``:oss/ `.+s+. .+ys--yh+ `./ss+. -sh//yy+` +yy +yy -+h+-oyy -yh- .oyy/.-sh. .syo-.:sy- /yh `.-.` `yh+ -oyyyo. `/syys: oys `.` `/+ssys+-` `sh+ ` oys` .:osyo` -yh- ./syyooyo` .sys+/oyo--yh/ `yy+ .-:-. `-/+/:` -sh- /yh. oys ``..---hho---------` .---------..` `.-----.` -hd+---. `./osmNMMMMMMMMMMMMMMMs. +NNMMMMMMMMNNmh+. yNMMMMMNm- oNMMMMMNmo++:` +sy--/sdMMMhyyyyyyyNMMh- .oyNMMmyyyyyhNMMm+` -yMMMdyyo:` .oyyNMMNhs+syy` -yy/ /MMM+.`-+/``mMMy- `mMMh:`````.dMMN:` `MMMy-`-dhhy```mMMy:``+hs -yy+` /MMMo:-mMM+`-oo/. mMMh: `dMMN/` dMMm:`dMMMMy..MMMo-.+yo` .sys`/MMMMNNMMMs- mMMmyooooymMMNo: oMMM/sMMMMMM++MMN//oh: `sh+/MMMhyyMMMs- `-` mMMMMMMMMMNmy+-` -MMMhMMMsmMMmdMMd/yy+ `-/+++oyy-/MMM+.`/hh/.`mNm:` mMMd+/////:-.` NMMMMMd/:NMMMMMy:/yyo/:.` +os+//:-..-oMMMo:--:::-/MMMo. .-mMMd+---` hMMMMN+. oMMMMMo. `-+osyso:` syo `mNMMMMMNNNNNNNNMMMo.oNNMMMMMNNNN:` +MMMMs:` dMMMN/` ``:syo /yh` :syyyyyyyyyyyyyyyy+.`+syyyyyyyyo:` .oyys:` .oyys:` +yh -yh- ```````````````` ````````` `` `` oys -+h/------------------------::::::::://////++++++++++++++++++++++///////::::/yd: shdddddddddddddddddddddddddddddhhhhhhhhyyyyyssssssssssssssssyyyyyyyhhhhhhhddddh` Program EPW v.4.0.0 (svn rev. 12139) starts on 1Mar2016 at 12: 5:26 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 1 processors Reading data from directory: ./sic.save Info: using nr1, nr2, nr3 values from input Info: using nr1, nr2, nr3 values from input IMPORTANT: XC functional enforced from input : Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0) Any further DFT definition will be discarded Please, verify this is what you really want file C.UPF: wavefunction(s) 3d renormalized G-vector sticks info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Sum 559 559 187 8801 8801 1591 Possibly too few bands at point 1 0.00000 0.00000 0.00000 Possibly too few bands at point 2 -0.33333 0.33333 -0.33333 Possibly too few bands at point 3 -0.66667 0.66667 -0.66667 Possibly too few bands at point 4 0.33333 0.33333 0.33333 Possibly too few bands at point 5 0.00000 0.66667 0.00000 Possibly too few bands at point 6 -0.33333 1.00000 -0.33333 Possibly too few bands at point 7 0.66667 0.66667 0.66667 Possibly too few bands at point 8 0.33333 1.00000 0.33333 Possibly too few bands at point 9 0.00000 1.33333 0.00000 Possibly too few bands at point 10 -0.33333 -0.33333 0.33333 Possibly too few bands at point 11 -0.66667 0.00000 0.00000 Possibly too few bands at point 12 -1.00000 0.33333 -0.33333 Possibly too few bands at point 13 0.00000 0.00000 0.66667 Possibly too few bands at point 14 -0.33333 0.33333 0.33333 Possibly too few bands at point 15 -0.66667 0.66667 -0.00000 Possibly too few bands at point 16 0.33333 0.33333 1.00000 Possibly too few bands at point 17 0.00000 0.66667 0.66667 Possibly too few bands at point 18 -0.33333 1.00000 0.33333 Possibly too few bands at point 19 -0.66667 -0.66667 0.66667 Possibly too few bands at point 20 -1.00000 -0.33333 0.33333 Possibly too few bands at point 21 -1.33333 0.00000 0.00000 Possibly too few bands at point 22 -0.33333 -0.33333 1.00000 Possibly too few bands at point 23 -0.66667 -0.00000 0.66667 Possibly too few bands at point 24 -1.00000 0.33333 0.33333 Possibly too few bands at point 25 0.00000 0.00000 1.33333 Possibly too few bands at point 26 -0.33333 0.33333 1.00000 Possibly too few bands at point 27 -0.66667 0.66667 0.66667 -- bravais-lattice index = 2 lattice parameter (a_0) = 8.2370 a.u. unit-cell volume = 139.7163 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 kinetic-energy cut-off = 60.0000 Ry charge density cut-off = 240.0000 Ry convergence threshold = 0.0E+00 beta = 0.0000 number of iterations used = 0 Exchange-correlation = SLA PZ NOGX NOGC ( 1 1 0 0 0 0) celldm(1)= 8.23700 celldm(2)= 0.00000 celldm(3)= 0.00000 celldm(4)= 0.00000 celldm(5)= 0.00000 celldm(6)= 0.00000 crystal axes: (cart. coord. in units of a_0) a(1) = ( -0.5000 0.0000 0.5000 ) a(2) = ( 0.0000 0.5000 0.5000 ) a(3) = ( -0.5000 0.5000 0.0000 ) reciprocal axes: (cart. coord. in units 2 pi/a_0) b(1) = ( -1.0000 -1.0000 1.0000 ) b(2) = ( 1.0000 1.0000 1.0000 ) b(3) = ( -1.0000 1.0000 -1.0000 ) Atoms inside the unit cell: Cartesian axes site n. atom mass positions (a_0 units) 1 Si 28.0879 tau( 1) = ( 0.00000 0.00000 0.00000 ) 2 C 12.0118 tau( 2) = ( 0.25000 0.25000 0.25000 ) 25 Sym.Ops. (with q -> -q+G ) G cutoff = 412.4674 ( 8801 G-vectors) FFT grid: ( 30, 30, 30) number of k points= 27 gaussian broad. (Ry)= 0.0200 ngauss = 1 cart. coord. in units 2pi/a_0 k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0740741 k( 2) = ( -0.3333333 0.3333333 -0.3333333), wk = 0.0740741 k( 3) = ( -0.6666667 0.6666667 -0.6666667), wk = 0.0740741 k( 4) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0740741 k( 5) = ( 0.0000000 0.6666667 0.0000000), wk = 0.0740741 k( 6) = ( -0.3333333 1.0000000 -0.3333333), wk = 0.0740741 k( 7) = ( 0.6666667 0.6666667 0.6666667), wk = 0.0740741 k( 8) = ( 0.3333333 1.0000000 0.3333333), wk = 0.0740741 k( 9) = ( 0.0000000 1.3333333 0.0000000), wk = 0.0740741 k( 10) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0740741 k( 11) = ( -0.6666667 0.0000000 0.0000000), wk = 0.0740741 k( 12) = ( -1.0000000 0.3333333 -0.3333333), wk = 0.0740741 k( 13) = ( 0.0000000 0.0000000 0.6666667), wk = 0.0740741 k( 14) = ( -0.3333333 0.3333333 0.3333333), wk = 0.0740741 k( 15) = ( -0.6666667 0.6666667 -0.0000000), wk = 0.0740741 k( 16) = ( 0.3333333 0.3333333 1.0000000), wk = 0.0740741 k( 17) = ( 0.0000000 0.6666667 0.6666667), wk = 0.0740741 k( 18) = ( -0.3333333 1.0000000 0.3333333), wk = 0.0740741 k( 19) = ( -0.6666667 -0.6666667 0.6666667), wk = 0.0740741 k( 20) = ( -1.0000000 -0.3333333 0.3333333), wk = 0.0740741 k( 21) = ( -1.3333333 0.0000000 0.0000000), wk = 0.0740741 k( 22) = ( -0.3333333 -0.3333333 1.0000000), wk = 0.0740741 k( 23) = ( -0.6666667 -0.0000000 0.6666667), wk = 0.0740741 k( 24) = ( -1.0000000 0.3333333 0.3333333), wk = 0.0740741 k( 25) = ( 0.0000000 0.0000000 1.3333333), wk = 0.0740741 k( 26) = ( -0.3333333 0.3333333 1.0000000), wk = 0.0740741 k( 27) = ( -0.6666667 0.6666667 0.6666667), wk = 0.0740741 PseudoPot. # 1 for Si read from file: ../../pp/Si.pz-vbc.UPF MD5 check sum: 6dfa03ddd5817404712e03e4d12deb78 Pseudo is Norm-conserving, Zval = 4.0 Generated by new atomic code, or converted to UPF format Using radial grid of 431 points, 2 beta functions with: l(1) = 0 l(2) = 1 PseudoPot. # 2 for C read from file: ../../pp/C.UPF MD5 check sum: 4781e8ce5ee01a432381f51d0ea25c53 Pseudo is Norm-conserving, Zval = 4.0 Generated by new atomic code, or converted to UPF format Using radial grid of 461 points, 2 beta functions with: l(1) = 0 l(2) = 1 EPW : 0.34s CPU 0.18s WALL EPW : 0.63s CPU 0.32s WALL No wavefunction gauge setting applied ------------------------------------------------------------------- Wannierization on 3 x 3 x 3 electronic grid ------------------------------------------------------------------- Spin CASE ( default = unpolarized ) Initializing Wannier90 Initial Wannier projections ( 0.00000 0.00000 0.00000) : l = -3 mr = 1 ( 0.00000 0.00000 0.00000) : l = -3 mr = 2 ( 0.00000 0.00000 0.00000) : l = -3 mr = 3 ( 0.00000 0.00000 0.00000) : l = -3 mr = 4 - Number of bands is ( 4) - Number of wannier functions is ( 4) - All guiding functions are given - All neighbours are found AMN k points = 27 in 1 pools 1 of 27 on ionode 2 of 27 on ionode 3 of 27 on ionode 4 of 27 on ionode 5 of 27 on ionode 6 of 27 on ionode 7 of 27 on ionode 8 of 27 on ionode 9 of 27 on ionode 10 of 27 on ionode 11 of 27 on ionode 12 of 27 on ionode 13 of 27 on ionode 14 of 27 on ionode 15 of 27 on ionode 16 of 27 on ionode 17 of 27 on ionode 18 of 27 on ionode 19 of 27 on ionode 20 of 27 on ionode 21 of 27 on ionode 22 of 27 on ionode 23 of 27 on ionode 24 of 27 on ionode 25 of 27 on ionode 26 of 27 on ionode 27 of 27 on ionode AMN calculated MMN k points = 27 in 1 pools 1 of 27 on ionode 2 of 27 on ionode 3 of 27 on ionode 4 of 27 on ionode 5 of 27 on ionode 6 of 27 on ionode 7 of 27 on ionode 8 of 27 on ionode 9 of 27 on ionode 10 of 27 on ionode 11 of 27 on ionode 12 of 27 on ionode 13 of 27 on ionode 14 of 27 on ionode 15 of 27 on ionode 16 of 27 on ionode 17 of 27 on ionode 18 of 27 on ionode 19 of 27 on ionode 20 of 27 on ionode 21 of 27 on ionode 22 of 27 on ionode 23 of 27 on ionode 24 of 27 on ionode 25 of 27 on ionode 26 of 27 on ionode 27 of 27 on ionode MMN calculated Running Wannier90 Wannier Function centers (cartesian, alat) and spreads (ang): ( 0.16147 0.16147 0.16147) : 0.87894 ( 0.16147 -0.16147 -0.16147) : 0.87894 ( -0.16147 0.16147 -0.16147) : 0.87894 ( -0.16147 -0.16147 0.16147) : 0.87894 ------------------------------------------------------------------- WANNIER : 11.45s CPU 5.72s WALL ( 1 calls) ------------------------------------------------------------------- Dipole matrix elements calculated Calculating kmap and kgmap Progress kmap: ########################### Progress kgmap: ######################################## kmaps : 3.27s CPU 1.64s WALL ( 1 calls) Symmetries of bravais lattice: 48 Symmetries of crystal: 24 =================================================================== irreducible q point # 1 =================================================================== Symmetries of small group of q: 24 in addition sym. q -> -q+G: Number of q in the star = 1 List of q in the star: 1 0.000000000 0.000000000 0.000000000 Imposing acoustic sum rule on the dynamical matrix q( 1 ) = ( 0.0000000 0.0000000 0.0000000 ) =================================================================== irreducible q point # 2 =================================================================== Symmetries of small group of q: 6 Number of q in the star = 4 List of q in the star: 1 -0.333333333 0.333333333 -0.333333333 2 0.333333333 0.333333333 0.333333333 3 0.333333333 -0.333333333 -0.333333333 4 -0.333333333 -0.333333333 0.333333333 In addition there is the -q list: 1 0.333333333 -0.333333333 0.333333333 2 -0.333333333 -0.333333333 -0.333333333 3 -0.333333333 0.333333333 0.333333333 4 0.333333333 0.333333333 -0.333333333 q( 2 ) = ( -0.3333333 0.3333333 -0.3333333 ) q( 3 ) = ( 0.3333333 -0.3333333 0.3333333 ) q( 4 ) = ( 0.3333333 0.3333333 0.3333333 ) q( 5 ) = ( -0.3333333 -0.3333333 -0.3333333 ) q( 6 ) = ( 0.3333333 -0.3333333 -0.3333333 ) q( 7 ) = ( -0.3333333 0.3333333 0.3333333 ) q( 8 ) = ( -0.3333333 -0.3333333 0.3333333 ) q( 9 ) = ( 0.3333333 0.3333333 -0.3333333 ) =================================================================== irreducible q point # 3 =================================================================== Symmetries of small group of q: 4 Number of q in the star = 6 List of q in the star: 1 0.000000000 0.666666667 0.000000000 2 0.000000000 0.000000000 -0.666666667 3 -0.666666667 0.000000000 0.000000000 4 0.666666667 0.000000000 0.000000000 5 0.000000000 -0.666666667 0.000000000 6 0.000000000 0.000000000 0.666666667 q( 10 ) = ( 0.0000000 0.6666667 0.0000000 ) q( 11 ) = ( 0.0000000 0.0000000 -0.6666667 ) q( 12 ) = ( -0.6666667 0.0000000 0.0000000 ) q( 13 ) = ( 0.6666667 0.0000000 0.0000000 ) q( 14 ) = ( 0.0000000 -0.6666667 0.0000000 ) q( 15 ) = ( 0.0000000 0.0000000 0.6666667 ) =================================================================== irreducible q point # 4 =================================================================== Symmetries of small group of q: 2 Number of q in the star = 12 List of q in the star: 1 0.666666667 0.000000000 0.666666667 2 -0.666666667 0.000000000 -0.666666667 3 0.666666667 -0.666666667 0.000000000 4 0.000000000 -0.666666667 0.666666667 5 0.000000000 -0.666666667 -0.666666667 6 -0.666666667 0.000000000 0.666666667 7 0.666666667 0.666666667 0.000000000 8 -0.666666667 -0.666666667 0.000000000 9 -0.666666667 0.666666667 0.000000000 10 0.666666667 0.000000000 -0.666666667 11 0.000000000 0.666666667 0.666666667 12 0.000000000 0.666666667 -0.666666667 q( 16 ) = ( 0.6666667 0.0000000 0.6666667 ) q( 17 ) = ( -0.6666667 0.0000000 -0.6666667 ) q( 18 ) = ( 0.6666667 -0.6666667 0.0000000 ) q( 19 ) = ( 0.0000000 -0.6666667 0.6666667 ) q( 20 ) = ( 0.0000000 -0.6666667 -0.6666667 ) q( 21 ) = ( -0.6666667 0.0000000 0.6666667 ) q( 22 ) = ( 0.6666667 0.6666667 0.0000000 ) q( 23 ) = ( -0.6666667 -0.6666667 0.0000000 ) q( 24 ) = ( -0.6666667 0.6666667 0.0000000 ) q( 25 ) = ( 0.6666667 0.0000000 -0.6666667 ) q( 26 ) = ( 0.0000000 0.6666667 0.6666667 ) q( 27 ) = ( 0.0000000 0.6666667 -0.6666667 ) Writing epmatq on .epb files Writing Hamiltonian, Dynamical matrix and EP vertex in Wann rep to file Reading Hamiltonian, Dynamical matrix and EP vertex in Wann rep from file Finished reading Wann rep data from file Using uniform q-mesh: 6 6 6 Size of q point mesh for interpolation: 216 Using uniform k-mesh: 6 6 6 Size of k point mesh for interpolation: 432 Max number of k points per pool: 432 Fermi energy coarse grid = 9.635389 eV Fermi energy is calculated from the fine k-mesh: Ef = 9.805462 eV =================================================================== ibndmin = 1 ebndmin = -0.336 ibndmax = 4 ebndmax = 0.691 Number of ep-matrix elements per pool : 20736 ~= 162.00 Kb (@ 8 bytes/ DP) =================================================================== Phonon (Imaginary) Self-Energy in the Migdal Approximation =================================================================== Fermi Surface thickness = 15.000000 eV Golden Rule strictly enforced with T = 0.172347 eV Gaussian Broadening: 1.000000 eV, ngauss= 1 DOS = 0.046846 states/spin/eV/Unit Cell at Ef= 9.805462 eV ismear = 1 iq = 1 coord.: 0.00000 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000000 gamma= 0.000000 meV omega= 0.0001 meV lambda( 2 )= 0.000000 gamma= 0.000000 meV omega= 0.0002 meV lambda( 3 )= 0.000000 gamma= 0.000000 meV omega= 0.0002 meV lambda( 4 )= 0.006035 gamma= 0.007898 meV omega= 94.2973 meV lambda( 5 )= 0.006035 gamma= 0.007898 meV omega= 94.2973 meV lambda( 6 )= 0.006035 gamma= 0.007898 meV omega= 94.2973 meV lambda( tot )= 0.018106 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 =================================================================== Electron (Imaginary) Self-Energy in the Migdal Approximation =================================================================== Fermi Surface thickness = 15.000000 eV Golden Rule strictly enforced with T = 0.172347 eV Gaussian Broadening: 1.000000 eV, ngauss= 1 DOS = 0.046846 states/spin/eV/Unit Cell at Ef= 9.805462 eV ismear = 1 iq = 2 coord.: 0.00000 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048011 gamma= -0.001843 meV omega= 16.1523 meV lambda( 2 )= -0.030186 gamma= -0.001371 meV omega= 17.5651 meV lambda( 3 )= 0.037737 gamma= 0.006061 meV omega= 33.0343 meV lambda( 4 )= 0.036004 gamma= 0.047011 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049577 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081620 meV omega= 100.8907 meV lambda( tot )= 0.087817 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 3 coord.: 0.00000 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 4 coord.: 0.00000 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006138 gamma= 0.000957 meV omega= 32.5420 meV lambda( 2 )= 0.005947 gamma= 0.000979 meV omega= 33.4448 meV lambda( 3 )= 0.058237 gamma= 0.049186 meV omega= 75.7547 meV lambda( 4 )= 0.030533 gamma= 0.037441 meV omega= 91.2801 meV lambda( 5 )= 0.030461 gamma= 0.037618 meV omega= 91.6046 meV lambda( 6 )= 0.019282 gamma= 0.032554 meV omega= 107.1067 meV lambda( tot )= 0.150597 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 5 coord.: 0.00000 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 6 coord.: 0.00000 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048002 gamma= -0.001843 meV omega= 16.1523 meV lambda( 2 )= -0.030182 gamma= -0.001370 meV omega= 17.5651 meV lambda( 3 )= 0.037733 gamma= 0.006060 meV omega= 33.0343 meV lambda( 4 )= 0.036003 gamma= 0.047010 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049576 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081621 meV omega= 100.8907 meV lambda( tot )= 0.087826 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 7 coord.: 0.00000 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.016062 gamma= -0.000399 meV omega= 12.9996 meV lambda( 2 )= -0.016063 gamma= -0.000399 meV omega= 12.9996 meV lambda( 3 )= -0.122668 gamma= -0.019174 meV omega= 32.5896 meV lambda( 4 )= 0.047822 gamma= 0.063423 meV omega= 94.9296 meV lambda( 5 )= 0.047822 gamma= 0.063424 meV omega= 94.9296 meV lambda( 6 )= 0.067261 gamma= 0.100998 meV omega= 101.0097 meV lambda( tot )= 0.008111 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 8 coord.: 0.00000 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018139 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017422 gamma= -0.001341 meV omega= 22.8692 meV lambda( 3 )= 0.018752 gamma= 0.003227 meV omega= 34.1944 meV lambda( 4 )= 0.044449 gamma= 0.058578 meV omega= 94.6292 meV lambda( 5 )= 0.046848 gamma= 0.062307 meV omega= 95.0633 meV lambda( 6 )= 0.082430 gamma= 0.125648 meV omega= 101.7711 meV lambda( tot )= 0.193195 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 9 coord.: 0.00000 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001931 gamma= -0.000298 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023989 gamma= 0.030817 meV omega= 93.4283 meV lambda( 5 )= 0.025494 gamma= 0.034195 meV omega= 95.4660 meV lambda( 6 )= 0.026539 gamma= 0.043292 meV omega= 105.2814 meV lambda( tot )= 0.120955 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 10 coord.: 0.00000 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002778 gamma= 0.000558 meV omega= 36.9315 meV lambda( 2 )= 0.007632 gamma= 0.002018 meV omega= 42.3891 meV lambda( 3 )= 0.025104 gamma= 0.018376 meV omega= 70.5247 meV lambda( 4 )= 0.014042 gamma= 0.017276 meV omega= 91.4339 meV lambda( 5 )= 0.018358 gamma= 0.023372 meV omega= 93.0071 meV lambda( 6 )= 0.007965 gamma= 0.012979 meV omega= 105.2273 meV lambda( tot )= 0.075878 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 11 coord.: 0.00000 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019504 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008241 gamma= 0.002263 meV omega= 43.2002 meV lambda( 3 )= 0.026140 gamma= 0.017296 meV omega= 67.0515 meV lambda( 4 )= 0.028451 gamma= 0.035595 meV omega= 92.1999 meV lambda( 5 )= 0.016774 gamma= 0.021513 meV omega= 93.3506 meV lambda( 6 )= 0.017447 gamma= 0.028310 meV omega= 105.0009 meV lambda( tot )= 0.116557 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 12 coord.: 0.00000 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053618 gamma= 0.004459 meV omega= 23.7706 meV lambda( 2 )= 0.000431 gamma= 0.000066 meV omega= 32.3607 meV lambda( 3 )= 0.000772 gamma= 0.000266 meV omega= 48.3490 meV lambda( 4 )= 0.031641 gamma= 0.041193 meV omega= 94.0538 meV lambda( 5 )= 0.029447 gamma= 0.039653 meV omega= 95.6544 meV lambda( 6 )= 0.026926 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142836 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 13 coord.: 0.00000 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 14 coord.: 0.00000 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004355 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003305 gamma= 0.000547 meV omega= 33.5472 meV lambda( 3 )= 0.030143 gamma= 0.013437 meV omega= 55.0357 meV lambda( 4 )= 0.023171 gamma= 0.029670 meV omega= 93.2760 meV lambda( 5 )= 0.025554 gamma= 0.033646 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050951 meV omega= 106.2388 meV lambda( tot )= 0.117202 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 15 coord.: 0.00000 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 16 coord.: 0.00000 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000278 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010981 gamma= 0.007950 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002636 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005093 gamma= 0.008197 meV omega= 104.5753 meV lambda( tot )= 0.021979 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 17 coord.: 0.00000 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 18 coord.: 0.00000 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007297 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003522 gamma= 0.000940 meV omega= 42.5756 meV lambda( 3 )= 0.030622 gamma= 0.019986 meV omega= 66.5934 meV lambda( 4 )= 0.023692 gamma= 0.029415 meV omega= 91.8482 meV lambda( 5 )= 0.014727 gamma= 0.018992 meV omega= 93.6086 meV lambda( 6 )= 0.013222 gamma= 0.021584 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 19 coord.: 0.00000 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.008544 gamma= -0.001249 meV omega= 31.5176 meV lambda( 2 )= -0.008544 gamma= -0.001249 meV omega= 31.5176 meV lambda( 3 )= 0.072367 gamma= 0.062731 meV omega= 76.7465 meV lambda( 4 )= 0.045197 gamma= 0.056254 meV omega= 91.9621 meV lambda( 5 )= 0.045197 gamma= 0.056254 meV omega= 91.9621 meV lambda( 6 )= 0.000402 gamma= 0.000669 meV omega= 106.3993 meV lambda( tot )= 0.146076 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 20 coord.: 0.00000 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001292 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006631 gamma= 0.001725 meV omega= 42.0490 meV lambda( 3 )= 0.027323 gamma= 0.020375 meV omega= 71.1823 meV lambda( 4 )= 0.016600 gamma= 0.020577 meV omega= 91.7744 meV lambda( 5 )= 0.020361 gamma= 0.025963 meV omega= 93.0805 meV lambda( 6 )= 0.005048 gamma= 0.008169 meV omega= 104.8553 meV lambda( tot )= 0.074672 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 21 coord.: 0.00000 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000036 meV omega= 41.8048 meV lambda( 2 )= 0.001252 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011213 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003652 gamma= 0.004587 meV omega= 92.3809 meV lambda( 6 )= 0.004440 gamma= 0.007072 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 22 coord.: 0.00000 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000007 gamma= -0.000002 meV omega= 43.4255 meV lambda( 2 )= -0.000002 gamma= -0.000000 meV omega= 45.6989 meV lambda( 3 )= 0.004056 gamma= 0.003554 meV omega= 77.1672 meV lambda( 4 )= 0.000198 gamma= 0.000238 meV omega= 90.2557 meV lambda( 5 )= 0.000174 gamma= 0.000214 meV omega= 91.3515 meV lambda( 6 )= 0.000807 gamma= 0.001295 meV omega= 104.4255 meV lambda( tot )= 0.005226 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 23 coord.: 0.00000 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000037 meV omega= 41.8048 meV lambda( 2 )= 0.001253 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011214 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003653 gamma= 0.004588 meV omega= 92.3809 meV lambda( 6 )= 0.004438 gamma= 0.007068 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 24 coord.: 0.00000 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001291 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006632 gamma= 0.001726 meV omega= 42.0490 meV lambda( 3 )= 0.027325 gamma= 0.020376 meV omega= 71.1823 meV lambda( 4 )= 0.016601 gamma= 0.020578 meV omega= 91.7744 meV lambda( 5 )= 0.020359 gamma= 0.025960 meV omega= 93.0805 meV lambda( 6 )= 0.005044 gamma= 0.008162 meV omega= 104.8553 meV lambda( tot )= 0.074671 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 25 coord.: 0.00000 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 26 coord.: 0.00000 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007299 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003512 gamma= 0.000937 meV omega= 42.5756 meV lambda( 3 )= 0.030632 gamma= 0.019992 meV omega= 66.5934 meV lambda( 4 )= 0.023691 gamma= 0.029414 meV omega= 91.8482 meV lambda( 5 )= 0.014731 gamma= 0.018997 meV omega= 93.6086 meV lambda( 6 )= 0.013219 gamma= 0.021578 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 27 coord.: 0.00000 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 28 coord.: 0.00000 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000277 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010984 gamma= 0.007952 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002637 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005091 gamma= 0.008194 meV omega= 104.5753 meV lambda( tot )= 0.021981 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 29 coord.: 0.00000 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 30 coord.: 0.00000 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004352 