722 -19.4213 -19.4213 -19.4092 -19.4092 -15.6664 -15.6664 -15.6663 -15.6663 -2.9182 -2.9182 -2.9180 -2.9180 0.2397 0.2397 0.2425 0.2425 0.5352 0.5352 0.5389 0.5389 9.6570 9.6570 9.6612 9.6612 10.4326 10.4326 10.4332 10.4332 k =-0.3041 0.8048 0.8736 ( 4088 PWs) bands (ev): -47.5475 -47.5475 -47.5475 -47.5475 -19.6427 -19.6427 -19.6390 -19.6390 -19.4880 -19.4880 -19.4713 -19.4713 -19.4216 -19.4216 -19.4085 -19.4085 -15.6661 -15.6661 -15.6660 -15.6660 -2.9233 -2.9233 -2.9231 -2.9231 0.2464 0.2464 0.2491 0.2491 0.5408 0.5408 0.5445 0.5445 9.5783 9.5783 9.5825 9.5825 10.4942 10.4942 10.4947 10.4947 k =-0.3094 0.7871 0.8736 ( 4092 PWs) bands (ev): -47.5475 -47.5475 -47.5475 -47.5475 -19.6433 -19.6433 -19.6393 -19.6393 -19.4885 -19.4885 -19.4706 -19.4706 -19.4219 -19.4219 -19.4079 -19.4079 -15.6659 -15.6659 -15.6658 -15.6658 -2.9286 -2.9286 -2.9284 -2.9284 0.2522 0.2522 0.2548 0.2548 0.5482 0.5482 0.5518 0.5518 9.5008 9.5008 9.5050 9.5050 10.5542 10.5542 10.5546 10.5546 k =-0.3147 0.7693 0.8736 ( 4092 PWs) bands (ev): -47.5476 -47.5476 -47.5476 -47.5476 -19.6440 -19.6440 -19.6397 -19.6397 -19.4889 -19.4889 -19.4699 -19.4699 -19.4221 -19.4221 -19.4073 -19.4073 -15.6656 -15.6656 -15.6656 -15.6656 -2.9342 -2.9342 -2.9341 -2.9341 0.2569 0.2569 0.2593 0.2593 0.5577 0.5577 0.5612 0.5612 9.4244 9.4244 9.4287 9.4287 10.6121 10.6121 10.6125 10.6125 k =-0.3200 0.7516 0.8736 ( 4092 PWs) bands (ev): -47.5476 -47.5476 -47.5476 -47.5476 -19.6446 -19.6446 -19.6401 -19.6401 -19.4893 -19.4893 -19.4693 -19.4693 -19.4223 -19.4223 -19.4067 -19.4067 -15.6654 -15.6654 -15.6653 -15.6653 -2.9401 -2.9401 -2.9399 -2.9399 0.2603 0.2603 0.2625 0.2625 0.5695 0.5695 0.5728 0.5728 9.3493 9.3493 9.3536 9.3536 10.6677 10.6677 10.6679 10.6679 k =-0.3253 0.7339 0.8736 ( 4088 PWs) bands (ev): -47.5477 -47.5477 -47.5477 -47.5477 -19.6453 -19.6453 -19.6406 -19.6406 -19.4896 -19.4896 -19.4687 -19.4687 -19.4223 -19.4223 -19.4060 -19.4060 -15.6651 -15.6651 -15.6650 -15.6650 -2.9461 -2.9461 -2.9460 -2.9460 0.2622 0.2622 0.2643 0.2643 0.5836 0.5836 0.5867 0.5867 9.2754 9.2754 9.2797 9.2797 10.7205 10.7205 10.7206 10.7206 k =-0.3306 0.7162 0.8736 ( 4084 PWs) bands (ev): -47.5478 -47.5478 -47.5478 -47.5478 -19.6460 -19.6460 -19.6412 -19.6412 -19.4898 -19.4898 -19.4682 -19.4682 -19.4222 -19.4222 -19.4054 -19.4054 -15.6648 -15.6648 -15.6648 -15.6648 -2.9524 -2.9524 -2.9522 -2.9522 0.2628 0.2628 0.2646 0.2646 0.6000 0.6000 0.6029 0.6029 9.2027 9.2027 9.2071 9.2071 10.7701 10.7701 10.7702 10.7702 k =-0.3359 0.6985 0.8736 ( 4084 PWs) bands (ev): -47.5478 -47.5478 -47.5478 -47.5478 -19.6468 -19.6468 -19.6418 -19.6418 -19.4900 -19.4900 -19.4677 -19.4677 -19.4221 -19.4221 -19.4047 -19.4047 -15.6645 -15.6645 -15.6645 -15.6645 -2.9588 -2.9588 -2.9586 -2.9586 0.2619 0.2619 0.2634 0.2634 0.6186 0.6186 0.6213 0.6213 9.1312 9.1312 9.1356 9.1356 10.8163 10.8163 10.8164 10.8164 k =-0.3412 0.6808 0.8736 ( 4084 PWs) bands (ev): -47.5479 -47.5479 -47.5479 -47.5479 -19.6476 -19.6476 -19.6425 -19.6425 -19.4902 -19.4902 -19.4674 -19.4674 -19.4218 -19.4218 -19.4041 -19.4041 -15.6643 -15.6643 -15.6642 -15.6642 -2.9653 -2.9653 -2.9652 -2.9652 0.2597 0.2597 0.2610 0.2610 0.6393 0.6393 0.6418 0.6418 9.0611 9.0611 9.0655 9.0655 10.8589 10.8589 10.8590 10.8590 k =-0.3465 0.6631 0.8736 ( 4084 PWs) bands (ev): -47.5480 -47.5480 -47.5480 -47.5480 -19.6484 -19.6484 -19.6432 -19.6432 -19.4903 -19.4903 -19.4671 -19.4671 -19.4215 -19.4215 -19.4035 -19.4035 -15.6640 -15.6640 -15.6639 -15.6639 -2.9720 -2.9720 -2.9719 -2.9719 0.2563 0.2563 0.2574 0.2574 0.6620 0.6620 0.6642 0.6642 8.9922 8.9922 8.9966 8.9966 10.8977 10.8977 10.8977 10.8977 k =-0.3518 0.6454 0.8736 ( 4080 PWs) bands (ev): -47.5480 -47.5480 -47.5480 -47.5480 -19.6493 -19.6493 -19.6440 -19.6440 -19.4903 -19.4903 -19.4669 -19.4669 -19.4210 -19.4210 -19.4028 -19.4028 -15.6637 -15.6637 -15.6636 -15.6636 -2.9788 -2.9788 -2.9787 -2.9787 0.2518 0.2518 0.2527 0.2527 0.6863 0.6863 0.6883 0.6883 8.9247 8.9247 8.9290 8.9290 10.9326 10.9326 10.9326 10.9326 k =-0.3571 0.6277 0.8736 ( 4072 PWs) bands (ev): -47.5481 -47.5481 -47.5481 -47.5481 -19.6502 -19.6502 -19.6448 -19.6448 -19.4903 -19.4903 -19.4668 -19.4668 -19.4203 -19.4203 -19.4021 -19.4021 -15.6634 -15.6634 -15.6633 -15.6633 -2.9857 -2.9857 -2.9856 -2.9856 0.2465 0.2465 0.2472 0.2472 0.7122 0.7122 0.7141 0.7141 8.8585 8.8585 8.8628 8.8628 10.9635 10.9635 10.9636 10.9636 k =-0.3623 0.6099 0.8736 ( 4064 PWs) bands (ev): -47.5482 -47.5482 -47.5482 -47.5482 -19.6511 -19.6511 -19.6457 -19.6457 -19.4902 -19.4902 -19.4668 -19.4668 -19.4196 -19.4196 -19.4014 -19.4014 -15.6631 -15.6631 -15.6631 -15.6631 -2.9926 -2.9926 -2.9925 -2.9925 0.2404 0.2404 0.2410 0.2410 0.7393 0.7393 0.7410 0.7410 8.7937 8.7937 8.7979 8.7979 10.9906 10.9906 10.9907 10.9907 k =-0.3676 0.5922 0.8736 ( 4062 PWs) bands (ev): -47.5483 -47.5483 -47.5483 -47.5483 -19.6520 -19.6520 -19.6466 -19.6466 -19.4901 -19.4901 -19.4668 -19.4668 -19.4188 -19.4188 -19.4008 -19.4008 -15.6628 -15.6628 -15.6628 -15.6628 -2.9995 -2.9995 -2.9994 -2.9994 0.2337 0.2337 0.2341 0.2341 0.7676 0.7676 0.7691 0.7691 8.7303 8.7303 8.7345 8.7345 11.0140 11.0140 11.0142 11.0142 k =-0.3729 0.5745 0.8736 ( 4054 PWs) bands (ev): -47.5483 -47.5483 -47.5483 -47.5483 -19.6529 -19.6529 -19.6476 -19.6476 -19.4899 -19.4899 -19.4670 -19.4670 -19.4178 -19.4178 -19.4001 -19.4001 -15.6625 -15.6625 -15.6625 -15.6625 -3.0064 -3.0064 -3.0063 -3.0063 0.2265 0.2265 0.2268 0.2268 0.7968 0.7968 0.7982 0.7982 8.6685 8.6685 8.6726 8.6726 11.0340 11.0340 11.0341 11.0341 k =-0.3782 0.5568 0.8736 ( 4066 PWs) bands (ev): -47.5484 -47.5484 -47.5484 -47.5484 -19.6539 -19.6539 -19.6486 -19.6486 -19.4898 -19.4898 -19.4672 -19.4672 -19.4169 -19.4169 -19.3995 -19.3995 -15.6623 -15.6623 -15.6622 -15.6622 -3.0133 -3.0133 -3.0132 -3.0132 0.2189 0.2189 0.2191 0.2191 0.8266 0.8266 0.8279 0.8279 8.6082 8.6082 8.6122 8.6122 11.0506 11.0506 11.0508 11.0508 k =-0.3835 0.5391 0.8736 ( 4074 PWs) bands (ev): -47.5485 -47.5485 -47.5485 -47.5485 -19.6549 -19.6549 -19.6497 -19.6497 -19.4897 -19.4897 -19.4675 -19.4675 -19.4159 -19.4159 -19.3988 -19.3988 -15.6620 -15.6620 -15.6619 -15.6619 -3.0201 -3.0201 -3.0200 -3.0200 0.2111 0.2111 0.2111 0.2111 0.8569 0.8569 0.8581 0.8581 8.5495 8.5495 8.5534 8.5534 11.0643 11.0643 11.0646 11.0646 k =-0.3888 0.5214 0.8736 ( 4082 PWs) bands (ev): -47.5486 -47.5486 -47.5486 -47.5486 -19.6559 -19.6559 -19.6508 -19.6508 -19.4894 -19.4894 -19.4679 -19.4679 -19.4149 -19.4149 -19.3983 -19.3983 -15.6617 -15.6617 -15.6617 -15.6617 -3.0268 -3.0268 -3.0268 -3.0268 0.2030 0.2030 0.2031 0.2031 0.8876 0.8876 0.8887 0.8887 8.4925 8.4925 8.4963 8.4963 11.0752 11.0752 11.0756 11.0756 k =-0.3941 0.5037 0.8736 ( 4082 PWs) bands (ev): -47.5487 -47.5487 -47.5487 -47.5487 -19.6568 -19.6568 -19.6519 -19.6519 -19.4891 -19.4891 -19.4683 -19.4683 -19.4137 -19.4137 -19.3976 -19.3976 -15.6615 -15.6615 -15.6614 -15.6614 -3.0335 -3.0335 -3.0334 -3.0334 0.1948 0.1948 0.1949 0.1949 0.9185 0.9185 0.9195 0.9195 8.4372 8.4372 8.4410 8.4410 11.0837 11.0837 11.0841 11.0841 k =-0.3994 0.4860 0.8736 ( 4086 PWs) bands (ev): -47.5488 -47.5488 -47.5488 -47.5488 -19.6578 -19.6578 -19.6530 -19.6530 -19.4888 -19.4888 -19.4687 -19.4687 -19.4125 -19.4125 -19.3970 -19.3970 -15.6612 -15.6612 -15.6612 -15.6612 -3.0400 -3.0400 -3.0399 -3.0399 0.1867 0.1867 0.1868 0.1868 0.9494 0.9494 0.9503 0.9503 8.3838 8.3838 8.3874 8.3874 11.0901 11.0901 11.0906 11.0906 k =-0.4047 0.4683 0.8736 ( 4094 PWs) bands (ev): -47.5489 -47.5489 -47.5489 -47.5489 -19.6588 -19.6588 -19.6542 -19.6542 -19.4885 -19.4885 -19.4692 -19.4692 -19.4113 -19.4113 -19.3965 -19.3965 -15.6610 -15.6610 -15.6609 -15.6609 -3.0463 -3.0463 -3.0463 -3.0463 0.1785 0.1785 0.1787 0.1787 0.9800 0.9800 0.9808 0.9808 8.3323 8.3323 8.3358 8.3358 11.0946 11.0946 11.0951 11.0951 k =-0.4100 0.4506 0.8736 ( 4098 PWs) bands (ev): -47.5489 -47.5489 -47.5489 -47.5489 -19.6597 -19.6597 -19.6553 -19.6553 -19.4882 -19.4882 -19.4697 -19.4697 -19.4100 -19.4100 -19.3959 -19.3959 -15.6607 -15.6607 -15.6607 -15.6607 -3.0525 -3.0525 -3.0524 -3.0524 0.1705 0.1705 0.1707 0.1707 1.0103 1.0103 1.0110 1.0110 8.2828 8.2828 8.2861 8.2861 11.0975 11.0975 11.0980 11.0980 k =-0.4153 0.4328 0.8736 ( 4098 PWs) bands (ev): -47.5490 -47.5490 -47.5490 -47.5490 -19.6606 -19.6606 -19.6564 -19.6564 -19.4878 -19.4878 -19.4702 -19.4702 -19.4088 -19.4088 -19.3954 -19.3954 -15.6605 -15.6605 -15.6604 -15.6604 -3.0584 -3.0584 -3.0584 -3.0584 0.1627 0.1627 0.1630 0.1630 1.0400 1.0400 1.0407 1.0407 8.2354 8.2354 8.2385 8.2385 11.0990 11.0990 11.0996 11.0996 k =-0.4206 0.4151 0.8736 ( 4098 PWs) bands (ev): -47.5491 -47.5491 -47.5491 -47.5491 -19.6615 -19.6615 -19.6575 -19.6575 -19.4873 -19.4873 -19.4708 -19.4708 -19.4075 -19.4075 -19.3949 -19.3949 -15.6603 -15.6603 -15.6602 -15.6602 -3.0641 -3.0641 -3.0641 -3.0641 0.1552 0.1552 0.1554 0.1554 1.0690 1.0690 1.0697 1.0697 8.1901 8.1901 8.1931 8.1931 11.0994 11.0994 11.1000 11.1000 k =-0.4259 0.3974 0.8736 ( 4098 PWs) bands (ev): -47.5492 -47.5492 -47.5492 -47.5492 -19.6624 -19.6624 -19.6586 -19.6586 -19.4869 -19.4869 -19.4713 -19.4713 -19.4062 -19.4062 -19.3944 -19.3944 -15.6600 -15.6600 -15.6600 -15.6600 -3.0696 -3.0696 -3.0695 -3.0695 0.1479 0.1479 0.1481 0.1481 1.0972 1.0972 1.0978 1.0978 8.1472 8.1472 8.1500 8.1500 11.0988 11.0988 11.0995 11.0995 k =-0.4312 0.3797 0.8736 ( 4102 PWs) bands (ev): -47.5492 -47.5492 -47.5492 -47.5492 -19.6632 -19.6632 -19.6596 -19.6596 -19.4865 -19.4865 -19.4719 -19.4719 -19.4050 -19.4050 -19.3939 -19.3939 -15.6598 -15.6598 -15.6598 -15.6598 -3.0748 -3.0748 -3.0747 -3.0747 0.1409 0.1409 0.1412 0.1412 1.1242 1.1242 1.1248 1.1248 8.1066 8.1066 8.1093 8.1093 11.0975 11.0975 11.0982 11.0982 k =-0.4365 0.3620 0.8736 ( 4114 PWs) bands (ev): -47.5493 -47.5493 -47.5493 -47.5493 -19.6640 -19.6640 -19.6607 -19.6607 -19.4860 -19.4860 -19.4725 -19.4725 -19.4038 -19.4038 -19.3936 -19.3936 -15.6597 -15.6597 -15.6596 -15.6596 -3.0796 -3.0796 -3.0796 -3.0796 0.1343 0.1343 0.1345 0.1345 1.1500 1.1500 1.1505 1.1505 8.0685 8.0685 8.0710 8.0710 11.0956 11.0956 11.0963 11.0963 k =-0.4418 0.3443 0.8736 ( 4118 PWs) bands (ev): -47.5494 -47.5494 -47.5494 -47.5494 -19.6647 -19.6647 -19.6616 -19.6616 -19.4856 -19.4856 -19.4731 -19.4731 -19.4027 -19.4027 -19.3932 -19.3932 -15.6595 -15.6595 -15.6595 -15.6595 -3.0842 -3.0842 -3.0842 -3.0842 0.1280 0.1280 0.1283 0.1283 1.1745 1.1745 1.1749 1.1749 8.0330 8.0330 8.0354 8.0354 11.0934 11.0934 11.0940 11.0940 k =-0.4471 0.3266 0.8736 ( 4114 PWs) bands (ev): -47.5494 -47.5494 -47.5494 -47.5494 -19.6653 -19.6653 -19.6625 -19.6625 -19.4851 -19.4851 -19.4737 -19.4737 -19.4015 -19.4015 -19.3929 -19.3929 -15.6593 -15.6593 -15.6593 -15.6593 -3.0884 -3.0884 -3.0884 -3.0884 0.1223 0.1223 0.1225 0.1225 1.1974 1.1974 1.1978 1.1978 8.0002 8.0002 8.0024 8.0024 11.0908 11.0908 11.0914 11.0914 k =-0.4524 0.3089 0.8736 ( 4122 PWs) bands (ev): -47.5495 -47.5495 -47.5495 -47.5495 -19.6659 -19.6659 -19.6634 -19.6634 -19.4846 -19.4846 -19.4744 -19.4744 -19.4005 -19.4005 -19.3927 -19.3927 -15.6592 -15.6592 -15.6592 -15.6592 -3.0923 -3.0923 -3.0923 -3.0923 0.1170 0.1170 0.1172 0.1172 1.2186 1.2186 1.2190 1.2190 7.9702 7.9702 7.9722 7.9722 11.0882 11.0882 11.0887 11.0887 k =-0.4576 0.2912 0.8736 ( 4122 PWs) bands (ev): -47.5495 -47.5495 -47.5495 -47.5495 -19.6664 -19.6664 -19.6642 -19.6642 -19.4841 -19.4841 -19.4750 -19.4750 -19.3995 -19.3995 -19.3926 -19.3926 -15.6590 -15.6590 -15.6590 -15.6590 -3.0958 -3.0958 -3.0958 -3.0958 0.1122 0.1122 0.1124 0.1124 1.2381 1.2381 1.2384 1.2384 7.9431 7.9431 7.9448 7.9448 11.0855 11.0855 11.0860 11.0860 k =-0.4629 0.2734 0.8736 ( 4126 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6669 -19.6669 -19.6649 -19.6649 -19.4836 -19.4836 -19.4756 -19.4756 -19.3985 -19.3985 -19.3924 -19.3924 -15.6589 -15.6589 -15.6589 -15.6589 -3.0989 -3.0989 -3.0989 -3.0989 0.1079 0.1079 0.1081 0.1081 1.2555 1.2555 1.2558 1.2558 7.9189 7.9189 7.9205 7.9205 11.0829 11.0829 11.0834 11.0834 k =-0.4682 0.2557 0.8736 ( 4130 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6673 -19.6673 -19.6656 -19.6656 -19.4831 -19.4831 -19.4762 -19.4762 -19.3976 -19.3976 -19.3924 -19.3924 -15.6588 -15.6588 -15.6588 -15.6588 -3.1017 -3.1017 -3.1017 -3.1017 0.1041 0.1041 0.1043 0.1043 1.2709 1.2709 1.2712 1.2712 7.8978 7.8978 7.8991 7.8991 11.0805 11.0805 11.0809 11.0809 k =-0.4735 0.2380 0.8736 ( 4128 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6676 -19.6676 -19.6662 -19.6662 -19.4825 -19.4825 -19.4768 -19.4768 -19.3967 -19.3967 -19.3924 -19.3924 -15.6587 -15.6587 -15.6587 -15.6587 -3.1040 -3.1040 -3.1040 -3.1040 0.1009 0.1009 0.1010 0.1010 1.2842 1.2842 1.2844 1.2844 7.8798 7.8798 7.8809 7.8809 11.0783 11.0783 11.0786 11.0786 k =-0.4788 0.2203 0.8736 ( 4112 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6678 -19.6678 -19.6666 -19.6666 -19.4819 -19.4819 -19.4773 -19.4773 -19.3959 -19.3959 -19.3924 -19.3924 -15.6587 -15.6587 -15.6586 -15.6586 -3.1059 -3.1059 -3.1059 -3.1059 0.0983 0.0983 0.0984 0.0984 1.2952 1.2952 1.2953 1.2953 7.8650 7.8650 7.8659 7.8659 11.0764 11.0764 11.0767 11.0767 k =-0.4841 0.2026 0.8736 ( 4104 PWs) bands (ev): -47.5496 -47.5496 -47.5496 -47.5496 -19.6679 -19.6679 -19.6670 -19.6670 -19.4813 -19.4813 -19.4779 -19.4779 -19.3951 -19.3951 -19.3925 -19.3925 -15.6586 -15.6586 -15.6586 -15.6586 -3.1074 -3.1074 -3.1074 -3.1074 0.0962 0.0962 0.0963 0.0963 1.3038 1.3038 1.3039 1.3039 7.8535 7.8535 7.8542 7.8542 11.0750 11.0750 11.0752 11.0752 k =-0.4894 0.1849 0.8736 ( 4104 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6679 -19.6679 -19.6674 -19.6674 -19.4808 -19.4808 -19.4785 -19.4785 -19.3945 -19.3945 -19.3928 -19.3928 -15.6586 -15.6586 -15.6585 -15.6585 -3.1085 -3.1085 -3.1085 -3.1085 0.0947 0.0947 0.0948 0.0948 1.3100 1.3100 1.3101 1.3101 7.8453 7.8453 7.8457 7.8457 11.0739 11.0739 11.0740 11.0740 k =-0.4947 0.1672 0.8736 ( 4100 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6679 -19.6679 -19.6676 -19.6676 -19.4802 -19.4802 -19.4790 -19.4790 -19.3939 -19.3939 -19.3930 -19.3930 -15.6585 -15.6585 -15.6585 -15.6585 -3.1091 -3.1091 -3.1091 -3.1091 0.0938 0.0938 0.0939 0.0939 1.3138 1.3138 1.3138 1.3138 7.8404 7.8404 7.8406 7.8406 11.0732 11.0732 11.0733 11.0733 k =-0.5000 0.1495 0.8736 ( 4096 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6678 -19.6678 -19.6678 -19.6678 -19.4796 -19.4796 -19.4796 -19.4796 -19.3934 -19.3934 -19.3934 -19.3934 -15.6585 -15.6585 -15.6585 -15.6585 -3.1093 -3.1093 -3.1093 -3.1093 0.0936 0.0936 0.0936 0.0936 1.3150 1.3150 1.3150 1.3150 7.8388 7.8388 7.8388 7.8388 11.0730 11.0730 11.0730 11.0730 k =-0.5000 0.1495 0.8736 ( 4096 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6678 -19.6678 -19.6678 -19.6678 -19.4796 -19.4796 -19.4796 -19.4796 -19.3934 -19.3934 -19.3934 -19.3934 -15.6585 -15.6585 -15.6585 -15.6585 -3.1093 -3.1093 -3.1093 -3.1093 0.0936 0.0936 0.0936 0.0936 1.3150 1.3150 1.3150 1.3150 7.8388 7.8388 7.8388 7.8388 11.0730 11.0730 11.0730 11.0730 k =-0.5000 0.1495 0.8550 ( 4100 PWs) bands (ev): -47.5499 -47.5499 -47.5494 -47.5494 -19.6684 -19.6684 -19.6672 -19.6672 -19.4801 -19.4801 -19.4791 -19.4791 -19.3941 -19.3941 -19.3928 -19.3928 -15.6622 -15.6622 -15.6553 -15.6553 -3.1117 -3.1117 -3.1072 -3.1072 0.0924 0.0924 0.0969 0.0969 1.3100 1.3100 1.3201 1.3201 7.7677 7.7677 7.9099 7.9099 11.0082 11.0082 11.1392 11.1392 k =-0.5000 0.1495 0.8364 ( 4104 PWs) bands (ev): -47.5501 -47.5501 -47.5492 -47.5492 -19.6689 -19.6689 -19.6663 -19.6663 -19.4806 -19.4806 -19.4784 -19.4784 -19.3947 -19.3947 -19.3921 -19.3921 -15.6663 -15.6663 -15.6524 -15.6524 -3.1143 -3.1143 -3.1052 -3.1052 0.0934 0.0934 0.1024 0.1024 1.3048 1.3048 1.3251 1.3251 7.6966 7.6966 7.9807 7.9807 10.9448 10.9448 11.2065 11.2065 k =-0.5000 0.1495 0.8178 ( 4104 PWs) bands (ev): -47.5504 -47.5504 -47.5490 -47.5490 -19.6692 -19.6692 -19.6654 -19.6654 -19.4810 -19.4810 -19.4777 -19.4777 -19.3954 -19.3954 -19.3915 -19.3915 -15.6707 -15.6707 -15.6499 -15.6499 -3.1170 -3.1170 -3.1033 -3.1033 0.0966 0.0966 0.1099 0.1099 1.2997 1.2997 1.3301 1.3301 7.6257 7.6257 8.0511 8.0511 10.8831 10.8831 11.2749 11.2749 k =-0.5000 0.1495 0.7993 ( 4106 PWs) bands (ev): -47.5506 -47.5506 -47.5488 -47.5488 -19.6695 -19.6695 -19.6644 -19.6644 -19.4813 -19.4813 -19.4770 -19.4770 -19.3960 -19.3960 -19.3908 -19.3908 -15.6755 -15.6755 -15.6479 -15.6479 -3.1200 -3.1200 -3.1016 -3.1016 0.1020 0.1020 0.1195 0.1195 1.2946 1.2946 1.3351 1.3351 7.5552 7.5552 8.1208 8.1208 10.8234 10.8234 11.3442 11.3442 k =-0.5000 0.1495 0.7807 ( 4110 PWs) bands (ev): -47.5509 -47.5509 -47.5486 -47.5486 -19.6696 -19.6696 -19.6633 -19.6633 -19.4815 -19.4815 -19.4762 -19.4762 -19.3967 -19.3967 -19.3902 -19.3902 -15.6807 -15.6807 -15.6463 -15.6463 -3.1232 -3.1232 -3.1001 -3.1001 0.1096 0.1096 0.1312 0.1312 1.2895 1.2895 1.3400 1.3400 7.4849 7.4849 8.1896 8.1896 10.7660 10.7660 11.4143 11.4143 k =-0.5000 0.1495 0.7621 ( 4114 PWs) bands (ev): -47.5512 -47.5512 -47.5484 -47.5484 -19.6696 -19.6696 -19.6620 -19.6620 -19.4817 -19.4817 -19.4754 -19.4754 -19.3973 -19.3973 -19.3896 -19.3896 -15.6862 -15.6862 -15.6450 -15.6450 -3.1267 -3.1267 -3.0986 -3.0986 0.1194 0.1194 0.1448 0.1448 1.2844 1.2844 1.3448 1.3448 7.4151 7.4151 8.2570 8.2570 10.7111 10.7111 11.4851 11.4851 k =-0.5000 0.1495 0.7435 ( 4122 PWs) bands (ev): -47.5514 -47.5514 -47.5482 -47.5482 -19.6696 -19.6696 -19.6607 -19.6607 -19.4819 -19.4819 -19.4745 -19.4745 -19.3979 -19.3979 -19.3890 -19.3890 -15.6921 -15.6921 -15.6442 -15.6442 -3.1304 -3.1304 -3.0973 -3.0973 0.1314 0.1314 0.1604 0.1604 1.2793 1.2793 1.3496 1.3496 7.3457 7.3457 8.3226 8.3226 10.6593 10.6593 11.5565 11.5565 k =-0.5000 0.1495 0.7249 ( 4118 PWs) bands (ev): -47.5517 -47.5517 -47.5480 -47.5480 -19.6693 -19.6693 -19.6593 -19.6593 -19.4819 -19.4819 -19.4735 -19.4735 -19.3985 -19.3985 -19.3883 -19.3883 -15.6983 -15.6983 -15.6438 -15.6438 -3.1343 -3.1343 -3.0961 -3.0961 0.1456 0.1456 0.1779 0.1779 1.2742 1.2742 1.3544 1.3544 7.2769 7.2769 8.3860 8.3860 10.6111 10.6111 11.6284 11.6284 k =-0.5000 0.1495 0.7063 ( 4118 PWs) bands (ev): -47.5520 -47.5520 -47.5479 -47.5479 -19.6690 -19.6690 -19.6578 -19.6578 -19.4818 -19.4818 -19.4725 -19.4725 -19.3990 -19.3990 -19.3876 -19.3876 -15.7048 -15.7048 -15.6437 -15.6437 -3.1385 -3.1385 -3.0950 -3.0950 0.1619 0.1619 0.1972 0.1972 1.2692 1.2692 1.3591 1.3591 7.2086 7.2086 8.4465 8.4465 10.5670 10.5670 11.7007 11.7007 k =-0.5000 0.1495 0.6877 ( 4106 PWs) bands (ev): -47.5522 -47.5522 -47.5477 -47.5477 -19.6685 -19.6685 -19.6562 -19.6562 -19.4816 -19.4816 -19.4714 -19.4714 -19.3995 -19.3995 -19.3870 -19.3870 -15.7115 -15.7115 -15.6441 -15.6441 -3.1429 -3.1429 -3.0940 -3.0940 0.1804 0.1804 0.2184 0.2184 1.2642 1.2642 1.3637 1.3637 7.1408 7.1408 8.5034 8.5034 10.5277 10.5277 11.7733 11.7733 k =-0.5000 0.1495 0.6691 ( 4102 PWs) bands (ev): -47.5525 -47.5525 -47.5475 -47.5475 -19.6680 -19.6680 -19.6546 -19.6546 -19.4814 -19.4814 -19.4704 -19.4704 -19.4000 -19.4000 -19.3863 -19.3863 -15.7186 -15.7186 -15.6448 -15.6448 -3.1476 -3.1476 -3.0930 -3.0930 0.2010 0.2010 0.2412 0.2412 1.2592 1.2592 1.3683 1.3683 7.0737 7.0737 8.5560 8.5560 10.4940 10.4940 11.8461 11.8461 k =-0.5000 0.1495 0.6506 ( 4102 PWs) bands (ev): -47.5528 -47.5528 -47.5474 -47.5474 -19.6675 -19.6675 -19.6529 -19.6529 -19.4811 -19.4811 -19.4692 -19.4692 -19.4004 -19.4004 -19.3857 -19.3857 -15.7258 -15.7258 -15.6458 -15.6458 -3.1526 -3.1526 -3.0921 -3.0921 0.2237 0.2237 0.2657 0.2657 1.2543 1.2543 1.3728 1.3728 7.0071 7.0071 8.6035 8.6035 10.4667 10.4667 11.9187 11.9187 k =-0.5000 0.1495 0.6320 ( 4106 PWs) bands (ev): -47.5530 -47.5530 -47.5472 -47.5472 -19.6668 -19.6668 -19.6512 -19.6512 -19.4807 -19.4807 -19.4681 -19.4681 -19.4009 -19.4009 -19.3851 -19.3851 -15.7333 -15.7333 -15.6472 -15.6472 -3.1578 -3.1578 -3.0913 -3.0913 0.2484 0.2484 0.2917 0.2917 1.2494 1.2494 1.3771 1.3771 6.9412 6.9412 8.6449 8.6449 10.4467 10.4467 11.9912 11.9912 k =-0.5000 0.1495 0.6134 ( 4112 PWs) bands (ev): -47.5533 -47.5533 -47.5471 -47.5471 -19.6662 -19.6662 -19.6495 -19.6495 -19.4804 -19.4804 -19.4669 -19.4669 -19.4013 -19.4013 -19.3845 -19.3845 -15.7410 -15.7410 -15.6490 -15.6490 -3.1632 -3.1632 -3.0906 -3.0906 0.2750 0.2750 0.3193 0.3193 1.2446 1.2446 1.3814 1.3814 6.8759 6.8759 8.6794 8.6794 10.4347 10.4347 12.0632 12.0632 k =-0.5000 0.1495 0.5948 ( 4118 PWs) bands (ev): -47.5536 -47.5536 -47.5469 -47.5469 -19.6654 -19.6654 -19.6477 -19.6477 -19.4799 -19.4799 -19.4657 -19.4657 -19.4016 -19.4016 -19.3838 -19.3838 -15.7488 -15.7488 -15.6510 -15.6510 -3.1688 -3.1688 -3.0899 -3.0899 0.3035 0.3035 0.3483 0.3483 1.2399 1.2399 1.3856 1.3856 6.8113 6.8113 8.7063 8.7063 10.4315 10.4315 12.1344 12.1344 k =-0.5000 0.1495 0.5762 ( 4118 PWs) bands (ev): -47.5539 -47.5539 -47.5468 -47.5468 -19.6646 -19.6646 -19.6459 -19.6459 -19.4794 -19.4794 -19.4645 -19.4645 -19.4020 -19.4020 -19.3832 -19.3832 -15.7568 -15.7568 -15.6533 -15.6533 -3.1747 -3.1747 -3.0893 -3.0893 0.3338 0.3338 0.3787 0.3787 1.2352 1.2352 1.3897 1.3897 6.7474 6.7474 8.7251 8.7251 10.4376 10.4376 12.2044 12.2044 k =-0.5000 0.1495 0.5576 ( 4110 PWs) bands (ev): -47.5542 -47.5542 -47.5467 -47.5467 -19.6637 -19.6637 -19.6440 -19.6440 -19.4788 -19.4788 -19.4631 -19.4631 -19.4022 -19.4022 -19.3825 -19.3825 -15.7649 -15.7649 -15.6559 -15.6559 -3.1807 -3.1807 -3.0888 -3.0888 0.3658 0.3658 0.4103 0.4103 1.2306 1.2306 1.3938 1.3938 6.6842 6.6842 8.7354 8.7354 10.4533 10.4533 12.2727 12.2727 k =-0.5000 0.1495 0.5390 ( 4116 PWs) bands (ev): -47.5544 -47.5544 -47.5466 -47.5466 -19.6629 -19.6629 -19.6422 -19.6422 -19.4782 -19.4782 -19.4617 -19.4617 -19.4025 -19.4025 -19.3819 -19.3819 -15.7731 -15.7731 -15.6588 -15.6588 -3.1869 -3.1869 -3.0883 -3.0883 0.3994 0.3994 0.4431 0.4431 1.2261 1.2261 1.3976 1.3976 6.6217 6.6217 8.7374 8.7374 10.4784 10.4784 12.3386 12.3386 k =-0.5000 0.1495 0.5204 ( 4120 PWs) bands (ev): -47.5547 -47.5547 -47.5465 -47.5465 -19.6621 -19.6621 -19.6403 -19.6403 -19.4775 -19.4775 -19.4604 -19.4604 -19.4027 -19.4027 -19.3812 -19.3812 -15.7813 -15.7813 -15.6618 -15.6618 -3.1932 -3.1932 -3.0878 -3.0878 0.4345 0.4345 0.4769 0.4769 1.2217 1.2217 1.4014 1.4014 6.5600 6.5600 8.7314 8.7314 10.5126 10.5126 12.4010 12.4010 k =-0.5000 0.1495 0.5019 ( 4118 PWs) bands (ev): -47.5550 -47.5550 -47.5464 -47.5464 -19.6612 -19.6612 -19.6384 -19.6384 -19.4769 -19.4769 -19.4589 -19.4589 -19.4028 -19.4028 -19.3805 -19.3805 -15.7896 -15.7896 -15.6651 -15.6651 -3.1997 -3.1997 -3.0874 -3.0874 0.4710 0.4710 0.5117 0.5117 1.2174 1.2174 1.4051 1.4051 6.4991 6.4991 8.7179 8.7179 10.5552 10.5552 12.4586 12.4586 k =-0.5000 0.1495 0.4833 ( 4118 PWs) bands (ev): -47.5552 -47.5552 -47.5463 -47.5463 -19.6603 -19.6603 -19.6366 -19.6366 -19.4762 -19.4762 -19.4575 -19.4575 -19.4029 -19.4029 -19.3797 -19.3797 -15.7979 -15.7979 -15.6686 -15.6686 -3.2063 -3.2063 -3.0871 -3.0871 0.5088 0.5088 0.5473 0.5473 1.2132 1.2132 1.4087 1.4087 6.4390 6.4390 8.6977 8.6977 10.6054 10.6054 12.5096 12.5096 k =-0.5000 0.1495 0.4647 ( 4122 PWs) bands (ev): -47.5555 -47.5555 -47.5462 -47.5462 -19.6595 -19.6595 -19.6347 -19.6347 -19.4755 -19.4755 -19.4560 -19.4560 -19.4030 -19.4030 -19.3790 -19.3790 -15.8062 -15.8062 -15.6722 -15.6722 -3.2129 -3.2129 -3.0868 -3.0868 0.5477 0.5477 0.5837 0.5837 1.2091 1.2091 1.4122 1.4122 6.3798 6.3798 8.6717 8.6717 10.6624 10.6624 12.5514 12.5514 k =-0.5000 0.1495 0.4461 ( 4118 PWs) bands (ev): -47.5558 -47.5558 -47.5461 -47.5461 -19.6586 -19.6586 -19.6329 -19.6329 -19.4748 -19.4748 -19.4544 -19.4544 -19.4030 -19.4030 -19.3782 -19.3782 -15.8144 -15.8144 -15.6760 -15.6760 -3.2196 -3.2196 -3.0866 -3.0866 0.5875 0.5875 0.6206 0.6206 1.2051 1.2051 1.4155 1.4155 6.3215 6.3215 8.6408 8.6408 10.7250 10.7250 12.5816 12.5816 k =-0.5000 0.1495 0.4275 ( 4118 PWs) bands (ev): -47.5560 -47.5560 -47.5460 -47.5460 -19.6578 -19.6578 -19.6311 -19.6311 -19.4742 -19.4742 -19.4529 -19.4529 -19.4030 -19.4030 -19.3774 -19.3774 -15.8225 -15.8225 -15.6798 -15.6798 -3.2263 -3.2263 -3.0864 -3.0864 0.6282 0.6282 0.6580 0.6580 1.2012 1.2012 1.4188 1.4188 6.2642 6.2642 8.6058 8.6058 10.7924 10.7924 12.5983 12.5983 k =-0.5000 0.1495 0.4089 ( 4122 PWs) bands (ev): -47.5562 -47.5562 -47.5460 -47.5460 -19.6571 -19.6571 -19.6294 -19.6294 -19.4735 -19.4735 -19.4513 -19.4513 -19.4029 -19.4029 -19.3766 -19.3766 -15.8306 -15.8306 -15.6838 -15.6838 -3.2330 -3.2330 -3.0862 -3.0862 0.6696 0.6696 0.6956 0.6956 1.1975 1.1975 1.4219 1.4219 6.2080 6.2080 8.5676 8.5676 10.8636 10.8636 12.6014 12.6014 k =-0.5000 0.1495 0.3903 ( 4118 PWs) bands (ev): -47.5565 -47.5565 -47.5459 -47.5459 -19.6563 -19.6563 -19.6276 -19.6276 -19.4729 -19.4729 -19.4497 -19.4497 -19.4029 -19.4029 -19.3757 -19.3757 -15.8385 -15.8385 -15.6877 -15.6877 -3.2397 -3.2397 -3.0862 -3.0862 0.7114 0.7114 0.7335 0.7335 1.1939 1.1939 1.4248 1.4248 6.1529 6.1529 8.5269 8.5269 10.9378 10.9378 12.5930 12.5930 k =-0.5000 0.1495 0.3717 ( 4126 PWs) bands (ev): -47.5567 -47.5567 -47.5459 -47.5459 -19.6556 -19.6556 -19.6260 -19.6260 -19.4724 -19.4724 -19.4481 -19.4481 -19.4028 -19.4028 -19.3748 -19.3748 -15.8462 -15.8462 -15.6918 -15.6918 -3.2463 -3.2463 -3.0861 -3.0861 0.7535 0.7535 0.7713 0.7713 1.1904 1.1904 1.4277 1.4277 6.0990 6.0990 8.4844 8.4844 11.0142 11.0142 12.5759 12.5759 k =-0.5000 0.1495 0.3532 ( 4118 PWs) bands (ev): -47.5569 -47.5569 -47.5458 -47.5458 -19.6550 -19.6550 -19.6243 -19.6243 -19.4718 -19.4718 -19.4464 -19.4464 -19.4028 -19.4028 -19.3738 -19.3738 -15.8538 -15.8538 -15.6958 -15.6958 -3.2528 -3.2528 -3.0861 -3.0861 0.7957 0.7957 0.8090 0.8090 1.1871 1.1871 1.4304 1.4304 6.0464 6.0464 8.4406 8.4406 11.0919 11.0919 12.5531 12.5531 k =-0.5000 0.1495 0.3346 ( 4130 PWs) bands (ev): -47.5572 -47.5572 -47.5458 -47.5458 -19.6544 -19.6544 -19.6227 -19.6227 -19.4714 -19.4714 -19.4448 -19.4448 -19.4028 -19.4028 -19.3728 -19.3728 -15.8612 -15.8612 -15.6998 -15.6998 -3.2592 -3.2592 -3.0861 -3.0861 0.8378 0.8378 0.8462 0.8462 1.1839 1.1839 1.4330 1.4330 5.9951 5.9951 8.3962 8.3962 11.1703 11.1703 12.5268 12.5268 k =-0.5000 0.1495 0.3160 ( 4124 PWs) bands (ev): -47.5574 -47.5574 -47.5457 -47.5457 -19.6538 -19.6538 -19.6212 -19.6212 -19.4709 -19.4709 -19.4431 -19.4431 -19.4027 -19.4027 -19.3718 -19.3718 -15.8683 -15.8683 -15.7038 -15.7038 -3.2654 -3.2654 -3.0862 -3.0862 0.8796 0.8796 0.8830 0.8830 1.1809 1.1809 1.4355 1.4355 5.9454 5.9454 8.3517 8.3517 11.2488 11.2488 12.4986 12.4986 k =-0.5000 0.1495 0.2974 ( 4124 PWs) bands (ev): -47.5576 -47.5576 -47.5457 -47.5457 -19.6532 -19.6532 -19.6198 -19.6198 -19.4705 -19.4705 -19.4415 -19.4415 -19.4026 -19.4026 -19.3707 -19.3707 -15.8751 -15.8751 -15.7076 -15.7076 -3.2714 -3.2714 -3.0863 -3.0863 0.9191 0.9191 0.9209 0.9209 1.1780 1.1780 1.4379 1.4379 5.8973 5.8973 8.3074 8.3074 11.3266 11.3266 12.4695 12.4695 k =-0.5000 0.1495 0.2788 ( 4120 PWs) bands (ev): -47.5578 -47.5578 -47.5456 -47.5456 -19.6527 -19.6527 -19.6184 -19.6184 -19.4701 -19.4701 -19.4399 -19.4399 -19.4026 -19.4026 -19.3696 -19.3696 -15.8817 -15.8817 -15.7114 -15.7114 -3.2772 -3.2772 -3.0864 -3.0864 0.9543 0.9543 0.9613 0.9613 1.1754 1.1754 1.4401 1.4401 5.8510 5.8510 8.2637 8.2637 11.4031 11.4031 12.4405 12.4405 k =-0.5000 0.1495 0.2602 ( 4112 PWs) bands (ev): -47.5579 -47.5579 -47.5456 -47.5456 -19.6522 -19.6522 -19.6170 -19.6170 -19.4697 -19.4697 -19.4382 -19.4382 -19.4026 -19.4026 -19.3685 -19.3685 -15.8879 -15.8879 -15.7151 -15.7151 -3.2828 -3.2828 -3.0865 -3.0865 0.9884 0.9884 1.0007 1.0007 1.1729 1.1729 1.4422 1.4422 5.8066 5.8066 8.2212 8.2212 11.4779 11.4779 12.4119 12.4119 k =-0.5000 0.1495 0.2416 ( 4114 PWs) bands (ev): -47.5581 -47.5581 -47.5456 -47.5456 -19.6518 -19.6518 -19.6158 -19.6158 -19.4695 -19.4695 -19.4367 -19.4367 -19.4027 -19.4027 -19.3674 -19.3674 -15.8939 -15.8939 -15.7186 -15.7186 -3.2881 -3.2881 -3.0866 -3.0866 1.0212 1.0212 1.0387 1.0387 1.1707 1.1707 1.4441 1.4441 5.7642 5.7642 8.1800 8.1800 11.5502 11.5502 12.3843 12.3843 k =-0.5000 0.1495 0.2230 ( 4114 PWs) bands (ev): -47.5583 -47.5583 -47.5455 -47.5455 -19.6514 -19.6514 -19.6146 -19.6146 -19.4692 -19.4692 -19.4351 -19.4351 -19.4028 -19.4028 -19.3663 -19.3663 -15.8994 -15.8994 -15.7219 -15.7219 -3.2931 -3.2931 -3.0868 -3.0868 1.0525 1.0525 1.0751 1.0751 1.1688 1.1688 1.4460 1.4460 5.7240 5.7240 8.1405 8.1405 11.6196 