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003307 gamma= 0.000548 meV omega= 33.5472 meV lambda( 3 )= 0.030140 gamma= 0.013436 meV omega= 55.0357 meV lambda( 4 )= 0.023172 gamma= 0.029671 meV omega= 93.2760 meV lambda( 5 )= 0.025553 gamma= 0.033645 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050949 meV omega= 106.2388 meV lambda( tot )= 0.117197 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 31 coord.: 0.00000 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.015893 gamma= -0.000395 meV omega= 12.9996 meV lambda( 2 )= -0.015893 gamma= -0.000395 meV omega= 12.9996 meV lambda( 3 )= -0.122663 gamma= -0.019173 meV omega= 32.5896 meV lambda( 4 )= 0.047825 gamma= 0.063427 meV omega= 94.9296 meV lambda( 5 )= 0.047825 gamma= 0.063427 meV omega= 94.9296 meV lambda( 6 )= 0.067263 gamma= 0.101000 meV omega= 101.0097 meV lambda( tot )= 0.008462 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 32 coord.: 0.00000 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053632 gamma= 0.004460 meV omega= 23.7706 meV lambda( 2 )= 0.000422 gamma= 0.000065 meV omega= 32.3607 meV lambda( 3 )= 0.000771 gamma= 0.000265 meV omega= 48.3490 meV lambda( 4 )= 0.031640 gamma= 0.041192 meV omega= 94.0538 meV lambda( 5 )= 0.029445 gamma= 0.039651 meV omega= 95.6544 meV lambda( 6 )= 0.026927 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142837 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 33 coord.: 0.00000 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019503 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008250 gamma= 0.002266 meV omega= 43.2002 meV lambda( 3 )= 0.026130 gamma= 0.017289 meV omega= 67.0515 meV lambda( 4 )= 0.028450 gamma= 0.035593 meV omega= 92.1999 meV lambda( 5 )= 0.016769 gamma= 0.021507 meV omega= 93.3506 meV lambda( 6 )= 0.017446 gamma= 0.028308 meV omega= 105.0009 meV lambda( tot )= 0.116549 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 34 coord.: 0.00000 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002777 gamma= 0.000557 meV omega= 36.9315 meV lambda( 2 )= 0.007635 gamma= 0.002019 meV omega= 42.3891 meV lambda( 3 )= 0.025107 gamma= 0.018378 meV omega= 70.5247 meV lambda( 4 )= 0.014043 gamma= 0.017278 meV omega= 91.4339 meV lambda( 5 )= 0.018357 gamma= 0.023369 meV omega= 93.0071 meV lambda( 6 )= 0.007960 gamma= 0.012972 meV omega= 105.2273 meV lambda( tot )= 0.075879 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 35 coord.: 0.00000 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001935 gamma= -0.000299 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023991 gamma= 0.030819 meV omega= 93.4283 meV lambda( 5 )= 0.025495 gamma= 0.034196 meV omega= 95.4660 meV lambda( 6 )= 0.026536 gamma= 0.043288 meV omega= 105.2814 meV lambda( tot )= 0.120950 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 36 coord.: 0.00000 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018142 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017439 gamma= -0.001342 meV omega= 22.8692 meV lambda( 3 )= 0.018761 gamma= 0.003228 meV omega= 34.1944 meV lambda( 4 )= 0.044450 gamma= 0.058579 meV omega= 94.6292 meV lambda( 5 )= 0.046851 gamma= 0.062311 meV omega= 95.0633 meV lambda( 6 )= 0.082428 gamma= 0.125646 meV omega= 101.7711 meV lambda( tot )= 0.193193 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 37 coord.: 0.16667 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048012 gamma= -0.001844 meV omega= 16.1523 meV lambda( 2 )= -0.030186 gamma= -0.001371 meV omega= 17.5651 meV lambda( 3 )= 0.037737 gamma= 0.006061 meV omega= 33.0343 meV lambda( 4 )= 0.036004 gamma= 0.047011 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049577 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081620 meV omega= 100.8907 meV lambda( tot )= 0.087817 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 38 coord.: 0.16667 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018142 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017439 gamma= -0.001342 meV omega= 22.8692 meV lambda( 3 )= 0.018761 gamma= 0.003228 meV omega= 34.1944 meV lambda( 4 )= 0.044450 gamma= 0.058579 meV omega= 94.6292 meV lambda( 5 )= 0.046851 gamma= 0.062311 meV omega= 95.0633 meV lambda( 6 )= 0.082428 gamma= 0.125646 meV omega= 101.7711 meV lambda( tot )= 0.193193 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 39 coord.: 0.16667 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 40 coord.: 0.16667 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 41 coord.: 0.16667 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 42 coord.: 0.16667 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112626 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 43 coord.: 0.16667 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018139 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017422 gamma= -0.001341 meV omega= 22.8692 meV lambda( 3 )= 0.018752 gamma= 0.003227 meV omega= 34.1944 meV lambda( 4 )= 0.044449 gamma= 0.058578 meV omega= 94.6292 meV lambda( 5 )= 0.046848 gamma= 0.062307 meV omega= 95.0633 meV lambda( 6 )= 0.082430 gamma= 0.125648 meV omega= 101.7711 meV lambda( tot )= 0.193195 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 44 coord.: 0.16667 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048002 gamma= -0.001843 meV omega= 16.1523 meV lambda( 2 )= -0.030182 gamma= -0.001370 meV omega= 17.5651 meV lambda( 3 )= 0.037733 gamma= 0.006060 meV omega= 33.0343 meV lambda( 4 )= 0.036003 gamma= 0.047010 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049576 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081621 meV omega= 100.8907 meV lambda( tot )= 0.087825 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 45 coord.: 0.16667 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112626 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 46 coord.: 0.16667 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092507 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 47 coord.: 0.16667 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 48 coord.: 0.16667 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 49 coord.: 0.16667 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004355 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003305 gamma= 0.000547 meV omega= 33.5472 meV lambda( 3 )= 0.030143 gamma= 0.013437 meV omega= 55.0357 meV lambda( 4 )= 0.023171 gamma= 0.029670 meV omega= 93.2760 meV lambda( 5 )= 0.025554 gamma= 0.033646 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050951 meV omega= 106.2388 meV lambda( tot )= 0.117202 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 50 coord.: 0.16667 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053618 gamma= 0.004459 meV omega= 23.7706 meV lambda( 2 )= 0.000431 gamma= 0.000066 meV omega= 32.3607 meV lambda( 3 )= 0.000772 gamma= 0.000266 meV omega= 48.3490 meV lambda( 4 )= 0.031641 gamma= 0.041193 meV omega= 94.0538 meV lambda( 5 )= 0.029447 gamma= 0.039653 meV omega= 95.6544 meV lambda( 6 )= 0.026926 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142836 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 51 coord.: 0.16667 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 52 coord.: 0.16667 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061056 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 53 coord.: 0.16667 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 54 coord.: 0.16667 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 55 coord.: 0.16667 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001292 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006631 gamma= 0.001725 meV omega= 42.0490 meV lambda( 3 )= 0.027323 gamma= 0.020375 meV omega= 71.1823 meV lambda( 4 )= 0.016600 gamma= 0.020577 meV omega= 91.7744 meV lambda( 5 )= 0.020361 gamma= 0.025963 meV omega= 93.0805 meV lambda( 6 )= 0.005048 gamma= 0.008169 meV omega= 104.8553 meV lambda( tot )= 0.074672 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 56 coord.: 0.16667 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007297 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003522 gamma= 0.000940 meV omega= 42.5756 meV lambda( 3 )= 0.030622 gamma= 0.019986 meV omega= 66.5934 meV lambda( 4 )= 0.023692 gamma= 0.029415 meV omega= 91.8482 meV lambda( 5 )= 0.014727 gamma= 0.018992 meV omega= 93.6086 meV lambda( 6 )= 0.013222 gamma= 0.021584 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 57 coord.: 0.16667 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 58 coord.: 0.16667 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 59 coord.: 0.16667 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 60 coord.: 0.16667 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 61 coord.: 0.16667 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007299 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003512 gamma= 0.000937 meV omega= 42.5756 meV lambda( 3 )= 0.030632 gamma= 0.019992 meV omega= 66.5934 meV lambda( 4 )= 0.023691 gamma= 0.029414 meV omega= 91.8482 meV lambda( 5 )= 0.014731 gamma= 0.018997 meV omega= 93.6086 meV lambda( 6 )= 0.013219 gamma= 0.021578 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 62 coord.: 0.16667 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001291 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006632 gamma= 0.001726 meV omega= 42.0490 meV lambda( 3 )= 0.027325 gamma= 0.020376 meV omega= 71.1823 meV lambda( 4 )= 0.016601 gamma= 0.020578 meV omega= 91.7744 meV lambda( 5 )= 0.020359 gamma= 0.025960 meV omega= 93.0805 meV lambda( 6 )= 0.005044 gamma= 0.008162 meV omega= 104.8553 meV lambda( tot )= 0.074671 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 63 coord.: 0.16667 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 64 coord.: 0.16667 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 65 coord.: 0.16667 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 66 coord.: 0.16667 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 67 coord.: 0.16667 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053632 gamma= 0.004460 meV omega= 23.7706 meV lambda( 2 )= 0.000422 gamma= 0.000065 meV omega= 32.3607 meV lambda( 3 )= 0.000771 gamma= 0.000265 meV omega= 48.3490 meV lambda( 4 )= 0.031640 gamma= 0.041192 meV omega= 94.0538 meV lambda( 5 )= 0.029445 gamma= 0.039651 meV omega= 95.6544 meV lambda( 6 )= 0.026927 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142837 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 68 coord.: 0.16667 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004352 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003307 gamma= 0.000548 meV omega= 33.5472 meV lambda( 3 )= 0.030140 gamma= 0.013436 meV omega= 55.0357 meV lambda( 4 )= 0.023172 gamma= 0.029671 meV omega= 93.2760 meV lambda( 5 )= 0.025553 gamma= 0.033645 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050949 meV omega= 106.2388 meV lambda( tot )= 0.117197 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 69 coord.: 0.16667 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 70 coord.: 0.16667 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 71 coord.: 0.16667 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 72 coord.: 0.16667 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 73 coord.: 0.33333 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008337 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 74 coord.: 0.33333 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 75 coord.: 0.33333 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 76 coord.: 0.33333 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 77 coord.: 0.33333 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 78 coord.: 0.33333 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092507 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 79 coord.: 0.33333 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001931 gamma= -0.000298 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023989 gamma= 0.030817 meV omega= 93.4283 meV lambda( 5 )= 0.025494 gamma= 0.034195 meV omega= 95.4660 meV lambda( 6 )= 0.026539 gamma= 0.043292 meV omega= 105.2814 meV lambda( tot )= 0.120955 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 80 coord.: 0.33333 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112626 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 81 coord.: 0.33333 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001935 gamma= -0.000299 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023991 gamma= 0.030819 meV omega= 93.4283 meV lambda( 5 )= 0.025495 gamma= 0.034196 meV omega= 95.4660 meV lambda( 6 )= 0.026536 gamma= 0.043288 meV omega= 105.2814 meV lambda( tot )= 0.120950 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 82 coord.: 0.33333 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 83 coord.: 0.33333 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 84 coord.: 0.33333 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061056 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 85 coord.: 0.33333 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 86 coord.: 0.33333 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 87 coord.: 0.33333 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008337 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 88 coord.: 0.33333 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 89 coord.: 0.33333 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 90 coord.: 0.33333 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 91 coord.: 0.33333 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000036 meV omega= 41.8048 meV lambda( 2 )= 0.001252 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011213 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003652 gamma= 0.004587 meV omega= 92.3809 meV lambda( 6 )= 0.004440 gamma= 0.007072 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 92 coord.: 0.33333 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 93 coord.: 0.33333 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019504 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008241 gamma= 0.002263 meV omega= 43.2002 meV lambda( 3 )= 0.026140 gamma= 0.017296 meV omega= 67.0515 meV lambda( 4 )= 0.028451 gamma= 0.035595 meV omega= 92.1999 meV lambda( 5 )= 0.016774 gamma= 0.021513 meV omega= 93.3506 meV lambda( 6 )= 0.017447 gamma= 0.028310 meV omega= 105.0009 meV lambda( tot )= 0.116557 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 94 coord.: 0.33333 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 95 coord.: 0.33333 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 96 coord.: 0.33333 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 97 coord.: 0.33333 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 98 coord.: 0.33333 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 99 coord.: 0.33333 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 100 coord.: 0.33333 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 101 coord.: 0.33333 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 102 coord.: 0.33333 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 103 coord.: 0.33333 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019503 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008250 gamma= 0.002266 meV omega= 43.2002 meV lambda( 3 )= 0.026130 gamma= 0.017289 meV omega= 67.0515 meV lambda( 4 )= 0.028450 gamma= 0.035593 meV omega= 92.1999 meV lambda( 5 )= 0.016769 gamma= 0.021507 meV omega= 93.3506 meV lambda( 6 )= 0.017446 gamma= 0.028308 meV omega= 105.0009 meV lambda( tot )= 0.116549 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 104 coord.: 0.33333 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 105 coord.: 0.33333 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000037 meV omega= 41.8048 meV lambda( 2 )= 0.001253 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011214 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003653 gamma= 0.004588 meV omega= 92.3809 meV lambda( 6 )= 0.004438 gamma= 0.007068 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 106 coord.: 0.33333 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 107 coord.: 0.33333 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 108 coord.: 0.33333 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 109 coord.: 0.50000 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006138 gamma= 0.000957 meV omega= 32.5420 meV lambda( 2 )= 0.005947 gamma= 0.000979 meV omega= 33.4448 meV lambda( 3 )= 0.058237 gamma= 0.049186 meV omega= 75.7547 meV lambda( 4 )= 0.030533 gamma= 0.037441 meV omega= 91.2801 meV lambda( 5 )= 0.030461 gamma= 0.037618 meV omega= 91.6046 meV lambda( 6 )= 0.019282 gamma= 0.032554 meV omega= 107.1067 meV lambda( tot )= 0.150597 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 110 coord.: 0.50000 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 111 coord.: 0.50000 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 112 coord.: 0.50000 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000007 gamma= -0.000002 meV omega= 43.4255 meV lambda( 2 )= -0.000002 gamma= -0.000000 meV omega= 45.6989 meV lambda( 3 )= 0.004056 gamma= 0.003554 meV omega= 77.1672 meV lambda( 4 )= 0.000198 gamma= 0.000238 meV omega= 90.2557 meV lambda( 5 )= 0.000174 gamma= 0.000214 meV omega= 91.3515 meV lambda( 6 )= 0.000807 gamma= 0.001295 meV omega= 104.4255 meV lambda( tot )= 0.005226 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 113 coord.: 0.50000 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 114 coord.: 0.50000 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 115 coord.: 0.50000 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002778 gamma= 0.000558 meV omega= 36.9315 meV lambda( 2 )= 0.007632 gamma= 0.002018 meV omega= 42.3891 meV lambda( 3 )= 0.025104 gamma= 0.018376 meV omega= 70.5247 meV lambda( 4 )= 0.014042 gamma= 0.017276 meV omega= 91.4339 meV lambda( 5 )= 0.018358 gamma= 0.023372 meV omega= 93.0071 meV lambda( 6 )= 0.007965 gamma= 0.012979 meV omega= 105.2273 meV lambda( tot )= 0.075878 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 116 coord.: 0.50000 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092507 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 117 coord.: 0.50000 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 118 coord.: 0.50000 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000277 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010984 gamma= 0.007952 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002637 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005091 gamma= 0.008194 meV omega= 104.5753 meV lambda( tot )= 0.021981 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 119 coord.: 0.50000 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 120 coord.: 0.50000 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 121 coord.: 0.50000 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000278 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010981 gamma= 0.007950 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002636 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005093 gamma= 0.008197 meV omega= 104.5753 meV lambda( tot )= 0.021979 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 122 coord.: 0.50000 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061057 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 123 coord.: 0.50000 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 124 coord.: 0.50000 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002777 gamma= 0.000557 meV omega= 36.9315 meV lambda( 2 )= 0.007635 gamma= 0.002019 meV omega= 42.3891 meV lambda( 3 )= 0.025107 gamma= 0.018378 meV omega= 70.5247 meV lambda( 4 )= 0.014043 gamma= 0.017278 meV omega= 91.4339 meV lambda( 5 )= 0.018357 gamma= 0.023369 meV omega= 93.0071 meV lambda( 6 )= 0.007960 gamma= 0.012972 meV omega= 105.2273 meV lambda( tot )= 0.075879 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 125 coord.: 0.50000 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 126 coord.: 0.50000 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 127 coord.: 0.50000 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000007 gamma= -0.000002 meV omega= 43.4255 meV lambda( 2 )= -0.000002 gamma= -0.000000 meV omega= 45.6989 meV lambda( 3 )= 0.004056 gamma= 0.003554 meV omega= 77.1672 meV lambda( 4 )= 0.000198 gamma= 0.000238 meV omega= 90.2557 meV lambda( 5 )= 0.000174 gamma= 0.000214 meV omega= 91.3515 meV lambda( 6 )= 0.000807 gamma= 0.001295 meV omega= 104.4255 meV lambda( tot )= 0.005226 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 128 coord.: 0.50000 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 129 coord.: 0.50000 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 130 coord.: 0.50000 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006138 gamma= 0.000957 meV omega= 32.5420 meV lambda( 2 )= 0.005947 gamma= 0.000979 meV omega= 33.4448 meV lambda( 3 )= 0.058237 gamma= 0.049186 meV omega= 75.7547 meV lambda( 4 )= 0.030533 gamma= 0.037441 meV omega= 91.2801 meV lambda( 5 )= 0.030461 gamma= 0.037618 meV omega= 91.6046 meV lambda( 6 )= 0.019282 gamma= 0.032554 meV omega= 107.1067 meV lambda( tot )= 0.150597 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 131 coord.: 0.50000 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 132 coord.: 0.50000 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 133 coord.: 0.50000 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000277 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010984 gamma= 0.007952 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002637 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005091 gamma= 0.008194 meV omega= 104.5753 meV lambda( tot )= 0.021981 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 134 coord.: 0.50000 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 135 coord.: 0.50000 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 136 coord.: 0.50000 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002778 gamma= 0.000558 meV omega= 36.9315 meV lambda( 2 )= 0.007632 gamma= 0.002018 meV omega= 42.3891 meV lambda( 3 )= 0.025104 gamma= 0.018376 meV omega= 70.5247 meV lambda( 4 )= 0.014042 gamma= 0.017276 meV omega= 91.4339 meV lambda( 5 )= 0.018358 gamma= 0.023372 meV omega= 93.0071 meV lambda( 6 )= 0.007965 gamma= 0.012979 meV omega= 105.2273 meV lambda( tot )= 0.075878 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 137 coord.: 0.50000 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092507 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 138 coord.: 0.50000 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 139 coord.: 0.50000 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.002777 gamma= 0.000557 meV omega= 36.9315 meV lambda( 2 )= 0.007635 gamma= 0.002019 meV omega= 42.3891 meV lambda( 3 )= 0.025107 gamma= 0.018378 meV omega= 70.5247 meV lambda( 4 )= 0.014043 gamma= 0.017278 meV omega= 91.4339 meV lambda( 5 )= 0.018357 gamma= 0.023369 meV omega= 93.0071 meV lambda( 6 )= 0.007960 gamma= 0.012972 meV omega= 105.2273 meV lambda( tot )= 0.075879 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 140 coord.: 0.50000 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 141 coord.: 0.50000 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 142 coord.: 0.50000 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000278 gamma= 0.000077 meV omega= 43.4093 meV lambda( 2 )= 0.002194 gamma= 0.000758 meV omega= 48.4534 meV lambda( 3 )= 0.010981 gamma= 0.007950 meV omega= 70.1380 meV lambda( 4 )= 0.000798 gamma= 0.000966 meV omega= 90.7191 meV lambda( 5 )= 0.002636 gamma= 0.003301 meV omega= 92.2332 meV lambda( 6 )= 0.005093 gamma= 0.008197 meV omega= 104.5753 meV lambda( tot )= 0.021979 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 143 coord.: 0.50000 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061057 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 144 coord.: 0.50000 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 145 coord.: 0.66667 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 146 coord.: 0.66667 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 147 coord.: 0.66667 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 148 coord.: 0.66667 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 149 coord.: 0.66667 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 150 coord.: 