11.6196 12.3579 12.3579 k =-0.5000 0.1495 0.2045 ( 4114 PWs) bands (ev): -47.5584 -47.5584 -47.5455 -47.5455 -19.6511 -19.6511 -19.6135 -19.6135 -19.4690 -19.4690 -19.4337 -19.4337 -19.4029 -19.4029 -19.3653 -19.3653 -15.9046 -15.9046 -15.7251 -15.7251 -3.2978 -3.2978 -3.0869 -3.0869 1.0822 1.0822 1.1092 1.1092 1.1676 1.1676 1.4476 1.4476 5.6862 5.6862 8.1030 8.1030 11.6855 11.6855 12.3331 12.3331 k =-0.5000 0.1495 0.1859 ( 4118 PWs) bands (ev): -47.5585 -47.5585 -47.5455 -47.5455 -19.6508 -19.6508 -19.6125 -19.6125 -19.4688 -19.4688 -19.4323 -19.4323 -19.4031 -19.4031 -19.3643 -19.3643 -15.9094 -15.9094 -15.7281 -15.7281 -3.3022 -3.3022 -3.0871 -3.0871 1.1100 1.1100 1.1393 1.1393 1.1686 1.1686 1.4492 1.4492 5.6509 5.6509 8.0678 8.0678 11.7475 11.7475 12.3098 12.3098 k =-0.5000 0.1495 0.1673 ( 4120 PWs) bands (ev): -47.5587 -47.5587 -47.5455 -47.5455 -19.6506 -19.6506 -19.6116 -19.6116 -19.4687 -19.4687 -19.4309 -19.4309 -19.4033 -19.4033 -19.3633 -19.3633 -15.9139 -15.9139 -15.7308 -15.7308 -3.3062 -3.3062 -3.0873 -3.0873 1.1358 1.1358 1.1555 1.1555 1.1814 1.1814 1.4506 1.4506 5.6183 5.6183 8.0351 8.0351 11.8050 11.8050 12.2884 12.2884 k =-0.5000 0.1495 0.1487 ( 4120 PWs) bands (ev): -47.5588 -47.5588 -47.5454 -47.5454 -19.6503 -19.6503 -19.6107 -19.6107 -19.4686 -19.4686 -19.4296 -19.4296 -19.4035 -19.4035 -19.3625 -19.3625 -15.9178 -15.9178 -15.7333 -15.7333 -3.3099 -3.3099 -3.0874 -3.0874 1.1573 1.1573 1.1597 1.1597 1.2062 1.2062 1.4518 1.4518 5.5886 5.5886 8.0052 8.0052 11.8576 11.8576 12.2690 12.2690 k =-0.5000 0.1495 0.1301 ( 4122 PWs) bands (ev): -47.5589 -47.5589 -47.5454 -47.5454 -19.6502 -19.6502 -19.6100 -19.6100 -19.4685 -19.4685 -19.4284 -19.4284 -19.4038 -19.4038 -19.3616 -19.3616 -15.9214 -15.9214 -15.7355 -15.7355 -3.3131 -3.3131 -3.0876 -3.0876 1.1571 1.1571 1.1808 1.1808 1.2307 1.2307 1.4529 1.4529 5.5619 5.5619 7.9783 7.9783 11.9049 11.9049 12.2516 12.2516 k =-0.5000 0.1495 0.1115 ( 4124 PWs) bands (ev): -47.5590 -47.5590 -47.5454 -47.5454 -19.6500 -19.6500 -19.6094 -19.6094 -19.4684 -19.4684 -19.4274 -19.4274 -19.4040 -19.4040 -19.3609 -19.3609 -15.9245 -15.9245 -15.7375 -15.7375 -3.3160 -3.3160 -3.0877 -3.0877 1.1563 1.1563 1.1996 1.1996 1.2530 1.2530 1.4539 1.4539 5.5384 5.5384 7.9546 7.9546 11.9467 11.9467 12.2364 12.2364 k =-0.5000 0.1495 0.0929 ( 4124 PWs) bands (ev): -47.5590 -47.5590 -47.5454 -47.5454 -19.6499 -19.6499 -19.6088 -19.6088 -19.4684 -19.4684 -19.4264 -19.4264 -19.4043 -19.4043 -19.3602 -19.3602 -15.9272 -15.9272 -15.7392 -15.7392 -3.3184 -3.3184 -3.0878 -3.0878 1.1555 1.1555 1.2157 1.2157 1.2723 1.2723 1.4547 1.4547 5.5183 5.5183 7.9342 7.9342 11.9825 11.9825 12.2234 12.2234 k =-0.5000 0.1495 0.0743 ( 4120 PWs) bands (ev): -47.5591 -47.5591 -47.5454 -47.5454 -19.6497 -19.6497 -19.6083 -19.6083 -19.4683 -19.4683 -19.4256 -19.4256 -19.4045 -19.4045 -19.3597 -19.3597 -15.9293 -15.9293 -15.7406 -15.7406 -3.3204 -3.3204 -3.0879 -3.0879 1.1548 1.1548 1.2290 1.2290 1.2884 1.2884 1.4554 1.4554 5.5016 5.5016 7.9173 7.9173 12.0121 12.0121 12.2127 12.2127 k =-0.5000 0.1495 0.0558 ( 4120 PWs) bands (ev): -47.5591 -47.5591 -47.5454 -47.5454 -19.6497 -19.6497 -19.6079 -19.6079 -19.4683 -19.4683 -19.4249 -19.4249 -19.4047 -19.4047 -19.3592 -19.3592 -15.9310 -15.9310 -15.7417 -15.7417 -3.3220 -3.3220 -3.0880 -3.0880 1.1542 1.1542 1.2395 1.2395 1.3011 1.3011 1.4560 1.4560 5.4885 5.4885 7.9041 7.9041 12.0354 12.0354 12.2043 12.2043 k =-0.5000 0.1495 0.0372 ( 4120 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6077 -19.6077 -19.4683 -19.4683 -19.4244 -19.4244 -19.4049 -19.4049 -19.3589 -19.3589 -15.9322 -15.9322 -15.7425 -15.7425 -3.3231 -3.3231 -3.0881 -3.0881 1.1538 1.1538 1.2471 1.2471 1.3103 1.3103 1.4564 1.4564 5.4790 5.4790 7.8945 7.8945 12.0521 12.0521 12.1983 12.1983 k =-0.5000 0.1495 0.0186 ( 4116 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6075 -19.6075 -19.4683 -19.4683 -19.4241 -19.4241 -19.4050 -19.4050 -19.3587 -19.3587 -15.9330 -15.9330 -15.7429 -15.7429 -3.3238 -3.3238 -3.0881 -3.0881 1.1535 1.1535 1.2517 1.2517 1.3159 1.3159 1.4566 1.4566 5.4734 5.4734 7.8888 7.8888 12.0622 12.0622 12.1946 12.1946 k =-0.5000 0.1495-0.0000 ( 4120 PWs) bands (ev): -47.5592 -47.5592 -47.5454 -47.5454 -19.6496 -19.6496 -19.6075 -19.6075 -19.4683 -19.4683 -19.4240 -19.4240 -19.4050 -19.4050 -19.3586 -19.3586 -15.9332 -15.9332 -15.7431 -15.7431 -3.3240 -3.3240 -3.0881 -3.0881 1.1534 1.1534 1.2532 1.2532 1.3177 1.3177 1.4567 1.4567 5.4715 5.4715 7.8869 7.8869 12.0655 12.0655 12.1934 12.1934 k = 0.0000 0.0000 0.8736 ( 4124 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6625 -19.6625 -19.6625 -19.6625 -19.4816 -19.4816 -19.4816 -19.4816 -19.3950 -19.3950 -19.3950 -19.3950 -15.6651 -15.6651 -15.6651 -15.6651 -2.9846 -2.9846 -2.9846 -2.9846 -0.1256 -0.1256 -0.1256 -0.1256 1.3143 1.3143 1.3143 1.3143 8.0736 8.0736 8.0736 8.0736 11.1893 11.1893 11.1893 11.1893 k =-0.0179 0.0053 0.8736 ( 4120 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6625 -19.6625 -19.6625 -19.6625 -19.4816 -19.4816 -19.4816 -19.4816 -19.3950 -19.3950 -19.3950 -19.3950 -15.6650 -15.6650 -15.6650 -15.6650 -2.9850 -2.9850 -2.9850 -2.9850 -0.1249 -0.1249 -0.1249 -0.1249 1.3143 1.3143 1.3143 1.3143 8.0729 8.0729 8.0729 8.0729 11.1889 11.1889 11.1889 11.1889 k =-0.0357 0.0107 0.8736 ( 4118 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6626 -19.6626 -19.6626 -19.6626 -19.4816 -19.4816 -19.4816 -19.4816 -19.3950 -19.3950 -19.3950 -19.3950 -15.6650 -15.6650 -15.6650 -15.6650 -2.9863 -2.9863 -2.9863 -2.9863 -0.1228 -0.1228 -0.1228 -0.1228 1.3144 1.3144 1.3144 1.3144 8.0706 8.0706 8.0706 8.0706 11.1877 