0.66667 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 151 coord.: 0.66667 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019504 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008241 gamma= 0.002263 meV omega= 43.2002 meV lambda( 3 )= 0.026140 gamma= 0.017296 meV omega= 67.0515 meV lambda( 4 )= 0.028451 gamma= 0.035595 meV omega= 92.1999 meV lambda( 5 )= 0.016774 gamma= 0.021513 meV omega= 93.3506 meV lambda( 6 )= 0.017447 gamma= 0.028310 meV omega= 105.0009 meV lambda( tot )= 0.116557 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 152 coord.: 0.66667 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 153 coord.: 0.66667 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 154 coord.: 0.66667 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 155 coord.: 0.66667 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000036 meV omega= 41.8048 meV lambda( 2 )= 0.001252 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011213 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003652 gamma= 0.004587 meV omega= 92.3809 meV lambda( 6 )= 0.004440 gamma= 0.007072 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 156 coord.: 0.66667 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 157 coord.: 0.66667 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 158 coord.: 0.66667 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 159 coord.: 0.66667 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 160 coord.: 0.66667 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 161 coord.: 0.66667 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 162 coord.: 0.66667 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 163 coord.: 0.66667 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.000142 gamma= -0.000037 meV omega= 41.8048 meV lambda( 2 )= 0.001253 gamma= 0.000439 meV omega= 48.8020 meV lambda( 3 )= 0.011214 gamma= 0.008206 meV omega= 70.5157 meV lambda( 4 )= 0.000871 gamma= 0.001072 meV omega= 91.4696 meV lambda( 5 )= 0.003653 gamma= 0.004588 meV omega= 92.3809 meV lambda( 6 )= 0.004438 gamma= 0.007068 meV omega= 104.0274 meV lambda( tot )= 0.021287 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 164 coord.: 0.66667 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 165 coord.: 0.66667 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 166 coord.: 0.66667 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 167 coord.: 0.66667 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.019503 gamma= 0.003292 meV omega= 33.8649 meV lambda( 2 )= 0.008250 gamma= 0.002266 meV omega= 43.2002 meV lambda( 3 )= 0.026130 gamma= 0.017289 meV omega= 67.0515 meV lambda( 4 )= 0.028450 gamma= 0.035593 meV omega= 92.1999 meV lambda( 5 )= 0.016769 gamma= 0.021507 meV omega= 93.3506 meV lambda( 6 )= 0.017446 gamma= 0.028308 meV omega= 105.0009 meV lambda( tot )= 0.116549 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 168 coord.: 0.66667 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 169 coord.: 0.66667 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 2 )= 0.000852 gamma= 0.000203 meV omega= 40.2848 meV lambda( 3 )= 0.014537 gamma= 0.008317 meV omega= 62.3474 meV lambda( 4 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 5 )= 0.004624 gamma= 0.005806 meV omega= 92.3649 meV lambda( 6 )= 0.017198 gamma= 0.029405 meV omega= 107.7867 meV lambda( tot )= 0.042686 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 170 coord.: 0.66667 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 171 coord.: 0.66667 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000768 gamma= 0.000197 meV omega= 41.7009 meV lambda( 2 )= 0.001384 gamma= 0.000663 meV omega= 57.0531 meV lambda( 3 )= 0.013588 gamma= 0.008618 meV omega= 65.6467 meV lambda( 4 )= 0.004548 gamma= 0.005489 meV omega= 90.5578 meV lambda( 5 )= 0.000815 gamma= 0.001006 meV omega= 91.5830 meV lambda( 6 )= 0.006970 gamma= 0.010979 meV omega= 103.4577 meV lambda( tot )= 0.028073 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 172 coord.: 0.66667 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092508 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 173 coord.: 0.66667 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 2 )= 0.008338 gamma= 0.001023 meV omega= 28.8761 meV lambda( 3 )= 0.067495 gamma= 0.038043 meV omega= 61.8858 meV lambda( 4 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 5 )= 0.039207 gamma= 0.049773 meV omega= 92.8762 meV lambda( 6 )= 0.053434 gamma= 0.091180 meV omega= 107.6783 meV lambda( tot )= 0.216018 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 174 coord.: 0.66667 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 175 coord.: 0.66667 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001935 gamma= -0.000299 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023991 gamma= 0.030819 meV omega= 93.4283 meV lambda( 5 )= 0.025495 gamma= 0.034196 meV omega= 95.4660 meV lambda( 6 )= 0.026536 gamma= 0.043288 meV omega= 105.2814 meV lambda( tot )= 0.120950 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 176 coord.: 0.66667 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 177 coord.: 0.66667 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000606 gamma= 0.000167 meV omega= 43.3151 meV lambda( 2 )= 0.004350 gamma= 0.001872 meV omega= 54.0721 meV lambda( 3 )= 0.010071 gamma= 0.006729 meV omega= 67.3790 meV lambda( 4 )= 0.005094 gamma= 0.006196 meV omega= 90.9060 meV lambda( 5 )= 0.004136 gamma= 0.005116 meV omega= 91.6851 meV lambda( 6 )= 0.005195 gamma= 0.008094 meV omega= 102.8843 meV lambda( tot )= 0.029452 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 178 coord.: 0.66667 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061057 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 179 coord.: 0.66667 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001931 gamma= -0.000298 meV omega= 32.3971 meV lambda( 2 )= 0.009663 gamma= 0.001511 meV omega= 32.6007 meV lambda( 3 )= 0.037200 gamma= 0.017190 meV omega= 56.0345 meV lambda( 4 )= 0.023989 gamma= 0.030817 meV omega= 93.4283 meV lambda( 5 )= 0.025494 gamma= 0.034195 meV omega= 95.4660 meV lambda( 6 )= 0.026539 gamma= 0.043292 meV omega= 105.2814 meV lambda( tot )= 0.120955 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 180 coord.: 0.66667 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112626 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 181 coord.: 0.83333 0.00000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048001 gamma= -0.001843 meV omega= 16.1523 meV lambda( 2 )= -0.030181 gamma= -0.001370 meV omega= 17.5651 meV lambda( 3 )= 0.037733 gamma= 0.006060 meV omega= 33.0343 meV lambda( 4 )= 0.036003 gamma= 0.047010 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049576 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081621 meV omega= 100.8907 meV lambda( tot )= 0.087827 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 182 coord.: 0.83333 0.00000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112627 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 183 coord.: 0.83333 0.00000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006685 gamma= 0.001807 meV omega= 42.8555 meV lambda( 3 )= 0.029675 gamma= 0.019073 meV omega= 66.0846 meV lambda( 4 )= 0.022340 gamma= 0.027835 meV omega= 92.0110 meV lambda( 5 )= 0.012989 gamma= 0.016776 meV omega= 93.6776 meV lambda( 6 )= 0.014070 gamma= 0.023037 meV omega= 105.4775 meV lambda( tot )= 0.092507 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 184 coord.: 0.83333 0.00000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001422 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011949 gamma= 0.003176 meV omega= 42.4959 meV lambda( 3 )= 0.023876 gamma= 0.017700 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016178 meV omega= 91.2374 meV lambda( 5 )= 0.017593 gamma= 0.022301 meV omega= 92.8079 meV lambda( 6 )= 0.009499 gamma= 0.015436 meV omega= 105.0823 meV lambda( tot )= 0.077543 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 185 coord.: 0.83333 0.00000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 186 coord.: 0.83333 0.00000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018139 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017422 gamma= -0.001341 meV omega= 22.8692 meV lambda( 3 )= 0.018752 gamma= 0.003227 meV omega= 34.1944 meV lambda( 4 )= 0.044449 gamma= 0.058578 meV omega= 94.6292 meV lambda( 5 )= 0.046848 gamma= 0.062307 meV omega= 95.0633 meV lambda( 6 )= 0.082430 gamma= 0.125648 meV omega= 101.7711 meV lambda( tot )= 0.193195 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 187 coord.: 0.83333 0.16667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053618 gamma= 0.004459 meV omega= 23.7706 meV lambda( 2 )= 0.000431 gamma= 0.000066 meV omega= 32.3607 meV lambda( 3 )= 0.000772 gamma= 0.000266 meV omega= 48.3490 meV lambda( 4 )= 0.031641 gamma= 0.041193 meV omega= 94.0538 meV lambda( 5 )= 0.029447 gamma= 0.039653 meV omega= 95.6544 meV lambda( 6 )= 0.026926 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142836 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 188 coord.: 0.83333 0.16667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003348 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008369 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028471 gamma= 0.012633 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029595 meV omega= 93.2786 meV lambda( 5 )= 0.026060 gamma= 0.034257 meV omega= 94.5086 meV lambda( 6 )= 0.031479 gamma= 0.052251 meV omega= 106.2000 meV lambda( tot )= 0.120838 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 189 coord.: 0.83333 0.16667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017970 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017028 gamma= 0.021409 meV omega= 92.4292 meV lambda( 5 )= 0.007064 gamma= 0.009117 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061057 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 190 coord.: 0.83333 0.16667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007770 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 191 coord.: 0.83333 0.16667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 192 coord.: 0.83333 0.16667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004355 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003305 gamma= 0.000547 meV omega= 33.5472 meV lambda( 3 )= 0.030143 gamma= 0.013437 meV omega= 55.0357 meV lambda( 4 )= 0.023171 gamma= 0.029670 meV omega= 93.2760 meV lambda( 5 )= 0.025554 gamma= 0.033646 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050951 meV omega= 106.2388 meV lambda( tot )= 0.117202 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 193 coord.: 0.83333 0.33333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007297 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003522 gamma= 0.000940 meV omega= 42.5756 meV lambda( 3 )= 0.030622 gamma= 0.019986 meV omega= 66.5934 meV lambda( 4 )= 0.023692 gamma= 0.029415 meV omega= 91.8482 meV lambda( 5 )= 0.014727 gamma= 0.018992 meV omega= 93.6086 meV lambda( 6 )= 0.013222 gamma= 0.021584 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 194 coord.: 0.83333 0.33333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018111 gamma= 0.010793 meV omega= 63.6331 meV lambda( 4 )= 0.013911 gamma= 0.017342 meV omega= 92.0367 meV lambda( 5 )= 0.012924 gamma= 0.016729 meV omega= 93.7824 meV lambda( 6 )= 0.010007 gamma= 0.016083 meV omega= 104.4993 meV lambda( tot )= 0.063162 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 195 coord.: 0.83333 0.33333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001993 gamma= 0.000688 meV omega= 48.4212 meV lambda( 3 )= 0.011248 gamma= 0.008148 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005079 gamma= 0.008181 meV omega= 104.6192 meV lambda( tot )= 0.021920 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 196 coord.: 0.83333 0.33333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 197 coord.: 0.83333 0.33333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 198 coord.: 0.83333 0.33333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001292 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006631 gamma= 0.001725 meV