11.1877 11.1877 11.1877 k =-0.0536 0.0160 0.8736 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6626 -19.6626 -19.6626 -19.6626 -19.4815 -19.4815 -19.4815 -19.4815 -19.3949 -19.3949 -19.3949 -19.3949 -15.6649 -15.6649 -15.6649 -15.6649 -2.9883 -2.9883 -2.9883 -2.9883 -0.1193 -0.1193 -0.1193 -0.1193 1.3144 1.3144 1.3144 1.3144 8.0670 8.0670 8.0670 8.0670 11.1858 11.1858 11.1858 11.1858 k =-0.0714 0.0214 0.8736 ( 4122 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6628 -19.6628 -19.6628 -19.6628 -19.4815 -19.4815 -19.4815 -19.4815 -19.3949 -19.3949 -19.3949 -19.3949 -15.6647 -15.6647 -15.6647 -15.6647 -2.9912 -2.9912 -2.9912 -2.9912 -0.1145 -0.1145 -0.1145 -0.1145 1.3144 1.3144 1.3144 1.3144 8.0618 8.0618 8.0618 8.0618 11.1831 11.1831 11.1831 11.1831 k =-0.0893 0.0267 0.8736 ( 4126 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6629 -19.6629 -19.6629 -19.6629 -19.4815 -19.4815 -19.4815 -19.4815 -19.3949 -19.3949 -19.3949 -19.3949 -15.6646 -15.6646 -15.6646 -15.6646 -2.9948 -2.9948 -2.9948 -2.9948 -0.1084 -0.1084 -0.1084 -0.1084 1.3144 1.3144 1.3144 1.3144 8.0554 8.0554 8.0554 8.0554 11.1797 11.1797 11.1797 11.1797 k =-0.1071 0.0320 0.8736 ( 4126 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6631 -19.6631 -19.6631 -19.6631 -19.4815 -19.4815 -19.4815 -19.4815 -19.3948 -19.3948 -19.3948 -19.3948 -15.6643 -15.6643 -15.6643 -15.6643 -2.9990 -2.9990 -2.9990 -2.9990 -0.1012 -0.1012 -0.1012 -0.1012 1.3144 1.3144 1.3144 1.3144 8.0477 8.0477 8.0477 8.0477 11.1757 11.1757 11.1757 11.1757 k =-0.1250 0.0374 0.8736 ( 4126 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6633 -19.6633 -19.6633 -19.6633 -19.4814 -19.4814 -19.4814 -19.4814 -19.3948 -19.3948 -19.3948 -19.3948 -15.6641 -15.6641 -15.6641 -15.6641 -3.0039 -3.0039 -3.0039 -3.0039 -0.0929 -0.0929 -0.0929 -0.0929 1.3145 1.3145 1.3145 1.3145 8.0388 8.0388 8.0388 8.0388 11.1712 11.1712 11.1712 11.1712 k =-0.1429 0.0427 0.8736 ( 4122 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6635 -19.6635 -19.6635 -19.6635 -19.4813 -19.4813 -19.4813 -19.4813 -19.3947 -19.3947 -19.3947 -19.3947 -15.6638 -15.6638 -15.6638 -15.6638 -3.0093 -3.0093 -3.0093 -3.0093 -0.0836 -0.0836 -0.0836 -0.0836 1.3145 1.3145 1.3145 1.3145 8.0289 8.0289 8.0289 8.0289 11.1661 11.1661 11.1661 11.1661 k =-0.1607 0.0480 0.8736 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6637 -19.6637 -19.6637 -19.6637 -19.4811 -19.4811 -19.4811 -19.4811 -19.3946 -19.3946 -19.3946 -19.3946 -15.6635 -15.6635 -15.6635 -15.6635 -3.0152 -3.0152 -3.0152 -3.0152 -0.0734 -0.0734 -0.0734 -0.0734 1.3145 1.3145 1.3145 1.3145 8.0181 8.0181 8.0181 8.0181 11.1605 11.1605 11.1605 11.1605 k =-0.1786 0.0534 0.8736 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6640 -19.6640 -19.6640 -19.6640 -19.4810 -19.4810 -19.4810 -19.4810 -19.3946 -19.3946 -19.3946 -19.3946 -15.6632 -15.6632 -15.6632 -15.6632 -3.0215 -3.0215 -3.0215 -3.0215 -0.0625 -0.0625 -0.0625 -0.0625 1.3145 1.3145 1.3145 1.3145 8.0065 8.0065 8.0065 8.0065 11.1547 11.1547 11.1547 11.1547 k =-0.1964 0.0587 0.8736 ( 4110 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6643 -19.6643 -19.6643 -19.6643 -19.4809 -19.4809 -19.4809 -19.4809 -19.3945 -19.3945 -19.3945 -19.3945 -15.6629 -15.6629 -15.6629 -15.6629 -3.0281 -3.0281 -3.0281 -3.0281 -0.0511 -0.0511 -0.0511 -0.0511 1.3146 1.3146 1.3146 1.3146 7.9943 7.9943 7.9943 7.9943 11.1485 11.1485 11.1485 11.1485 k =-0.2143 0.0641 0.8736 ( 4108 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6646 -19.6646 -19.6646 -19.6646 -19.4808 -19.4808 -19.4808 -19.4808 -19.3944 -19.3944 -19.3944 -19.3944 -15.6625 -15.6625 -15.6625 -15.6625 -3.0349 -3.0349 -3.0349 -3.0349 -0.0392 -0.0392 -0.0392 -0.0392 1.3146 1.3146 1.3146 1.3146 7.9816 7.9816 7.9816 7.9816 11.1421 11.1421 11.1421 11.1421 k =-0.2321 0.0694 0.8736 ( 4106 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6648 -19.6648 -19.6648 -19.6648 -19.4807 -19.4807 -19.4807 -19.4807 -19.3943 -19.3943 -19.3943 -19.3943 -15.6622 -15.6622 -15.6622 -15.6622 -3.0418 -3.0418 -3.0418 -3.0418 -0.0270 -0.0270 -0.0270 -0.0270 1.3146 1.3146 1.3146 1.3146 7.9686 7.9686 7.9686 7.9686 11.1356 11.1356 11.1356 11.1356 k =-0.2500 0.0747 0.8736 ( 4118 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6652 -19.6652 -19.6652 -19.6652 -19.4806 -19.4806 -19.4806 -19.4806 -19.3943 -19.3943 -19.3943 -19.3943 -15.6618 -15.6618 -15.6618 -15.6618 -3.0489 -3.0489 -3.0489 -3.0489 -0.0148 -0.0148 -0.0148 -0.0148 1.3147 1.3147 1.3147 1.3147 7.9555 7.9555 7.9555 7.9555 11.1291 11.1291 11.1291 11.1291 k =-0.2679 0.0801 0.8736 ( 4122 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6655 -19.6655 -19.6655 -19.6655 -19.4805 -19.4805 -19.4805 -19.4805 -19.3942 -19.3942 -19.3942 -19.3942 -15.6614 -15.6614 -15.6614 -15.6614 -3.0558 -3.0558 -3.0558 -3.0558 -0.0026 -0.0026 -0.0026 -0.0026 1.3147 1.3147 1.3147 1.3147 7.9423 7.9423 7.9423 7.9423 11.1227 11.1227 11.1227 11.1227 k =-0.2857 0.0854 0.8736 ( 4120 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6658 -19.6658 -19.6658 -19.6658 -19.4804 -19.4804 -19.4804 -19.4804 -19.3941 -19.3941 -19.3941 -19.3941 -15.6611 -15.6611 -15.6611 -15.6611 -3.0626 -3.0626 -3.0626 -3.0626 0.0095 0.0095 0.0095 0.0095 1.3147 1.3147 1.3147 1.3147 7.9294 7.9294 7.9294 7.9294 11.1163 11.1163 11.1163 11.1163 k =-0.3036 0.0907 0.8736 ( 4116 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6661 -19.6661 -19.6661 -19.6661 -19.4803 -19.4803 -19.4803 -19.4803 -19.3940 -19.3940 -19.3940 -19.3940 -15.6607 -15.6607 -15.6607 -15.6607 -3.0692 -3.0692 -3.0692 -3.0692 0.0212 0.0212 0.0212 0.0212 1.3148 1.3148 1.3148 1.3148 7.9168 7.9168 7.9168 7.9168 11.1102 11.1102 11.1102 11.1102 k =-0.3214 0.0961 0.8736 ( 4116 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6664 -19.6664 -19.6664 -19.6664 -19.4802 -19.4802 -19.4802 -19.4802 -19.3939 -19.3939 -19.3939 -19.3939 -15.6604 -15.6604 -15.6604 -15.6604 -3.0755 -3.0755 -3.0755 -3.0755 0.0325 0.0325 0.0325 0.0325 1.3148 1.3148 1.3148 1.3148 7.9047 7.9047 7.9047 7.9047 11.1043 11.1043 11.1043 11.1043 k =-0.3393 0.1014 0.8736 ( 4108 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6666 -19.6666 -19.6666 -19.6666 -19.4801 -19.4801 -19.4801 -19.4801 -19.3938 -19.3938 -19.3938 -19.3938 -15.6601 -15.6601 -15.6601 -15.6601 -3.0815 -3.0815 -3.0815 -3.0815 0.0431 0.0431 0.0431 0.0431 1.3149 1.3149 1.3149 1.3149 7.8932 7.8932 7.8932 7.8932 11.0988 11.0988 11.0988 11.0988 k =-0.3571 0.1068 0.8736 ( 4108 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6669 -19.6669 -19.6669 -19.6669 -19.4800 -19.4800 -19.4800 -19.4800 -19.3937 -19.3937 -19.3937 -19.3937 -15.6598 -15.6598 -15.6598 -15.6598 -3.0870 -3.0870 -3.0870 -3.0870 0.0530 0.0530 0.0530 0.0530 1.3149 1.3149 1.3149 1.3149 7.8826 7.8826 7.8826 7.8826 11.0937 11.0937 11.0937 11.0937 k =-0.3750 0.1121 0.8736 ( 4102 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6670 -19.6670 -19.6670 -19.6670 -19.4799 -19.4799 -19.4799 -19.4799 -19.3937 -19.3937 -19.3937 -19.3937 -15.6595 -15.6595 -15.6595 -15.6595 -3.0920 -3.0920 -3.0920 -3.0920 0.0620 0.0620 0.0620 0.0620 1.3149 1.3149 1.3149 1.3149 7.8729 7.8729 7.8729 7.8729 11.0891 11.0891 11.0891 11.0891 k =-0.3929 0.1174 0.8736 ( 4098 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6672 -19.6672 -19.6672 -19.6672 -19.4798 -19.4798 -19.4798 -19.4798 -19.3936 -19.3936 -19.3936 -19.3936 -15.6592 -15.6592 -15.6592 -15.6592 -3.0964 -3.0964 -3.0964 -3.0964 0.0701 0.0701 0.0701 0.0701 1.3149 1.3149 1.3149 1.3149 7.8642 7.8642 7.8642 7.8642 11.0850 11.0850 11.0850 11.0850 k =-0.4107 0.1228 0.8736 ( 4098 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6674 -19.6674 -19.6674 -19.6674 -19.4797 -19.4797 -19.4797 -19.4797 -19.3936 -19.3936 -19.3936 -19.3936 -15.6590 -15.6590 -15.6590 -15.6590 -3.1003 -3.1003 -3.1003 -3.1003 0.0771 0.0771 0.0771 0.0771 1.3150 1.3150 1.3150 1.3150 7.8566 7.8566 7.8566 7.8566 11.0814 11.0814 11.0814 11.0814 k =-0.4286 0.1281 0.8736 ( 4102 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6675 -19.6675 -19.6675 -19.6675 -19.4797 -19.4797 -19.4797 -19.4797 -19.3935 -19.3935 -19.3935 -19.3935 -15.6588 -15.6588 -15.6588 -15.6588 -3.1035 -3.1035 -3.1035 -3.1035 0.0829 0.0829 0.0829 0.0829 1.3150 1.3150 1.3150 1.3150 7.8503 7.8503 7.8503 7.8503 11.0784 11.0784 11.0784 11.0784 k =-0.4464 0.1335 0.8736 ( 4102 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6677 -19.6677 -19.6677 -19.6677 -19.4797 -19.4797 -19.4797 -19.4797 -19.3935 -19.3935 -19.3935 -19.3935 -15.6587 -15.6587 -15.6587 -15.6587 -3.1060 -3.1060 -3.1060 -3.1060 0.0875 0.0875 0.0875 0.0875 1.3150 1.3150 1.3150 1.3150 7.8453 7.8453 7.8453 7.8453 11.0761 11.0761 11.0761 11.0761 k =-0.4643 0.1388 0.8736 ( 4104 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6678 -19.6678 -19.6678 -19.6678 -19.4797 -19.4797 -19.4797 -19.4797 -19.3935 -19.3935 -19.3935 -19.3935 -15.6586 -15.6586 -15.6586 -15.6586 -3.1079 -3.1079 -3.1079 -3.1079 0.0909 0.0909 0.0909 0.0909 1.3150 1.3150 1.3150 1.3150 7.8417 7.8417 7.8417 7.8417 11.0744 11.0744 11.0744 11.0744 k =-0.4821 0.1441 0.8736 ( 4096 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6678 -19.6678 -19.6678 -19.6678 -19.4796 -19.4796 -19.4796 -19.4796 -19.3934 -19.3934 -19.3934 -19.3934 -15.6585 -15.6585 -15.6585 -15.6585 -3.1090 -3.1090 -3.1090 -3.1090 0.0929 0.0929 0.0929 0.0929 1.3150 1.3150 1.3150 1.3150 7.8395 7.8395 7.8395 7.8395 11.0734 11.0734 11.0734 11.0734 k =-0.5000 0.1495 0.8736 ( 4096 PWs) bands (ev): -47.5497 -47.5497 -47.5497 -47.5497 -19.6678 -19.6678 -19.6678 -19.6678 -19.4796 -19.4796 -19.4796 -19.4796 -19.3934 -19.3934 -19.3934 -19.3934 -15.6585 -15.6585 -15.6585 -15.6585 -3.1093 -3.1093 -3.1093 -3.1093 0.0936 0.0936 0.0936 0.0936 1.3150 1.3150 1.3150 1.3150 7.8388 7.8388 7.8388 7.8388 11.0730 11.0730 11.0730 11.0730 Writing output data file NaHO.save init_run : 0.13s CPU 0.33s WALL ( 1 calls) electrons : 124.04s CPU 126.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 124.04s CPU 126.05s 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 : 0.01s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.05s WALL ( 474 calls) cegterg : 113.98s CPU 115.43s WALL ( 499 calls) Called by sum_band: Called by *egterg: h_psi : 72.32s CPU 73.84s WALL ( 8382 calls) s_psi : 1.19s CPU 1.16s WALL ( 8382 calls) g_psi : 0.17s CPU 0.22s WALL ( 7409 calls) cdiaghg : 36.80s CPU 37.25s WALL ( 7883 calls) cegterg:over : 4.45s CPU 4.17s WALL ( 7409 calls) cegterg:upda : 3.24s CPU 3.34s WALL ( 7409 calls) cegterg:last : 2.04s CPU 2.15s WALL ( 1447 calls) cdiaghg:chol : 1.94s CPU 2.01s WALL ( 7883 calls) cdiaghg:inve : 1.09s CPU 1.08s WALL ( 7883 calls) cdiaghg:para : 2.02s CPU 2.13s WALL ( 15766 calls) Called by h_psi: h_psi:vloc : 68.80s CPU 69.96s WALL ( 8382 calls) h_psi:vnl : 3.34s CPU 3.70s WALL ( 8382 calls) add_vuspsi : 1.32s CPU 1.44s WALL ( 8382 calls) General routines calbec : 1.99s CPU 2.24s WALL ( 8382 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 62.93s CPU 64.09s WALL ( 732972 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.19s CPU 0.24s WALL ( 948 calls) Parallel routines fft_scatter : 20.34s CPU 20.95s WALL ( 732995 calls) PWSCF : 2m20.93s CPU 2m37.14s WALL This run was terminated on: 19:59:16 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=