omega= 42.0490 meV lambda( 3 )= 0.027323 gamma= 0.020375 meV omega= 71.1823 meV lambda( 4 )= 0.016600 gamma= 0.020577 meV omega= 91.7744 meV lambda( 5 )= 0.020361 gamma= 0.025963 meV omega= 93.0805 meV lambda( 6 )= 0.005048 gamma= 0.008169 meV omega= 104.8553 meV lambda( tot )= 0.074672 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 199 coord.: 0.83333 0.50000 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.001291 gamma= -0.000247 meV omega= 36.0771 meV lambda( 2 )= 0.006632 gamma= 0.001726 meV omega= 42.0490 meV lambda( 3 )= 0.027325 gamma= 0.020376 meV omega= 71.1823 meV lambda( 4 )= 0.016601 gamma= 0.020578 meV omega= 91.7744 meV lambda( 5 )= 0.020359 gamma= 0.025960 meV omega= 93.0805 meV lambda( 6 )= 0.005044 gamma= 0.008162 meV omega= 104.8553 meV lambda( tot )= 0.074671 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 200 coord.: 0.83333 0.50000 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000469 gamma= 0.000128 meV omega= 43.0082 meV lambda( 2 )= 0.003432 gamma= 0.001424 meV omega= 53.1026 meV lambda( 3 )= 0.010325 gamma= 0.006875 meV omega= 67.2653 meV lambda( 4 )= 0.006150 gamma= 0.007542 meV omega= 91.2810 meV lambda( 5 )= 0.003760 gamma= 0.004678 meV omega= 91.9417 meV lambda( 6 )= 0.004967 gamma= 0.007760 meV omega= 103.0314 meV lambda( tot )= 0.029103 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 201 coord.: 0.83333 0.50000 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000073 gamma= 0.000024 meV omega= 47.4567 meV lambda( 2 )= 0.000283 gamma= 0.000109 meV omega= 51.1442 meV lambda( 3 )= 0.003733 gamma= 0.002716 meV omega= 70.3113 meV lambda( 4 )= 0.000392 gamma= 0.000469 meV omega= 90.0928 meV lambda( 5 )= 0.001119 gamma= 0.001387 meV omega= 91.7695 meV lambda( 6 )= 0.000990 gamma= 0.001536 meV omega= 102.7062 meV lambda( tot )= 0.006589 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 202 coord.: 0.83333 0.50000 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000283 gamma= 0.000079 meV omega= 43.6173 meV lambda( 2 )= 0.001992 gamma= 0.000687 meV omega= 48.4212 meV lambda( 3 )= 0.011246 gamma= 0.008147 meV omega= 70.1580 meV lambda( 4 )= 0.000833 gamma= 0.001007 meV omega= 90.6147 meV lambda( 5 )= 0.002484 gamma= 0.003107 meV omega= 92.1896 meV lambda( 6 )= 0.005081 gamma= 0.008184 meV omega= 104.6192 meV lambda( tot )= 0.021919 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 203 coord.: 0.83333 0.50000 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 204 coord.: 0.83333 0.50000 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.007299 gamma= 0.001301 meV omega= 34.8074 meV lambda( 2 )= 0.003512 gamma= 0.000937 meV omega= 42.5756 meV lambda( 3 )= 0.030632 gamma= 0.019992 meV omega= 66.5934 meV lambda( 4 )= 0.023691 gamma= 0.029414 meV omega= 91.8482 meV lambda( 5 )= 0.014731 gamma= 0.018997 meV omega= 93.6086 meV lambda( 6 )= 0.013219 gamma= 0.021578 meV omega= 105.3174 meV lambda( tot )= 0.093083 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 205 coord.: 0.83333 0.66667 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.004352 gamma= 0.000699 meV omega= 33.0338 meV lambda( 2 )= 0.003307 gamma= 0.000548 meV omega= 33.5472 meV lambda( 3 )= 0.030140 gamma= 0.013436 meV omega= 55.0357 meV lambda( 4 )= 0.023172 gamma= 0.029671 meV omega= 93.2760 meV lambda( 5 )= 0.025553 gamma= 0.033645 meV omega= 94.5851 meV lambda( 6 )= 0.030673 gamma= 0.050949 meV omega= 106.2388 meV lambda( tot )= 0.117197 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 206 coord.: 0.83333 0.66667 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003047 gamma= 0.000713 meV omega= 39.8872 meV lambda( 2 )= 0.005161 gamma= 0.001691 meV omega= 47.1857 meV lambda( 3 )= 0.018110 gamma= 0.010792 meV omega= 63.6331 meV lambda( 4 )= 0.013910 gamma= 0.017341 meV omega= 92.0367 meV lambda( 5 )= 0.012923 gamma= 0.016727 meV omega= 93.7824 meV lambda( 6 )= 0.010008 gamma= 0.016084 meV omega= 104.4993 meV lambda( tot )= 0.063158 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 207 coord.: 0.83333 0.66667 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000441 gamma= 0.000123 meV omega= 43.6205 meV lambda( 2 )= 0.003608 gamma= 0.001508 meV omega= 53.2983 meV lambda( 3 )= 0.010138 gamma= 0.006768 meV omega= 67.3512 meV lambda( 4 )= 0.005419 gamma= 0.006616 meV omega= 91.0788 meV lambda( 5 )= 0.004966 gamma= 0.006121 meV omega= 91.5193 meV lambda( 6 )= 0.004960 gamma= 0.007771 meV omega= 103.1717 meV lambda( tot )= 0.029533 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 208 coord.: 0.83333 0.66667 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003396 gamma= 0.000770 meV omega= 39.2443 meV lambda( 2 )= 0.004973 gamma= 0.001662 meV omega= 47.6558 meV lambda( 3 )= 0.017971 gamma= 0.010602 meV omega= 63.3143 meV lambda( 4 )= 0.017029 gamma= 0.021411 meV omega= 92.4292 meV lambda( 5 )= 0.007066 gamma= 0.009120 meV omega= 93.6450 meV lambda( 6 )= 0.010625 gamma= 0.017076 meV omega= 104.4999 meV lambda( tot )= 0.061060 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 209 coord.: 0.83333 0.66667 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 210 coord.: 0.83333 0.66667 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.053632 gamma= 0.004460 meV omega= 23.7706 meV lambda( 2 )= 0.000422 gamma= 0.000065 meV omega= 32.3607 meV lambda( 3 )= 0.000771 gamma= 0.000265 meV omega= 48.3490 meV lambda( 4 )= 0.031640 gamma= 0.041192 meV omega= 94.0538 meV lambda( 5 )= 0.029445 gamma= 0.039651 meV omega= 95.6544 meV lambda( 6 )= 0.026927 gamma= 0.043203 meV omega= 104.4133 meV lambda( tot )= 0.142837 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 211 coord.: 0.83333 0.83333 0.00000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.018143 gamma= 0.001195 meV omega= 21.1580 meV lambda( 2 )= -0.017439 gamma= -0.001342 meV omega= 22.8692 meV lambda( 3 )= 0.018761 gamma= 0.003228 meV omega= 34.1944 meV lambda( 4 )= 0.044450 gamma= 0.058579 meV omega= 94.6292 meV lambda( 5 )= 0.046851 gamma= 0.062311 meV omega= 95.0633 meV lambda( 6 )= 0.082428 gamma= 0.125646 meV omega= 101.7711 meV lambda( tot )= 0.193193 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 212 coord.: 0.83333 0.83333 0.16667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.003349 gamma= 0.000530 meV omega= 32.7964 meV lambda( 2 )= 0.008368 gamma= 0.001450 meV omega= 34.3108 meV lambda( 3 )= 0.028473 gamma= 0.012634 meV omega= 54.9087 meV lambda( 4 )= 0.023111 gamma= 0.029594 meV omega= 93.2786 meV lambda( 5 )= 0.026061 gamma= 0.034258 meV omega= 94.5086 meV lambda( 6 )= 0.031480 gamma= 0.052252 meV omega= 106.2000 meV lambda( tot )= 0.120841 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 213 coord.: 0.83333 0.83333 0.33333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.001424 gamma= 0.000292 meV omega= 37.3447 meV lambda( 2 )= 0.011943 gamma= 0.003174 meV omega= 42.4959 meV lambda( 3 )= 0.023874 gamma= 0.017699 meV omega= 70.9744 meV lambda( 4 )= 0.013205 gamma= 0.016177 meV omega= 91.2374 meV lambda( 5 )= 0.017595 gamma= 0.022304 meV omega= 92.8079 meV lambda( 6 )= 0.009500 gamma= 0.015438 meV omega= 105.0823 meV lambda( tot )= 0.077541 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 214 coord.: 0.83333 0.83333 0.50000 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.006748 gamma= 0.001170 meV omega= 34.3300 meV lambda( 2 )= 0.006674 gamma= 0.001804 meV omega= 42.8555 meV lambda( 3 )= 0.029686 gamma= 0.019080 meV omega= 66.0846 meV lambda( 4 )= 0.022339 gamma= 0.027833 meV omega= 92.0110 meV lambda( 5 )= 0.012992 gamma= 0.016779 meV omega= 93.6776 meV lambda( 6 )= 0.014067 gamma= 0.023033 meV omega= 105.4775 meV lambda( tot )= 0.092505 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 215 coord.: 0.83333 0.83333 0.66667 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= 0.000719 gamma= 0.000062 meV omega= 24.1980 meV lambda( 2 )= 0.012982 gamma= 0.002058 meV omega= 32.8195 meV lambda( 3 )= 0.025746 gamma= 0.008983 meV omega= 48.6902 meV lambda( 4 )= 0.028046 gamma= 0.036290 meV omega= 93.7668 meV lambda( 5 )= 0.022330 gamma= 0.030304 meV omega= 96.0271 meV lambda( 6 )= 0.022804 gamma= 0.036250 meV omega= 103.9283 meV lambda( tot )= 0.112626 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 ismear = 1 iq = 216 coord.: 0.83333 0.83333 0.83333 wt: 0.00463 ------------------------------------------------------------------- lambda( 1 )= -0.048011 gamma= -0.001843 meV omega= 16.1523 meV lambda( 2 )= -0.030185 gamma= -0.001371 meV omega= 17.5651 meV lambda( 3 )= 0.037737 gamma= 0.006061 meV omega= 33.0343 meV lambda( 4 )= 0.036004 gamma= 0.047011 meV omega= 94.1918 meV lambda( 5 )= 0.037788 gamma= 0.049577 meV omega= 94.4170 meV lambda( 6 )= 0.054485 gamma= 0.081620 meV omega= 100.8907 meV lambda( tot )= 0.087818 ------------------------------------------------------------------- Number of (k,k+q) pairs on the Fermi surface: 216 out of 216 WARNING: only the eigenstates within the Fermi window are meaningful ik = 1 coord.: 0.0000000 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.7777 eV Re[Sigma]= -224.143967 meV Im[Sigma]= 57.147494 meV Z= 0.981076 lam= 0.019289 E( 2 )= -0.3992 eV Re[Sigma]= 234.444103 meV Im[Sigma]= 146.202924 meV Z= 0.998797 lam= 0.001204 E( 3 )= -0.3992 eV Re[Sigma]= 234.160701 meV Im[Sigma]= 145.328448 meV Z= 0.998447 lam= 0.001555 E( 4 )= -0.3992 eV Re[Sigma]= 234.988512 meV Im[Sigma]= 147.882936 meV Z= 0.999469 lam= 0.000531 ------------------------------------------------------------------- ik = 2 coord.: 0.0000000 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995407 meV Im[Sigma]= 87.929014 meV Z= 0.995273 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.013416 meV Im[Sigma]= 392.552882 meV Z= 1.122729 lam= -0.109313 E( 3 )= -0.6014 eV Re[Sigma]= 229.440618 meV Im[Sigma]= 180.678235 meV Z= 1.013876 lam= -0.013686 E( 4 )= -0.6014 eV Re[Sigma]= 229.588541 meV Im[Sigma]= 181.334583 meV Z= 1.014165 lam= -0.013967 ------------------------------------------------------------------- ik = 3 coord.: 0.0000000 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.664178 meV Im[Sigma]= 180.568492 meV Z= 1.019693 lam= -0.019313 E( 2 )= -6.6106 eV Re[Sigma]= -2.724639 meV Im[Sigma]= 146.307367 meV Z= 0.994023 lam= 0.006013 E( 3 )= -1.2665 eV Re[Sigma]= 189.131163 meV Im[Sigma]= 291.286819 meV Z= 1.068391 lam= -0.064013 E( 4 )= -1.2665 eV Re[Sigma]= 189.505389 meV Im[Sigma]= 295.191781 meV Z= 1.070043 lam= -0.065458 ------------------------------------------------------------------- ik = 4 coord.: 0.0000000 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.4659 eV Re[Sigma]= -158.589517 meV Im[Sigma]= 282.995113 meV Z= 1.080696 lam= -0.074671 E( 2 )= -9.2155 eV Re[Sigma]= 6.729105 meV Im[Sigma]= 63.706796 meV Z= 0.951883 lam= 0.050549 E( 3 )= -1.7294 eV Re[Sigma]= 141.436857 meV Im[Sigma]= 333.142817 meV Z= 1.104403 lam= -0.094533 E( 4 )= -1.7294 eV Re[Sigma]= 140.821734 meV Im[Sigma]= 331.271636 meV Z= 1.103371 lam= -0.093686 ------------------------------------------------------------------- ik = 5 coord.: 0.0000000 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.665612 meV Im[Sigma]= 180.564031 meV Z= 1.019691 lam= -0.019310 E( 2 )= -6.6106 eV Re[Sigma]= -2.723594 meV Im[Sigma]= 146.303266 meV Z= 0.994022 lam= 0.006014 E( 3 )= -1.2665 eV Re[Sigma]= 189.386440 meV Im[Sigma]= 293.965040 meV Z= 1.069524 lam= -0.065004 E( 4 )= -1.2665 eV Re[Sigma]= 189.248543 meV Im[Sigma]= 292.524716 meV Z= 1.068914 lam= -0.064471 ------------------------------------------------------------------- ik = 6 coord.: 0.0000000 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995551 meV Im[Sigma]= 87.928462 meV Z= 0.995272 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.014574 meV Im[Sigma]= 392.541797 meV Z= 1.122724 lam= -0.109309 E( 3 )= -0.6014 eV Re[Sigma]= 229.293522 meV Im[Sigma]= 180.023285 meV Z= 1.013588 lam= -0.013406 E( 4 )= -0.6014 eV Re[Sigma]= 229.738600 meV Im[Sigma]= 181.998816 meV Z= 1.014457 lam= -0.014251 ------------------------------------------------------------------- ik = 7 coord.: 0.0000000 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -222.795724 meV Im[Sigma]= 87.815347 meV Z= 0.995607 lam= 0.004412 E( 2 )= -2.2204 eV Re[Sigma]= 99.719647 meV Im[Sigma]= 391.350062 meV Z= 1.121641 lam= -0.108449 E( 3 )= -0.6014 eV Re[Sigma]= 229.272511 meV Im[Sigma]= 183.982488 meV Z= 1.015654 lam= -0.015413 E( 4 )= -0.6014 eV Re[Sigma]= 229.272503 meV Im[Sigma]= 183.982478 meV Z= 1.015654 lam= -0.015413 ------------------------------------------------------------------- ik = 8 coord.: 0.0000000 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339337 meV Im[Sigma]= 97.846698 meV Z= 0.995803 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.771631 meV Im[Sigma]= 380.346876 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.640810 meV Im[Sigma]= 289.196164 meV Z= 1.063192 lam= -0.059436 E( 4 )= -1.1893 eV Re[Sigma]= 203.610844 meV Im[Sigma]= 288.764846 meV Z= 1.063082 lam= -0.059339 ------------------------------------------------------------------- ik = 9 coord.: 0.0000000 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759100 meV Im[Sigma]= 178.950791 meV Z= 1.026313 lam= -0.025638 E( 2 )= -5.0893 eV Re[Sigma]= -20.997052 meV Im[Sigma]= 196.991471 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.359948 meV Im[Sigma]= 356.031902 meV Z= 1.113999 lam= -0.102333 E( 4 )= -1.7453 eV Re[Sigma]= 148.676423 meV Im[Sigma]= 348.112871 meV Z= 1.109261 lam= -0.098499 ------------------------------------------------------------------- ik = 10 coord.: 0.0000000 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.424980 meV Im[Sigma]= 299.488488 meV Z= 1.079309 lam= -0.073481 E( 2 )= -8.4181 eV Re[Sigma]= -25.264863 meV Im[Sigma]= 148.073942 meV Z= 1.003430 lam= -0.003419 E( 3 )= -2.9817 eV Re[Sigma]= 42.139205 meV Im[Sigma]= 293.348051 meV Z= 1.061021 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.513264 meV Im[Sigma]= 333.288677 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 11 coord.: 0.0000000 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.073793 meV Im[Sigma]= 268.832750 meV Z= 1.066517 lam= -0.062368 E( 2 )= -7.5294 eV Re[Sigma]= -12.455897 meV Im[Sigma]= 206.039031 meV Z= 1.049752 lam= -0.047394 E( 3 )= -3.4617 eV Re[Sigma]= 23.568172 meV Im[Sigma]= 242.558697 meV Z= 1.036926 lam= -0.035611 E( 4 )= -1.4850 eV Re[Sigma]= 166.751677 meV Im[Sigma]= 318.688624 meV Z= 1.089101 lam= -0.081811 ------------------------------------------------------------------- ik = 12 coord.: 0.0000000 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.952281 meV Im[Sigma]= 147.989183 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.982518 meV Im[Sigma]= 242.987366 meV Z= 1.019647 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297434 meV Im[Sigma]= 350.703061 meV Z= 1.103681 lam= -0.093941 E( 4 )= -0.6189 eV Re[Sigma]= 224.007567 meV Im[Sigma]= 185.539999 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 13 coord.: 0.0000000 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -195.560721 meV Im[Sigma]= 177.008942 meV Z= 1.018974 lam= -0.018620 E( 2 )= -6.6106 eV Re[Sigma]= -3.750296 meV Im[Sigma]= 141.610796 meV Z= 0.993139 lam= 0.006908 E( 3 )= -1.2665 eV Re[Sigma]= 189.380367 meV Im[Sigma]= 294.934281 meV Z= 1.069441 lam= -0.064932 E( 4 )= -1.2665 eV Re[Sigma]= 189.380364 meV Im[Sigma]= 294.934276 meV Z= 1.069441 lam= -0.064932 ------------------------------------------------------------------- ik = 14 coord.: 0.0000000 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047914 meV Im[Sigma]= 175.367705 meV Z= 1.024656 lam= -0.024063 E( 2 )= -5.0893 eV Re[Sigma]= -22.701330 meV Im[Sigma]= 195.270199 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.868905 meV Im[Sigma]= 360.047282 meV Z= 1.116202 lam= -0.104105 E( 4 )= -1.7453 eV Re[Sigma]= 147.323262 meV Im[Sigma]= 350.521895 meV Z= 1.110208 lam= -0.099268 ------------------------------------------------------------------- ik = 15 coord.: 0.0000000 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021151 meV Im[Sigma]= 231.204218 meV Z= 1.023297 lam= -0.022767 E( 2 )= -5.4186 eV Re[Sigma]= -25.458560 meV Im[Sigma]= 176.201128 meV Z= 1.011245 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 38.545780 meV Im[Sigma]= 275.837631 meV Z= 1.056264 lam= -0.053267 E( 4 )= -3.0665 eV Re[Sigma]= 37.169366 meV Im[Sigma]= 275.488145 meV Z= 1.056111 lam= -0.053130 ------------------------------------------------------------------- ik = 16 coord.: 0.0000000 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.799119 meV Im[Sigma]= 271.299051 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.849572 meV Im[Sigma]= 192.530091 meV Z= 1.037385 lam= -0.036038 E( 3 )= -4.6413 eV Re[Sigma]= 14.838564 meV Im[Sigma]= 178.853020 meV Z= 1.019823 lam= -0.019438 E( 4 )= -3.4814 eV Re[Sigma]= 26.578560 meV Im[Sigma]= 225.184100 meV Z= 1.033329 lam= -0.032254 ------------------------------------------------------------------- ik = 17 coord.: 0.0000000 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047628 meV Im[Sigma]= 240.238455 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976221 meV Im[Sigma]= 215.028857 meV Z= 1.052400 lam= -0.049791 E( 3 )= -6.1421 eV Re[Sigma]= 34.445105 meV Im[Sigma]= 126.239161 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260206 meV Im[Sigma]= 314.819569 meV Z= 1.073811 lam= -0.068737 ------------------------------------------------------------------- ik = 18 coord.: 0.0000000 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.877602 meV Im[Sigma]= 263.994922 meV Z= 1.064099 lam= -0.060238 E( 2 )= -7.5294 eV Re[Sigma]= -10.789342 meV Im[Sigma]= 199.125057 meV Z= 1.047637 lam= -0.045471 E( 3 )= -3.4617 eV Re[Sigma]= 25.269187 meV Im[Sigma]= 246.342577 meV Z= 1.037337 lam= -0.035994 E( 4 )= -1.4850 eV Re[Sigma]= 167.275053 meV Im[Sigma]= 322.677851 meV Z= 1.090636 lam= -0.083104 ------------------------------------------------------------------- ik = 19 coord.: 0.0000000 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.4659 eV Re[Sigma]= -157.153675 meV Im[Sigma]= 271.553948 meV Z= 1.074257 lam= -0.069124 E( 2 )= -9.2155 eV Re[Sigma]= 9.577339 meV Im[Sigma]= 61.415022 meV Z= 0.952624 lam= 0.049732 E( 3 )= -1.7294 eV Re[Sigma]= 140.978936 meV Im[Sigma]= 331.151864 meV Z= 1.103788 lam= -0.094029 E( 4 )= -1.7294 eV Re[Sigma]= 140.978940 meV Im[Sigma]= 331.151851 meV Z= 1.103788 lam= -0.094029 ------------------------------------------------------------------- ik = 20 coord.: 0.0000000 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.929831 meV Im[Sigma]= 289.845704 meV Z= 1.074754 lam= -0.069554 E( 2 )= -8.4181 eV Re[Sigma]= -24.131978 meV Im[Sigma]= 141.910657 meV Z= 1.001587 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.422004 meV Im[Sigma]= 292.832612 meV Z= 1.060071 lam= -0.056667 E( 4 )= -2.2693 eV Re[Sigma]= 91.267771 meV Im[Sigma]= 336.778494 meV Z= 1.099797 lam= -0.090742 ------------------------------------------------------------------- ik = 21 coord.: 0.0000000 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899232 meV Im[Sigma]= 267.550202 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457427 meV Im[Sigma]= 188.748670 meV Z= 1.036062 lam= -0.034807 E( 3 )= -4.6413 eV Re[Sigma]= 16.532384 meV Im[Sigma]= 177.586883 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.736207 meV Im[Sigma]= 225.008074 meV Z= 1.032040 lam= -0.031045 ------------------------------------------------------------------- ik = 22 coord.: 0.0000000 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.1466 eV Re[Sigma]= -66.998867 meV Im[Sigma]= 238.934404 meV Z= 1.048294 lam= -0.046069 E( 2 )= -7.9488 eV Re[Sigma]= -29.285917 meV Im[Sigma]= 175.808011 meV Z= 1.030885 lam= -0.029960 E( 3 )= -4.1536 eV Re[Sigma]= 21.577765 meV Im[Sigma]= 173.692861 meV Z= 1.009739 lam= -0.009645 E( 4 )= -4.1536 eV Re[Sigma]= 22.659865 meV Im[Sigma]= 175.166464 meV Z= 1.009859 lam= -0.009763 ------------------------------------------------------------------- ik = 23 coord.: 0.0000000 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899934 meV Im[Sigma]= 267.550360 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457299 meV Im[Sigma]= 188.746837 meV Z= 1.036061 lam= -0.034806 E( 3 )= -4.6413 eV Re[Sigma]= 16.531800 meV Im[Sigma]= 177.586260 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.734116 meV Im[Sigma]= 225.005315 meV Z= 1.032038 lam= -0.031043 ------------------------------------------------------------------- ik = 24 coord.: 0.0000000 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.932509 meV Im[Sigma]= 289.844016 meV Z= 1.074752 lam= -0.069553 E( 2 )= -8.4181 eV Re[Sigma]= -24.130874 meV Im[Sigma]= 141.909768 meV Z= 1.001588 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.419509 meV Im[Sigma]= 292.832507 meV Z= 1.060072 lam= -0.056668 E( 4 )= -2.2693 eV Re[Sigma]= 91.265964 meV Im[Sigma]= 336.780379 meV Z= 1.099799 lam= -0.090743 ------------------------------------------------------------------- ik = 25 coord.: 0.0000000 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -195.561741 meV Im[Sigma]= 177.004922 meV Z= 1.018971 lam= -0.018618 E( 2 )= -6.6106 eV Re[Sigma]= -3.748495 meV Im[Sigma]= 141.607458 meV Z= 0.993139 lam= 0.006909 E( 3 )= -1.2665 eV Re[Sigma]= 189.378889 meV Im[Sigma]= 294.939888 meV Z= 1.069443 lam= -0.064934 E( 4 )= -1.2665 eV Re[Sigma]= 189.378884 meV Im[Sigma]= 294.939883 meV Z= 1.069443 lam= -0.064934 ------------------------------------------------------------------- ik = 26 coord.: 0.0000000 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.879859 meV Im[Sigma]= 263.993026 meV Z= 1.064098 lam= -0.060237 E( 2 )= -7.5294 eV Re[Sigma]= -10.788167 meV Im[Sigma]= 199.121588 meV Z= 1.047636 lam= -0.045470 E( 3 )= -3.4617 eV Re[Sigma]= 25.268823 meV Im[Sigma]= 246.341120 meV Z= 1.037336 lam= -0.035992 E( 4 )= -1.4850 eV Re[Sigma]= 167.274321 meV Im[Sigma]= 322.679579 meV Z= 1.090637 lam= -0.083105 ------------------------------------------------------------------- ik = 27 coord.: 0.0000000 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047244 meV Im[Sigma]= 240.239652 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976657 meV Im[Sigma]= 215.030962 meV Z= 1.052401 lam= -0.049792 E( 3 )= -6.1421 eV Re[Sigma]= 34.445037 meV Im[Sigma]= 126.239203 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260735 meV Im[Sigma]= 314.820700 meV Z= 1.073811 lam= -0.068738 ------------------------------------------------------------------- ik = 28 coord.: 0.0000000 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.800382 meV Im[Sigma]= 271.299879 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.848489 meV Im[Sigma]= 192.531527 meV Z= 1.037386 lam= -0.036039 E( 3 )= -4.6413 eV Re[Sigma]= 14.838425 meV Im[Sigma]= 178.848578 meV Z= 1.019821 lam= -0.019436 E( 4 )= -3.4814 eV Re[Sigma]= 26.577218 meV Im[Sigma]= 225.180065 meV Z= 1.033326 lam= -0.032252 ------------------------------------------------------------------- ik = 29 coord.: 0.0000000 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021734 meV Im[Sigma]= 231.203607 meV Z= 1.023297 lam= -0.022766 E( 2 )= -5.4186 eV Re[Sigma]= -25.458755 meV Im[Sigma]= 176.201801 meV Z= 1.011246 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 38.416074 meV Im[Sigma]= 275.803501 meV Z= 1.056248 lam= -0.053253 E( 4 )= -3.0665 eV Re[Sigma]= 37.299220 meV Im[Sigma]= 275.519427 meV Z= 1.056125 lam= -0.053143 ------------------------------------------------------------------- ik = 30 coord.: 0.0000000 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047979 meV Im[Sigma]= 175.366415 meV Z= 1.024655 lam= -0.024062 E( 2 )= -5.0893 eV Re[Sigma]= -22.700369 meV Im[Sigma]= 195.269989 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.865515 meV Im[Sigma]= 360.052931 meV Z= 1.116205 lam= -0.104107 E( 4 )= -1.7453 eV Re[Sigma]= 147.322874 meV Im[Sigma]= 350.524853 meV Z= 1.110210 lam= -0.099270 ------------------------------------------------------------------- ik = 31 coord.: 0.0000000 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -222.795765 meV Im[Sigma]= 87.815911 meV Z= 0.995607 lam= 0.004412 E( 2 )= -2.2204 eV Re[Sigma]= 99.720861 meV Im[Sigma]= 391.334471 meV Z= 1.121634 lam= -0.108443 E( 3 )= -0.6014 eV Re[Sigma]= 229.273740 meV Im[Sigma]= 183.987869 meV Z= 1.015656 lam= -0.015415 E( 4 )= -0.6014 eV Re[Sigma]= 229.273715 meV Im[Sigma]= 183.987836 meV Z= 1.015656 lam= -0.015415 ------------------------------------------------------------------- ik = 32 coord.: 0.0000000 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.951835 meV Im[Sigma]= 147.989463 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.980878 meV Im[Sigma]= 242.987540 meV Z= 1.019648 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297720 meV Im[Sigma]= 350.700211 meV Z= 1.103680 lam= -0.093940 E( 4 )= -0.6189 eV Re[Sigma]= 224.007522 meV Im[Sigma]= 185.540528 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 33 coord.: 0.0000000 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.072546 meV Im[Sigma]= 268.834741 meV Z= 1.066518 lam= -0.062369 E( 2 )= -7.5294 eV Re[Sigma]= -12.457267 meV Im[Sigma]= 206.043278 meV Z= 1.049753 lam= -0.047395 E( 3 )= -3.4617 eV Re[Sigma]= 23.570337 meV Im[Sigma]= 242.559711 meV Z= 1.036928 lam= -0.035613 E( 4 )= -1.4850 eV Re[Sigma]= 166.753315 meV Im[Sigma]= 318.685782 meV Z= 1.089098 lam= -0.081809 ------------------------------------------------------------------- ik = 34 coord.: 0.0000000 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.428314 meV Im[Sigma]= 299.487838 meV Z= 1.079307 lam= -0.073480 E( 2 )= -8.4181 eV Re[Sigma]= -25.264037 meV Im[Sigma]= 148.074240 meV Z= 1.003431 lam= -0.003420 E( 3 )= -2.9817 eV Re[Sigma]= 42.139782 meV Im[Sigma]= 293.347649 meV Z= 1.061022 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.512857 meV Im[Sigma]= 333.290017 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 35 coord.: 0.0000000 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759753 meV Im[Sigma]= 178.948962 meV Z= 1.026312 lam= -0.025637 E( 2 )= -5.0893 eV Re[Sigma]= -20.996948 meV Im[Sigma]= 196.990640 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.357982 meV Im[Sigma]= 356.038726 meV Z= 1.114003 lam= -0.102336 E( 4 )= -1.7453 eV Re[Sigma]= 148.676684 meV Im[Sigma]= 348.113822 meV Z= 1.109262 lam= -0.098500 ------------------------------------------------------------------- ik = 36 coord.: 0.0000000 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339167 meV Im[Sigma]= 97.847196 meV Z= 0.995804 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.771011 meV Im[Sigma]= 380.347051 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.669290 meV Im[Sigma]= 289.608930 meV Z= 1.063298 lam= -0.059530 E( 4 )= -1.1893 eV Re[Sigma]= 203.581615 meV Im[Sigma]= 288.349863 meV Z= 1.062975 lam= -0.059244 ------------------------------------------------------------------- ik = 37 coord.: 0.1666667 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995412 meV Im[Sigma]= 87.929011 meV Z= 0.995273 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.013420 meV Im[Sigma]= 392.552905 meV Z= 1.122730 lam= -0.109314 E( 3 )= -0.6014 eV Re[Sigma]= 229.827221 meV Im[Sigma]= 182.393763 meV Z= 1.014631 lam= -0.014420 E( 4 )= -0.6014 eV Re[Sigma]= 229.201936 meV Im[Sigma]= 179.619059 meV Z= 1.013410 lam= -0.013233 ------------------------------------------------------------------- ik = 38 coord.: 0.1666667 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339169 meV Im[Sigma]= 97.847196 meV Z= 0.995804 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.770997 meV Im[Sigma]= 380.347019 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.647545 meV Im[Sigma]= 289.296582 meV Z= 1.063218 lam= -0.059459 E( 4 )= -1.1893 eV Re[Sigma]= 203.603378 meV Im[Sigma]= 288.662239 meV Z= 1.063055 lam= -0.059315 ------------------------------------------------------------------- ik = 39 coord.: 0.1666667 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040708 meV Im[Sigma]= 177.315636 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021429 meV Im[Sigma]= 199.331120 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056296 meV Im[Sigma]= 357.687146 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804949 meV Im[Sigma]= 350.591841 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 40 coord.: 0.1666667 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286701 meV Im[Sigma]= 298.340954 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520381 meV Im[Sigma]= 148.145792 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213100 meV Im[Sigma]= 291.978355 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524195 meV Im[Sigma]= 336.559943 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 41 coord.: 0.1666667 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482313 meV Im[Sigma]= 272.239664 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662986 meV Im[Sigma]= 204.784512 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230543 meV Im[Sigma]= 244.747276 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813468 meV Im[Sigma]= 320.510189 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 42 coord.: 0.1666667 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811980 meV Im[Sigma]= 150.896673 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445624 meV Im[Sigma]= 243.591016 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587919 meV Im[Sigma]= 352.916587 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316926 meV Im[Sigma]= 182.010554 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 43 coord.: 0.1666667 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339344 meV Im[Sigma]= 97.846698 meV Z= 0.995803 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.771638 meV Im[Sigma]= 380.346892 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.689117 meV Im[Sigma]= 289.892204 meV Z= 1.063370 lam= -0.059593 E( 4 )= -1.1893 eV Re[Sigma]= 203.562553 meV Im[Sigma]= 288.068847 meV Z= 1.062905 lam= -0.059182 ------------------------------------------------------------------- ik = 44 coord.: 0.1666667 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995554 meV Im[Sigma]= 87.928459 meV Z= 0.995272 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.014567 meV Im[Sigma]= 392.541821 meV Z= 1.122724 lam= -0.109309 E( 3 )= -0.6014 eV Re[Sigma]= 229.682626 meV Im[Sigma]= 181.750347 meV Z= 1.014347 lam= -0.014144 E( 4 )= -0.6014 eV Re[Sigma]= 229.349494 meV Im[Sigma]= 180.271753 meV Z= 1.013697 lam= -0.013512 ------------------------------------------------------------------- ik = 45 coord.: 0.1666667 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811980 meV Im[Sigma]= 150.896673 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445624 meV Im[Sigma]= 243.591005 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587931 meV Im[Sigma]= 352.916602 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316921 meV Im[Sigma]= 182.010554 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 46 coord.: 0.1666667 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479849 meV Im[Sigma]= 272.241515 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664430 meV Im[Sigma]= 204.787290 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230268 meV Im[Sigma]= 244.746515 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813952 meV Im[Sigma]= 320.509815 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 47 coord.: 0.1666667 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289127 meV Im[Sigma]= 298.338318 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519863 meV Im[Sigma]= 148.146419 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210361 meV Im[Sigma]= 291.976651 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522115 meV Im[Sigma]= 336.562947 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 48 coord.: 0.1666667 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041155 meV Im[Sigma]= 177.314874 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021960 meV Im[Sigma]= 199.329977 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053490 meV Im[Sigma]= 357.696705 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804027 meV Im[Sigma]= 350.595423 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 49 coord.: 0.1666667 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047924 meV Im[Sigma]= 175.367708 meV Z= 1.024656 lam= -0.024063 E( 2 )= -5.0893 eV Re[Sigma]= -22.701349 meV Im[Sigma]= 195.270229 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.868901 meV Im[Sigma]= 360.047258 meV Z= 1.116202 lam= -0.104105 E( 4 )= -1.7453 eV Re[Sigma]= 147.323268 meV Im[Sigma]= 350.521917 meV Z= 1.110208 lam= -0.099268 ------------------------------------------------------------------- ik = 50 coord.: 0.1666667 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.952275 meV Im[Sigma]= 147.989177 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.982520 meV Im[Sigma]= 242.987363 meV Z= 1.019647 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297438 meV Im[Sigma]= 350.703062 meV Z= 1.103681 lam= -0.093941 E( 4 )= -0.6189 eV Re[Sigma]= 224.007581 meV Im[Sigma]= 185.540010 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 51 coord.: 0.1666667 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041149 meV Im[Sigma]= 177.314868 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021961 meV Im[Sigma]= 199.329969 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053475 meV Im[Sigma]= 357.696655 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804036 meV Im[Sigma]= 350.595435 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 52 coord.: 0.1666667 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935866 meV Im[Sigma]= 290.139390 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086581 meV Im[Sigma]= 150.056162 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823020 meV Im[Sigma]= 188.968555 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419608 meV Im[Sigma]= 335.162870 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 53 coord.: 0.1666667 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875238 meV Im[Sigma]= 234.984814 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902764 meV Im[Sigma]= 203.482068 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650283 meV Im[Sigma]= 171.160937 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009720 meV Im[Sigma]= 255.810343 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 54 coord.: 0.1666667 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294717 meV Im[Sigma]= 285.688368 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061624 meV Im[Sigma]= 148.203664 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428585 meV Im[Sigma]= 187.981157 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932359 meV Im[Sigma]= 337.074253 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 55 coord.: 0.1666667 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.929840 meV Im[Sigma]= 289.845702 meV Z= 1.074754 lam= -0.069554 E( 2 )= -8.4181 eV Re[Sigma]= -24.131981 meV Im[Sigma]= 141.910657 meV Z= 1.001587 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.421996 meV Im[Sigma]= 292.832608 meV Z= 1.060071 lam= -0.056667 E( 4 )= -2.2693 eV Re[Sigma]= 91.267770 meV Im[Sigma]= 336.778483 meV Z= 1.099797 lam= -0.090742 ------------------------------------------------------------------- ik = 56 coord.: 0.1666667 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.877595 meV Im[Sigma]= 263.994916 meV Z= 1.064099 lam= -0.060238 E( 2 )= -7.5294 eV Re[Sigma]= -10.789338 meV Im[Sigma]= 199.125060 meV Z= 1.047637 lam= -0.045471 E( 3 )= -3.4617 eV Re[Sigma]= 25.269186 meV Im[Sigma]= 246.342584 meV Z= 1.037337 lam= -0.035994 E( 4 )= -1.4850 eV Re[Sigma]= 167.275074 meV Im[Sigma]= 322.677886 meV Z= 1.090636 lam= -0.083104 ------------------------------------------------------------------- ik = 57 coord.: 0.1666667 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294696 meV Im[Sigma]= 285.688363 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061615 meV Im[Sigma]= 148.203659 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428579 meV Im[Sigma]= 187.981160 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932361 meV Im[Sigma]= 337.074265 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 58 coord.: 0.1666667 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251774 meV Im[Sigma]= 270.915182 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054345 meV Im[Sigma]= 193.371031 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373776 meV Im[Sigma]= 179.515782 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492299 meV Im[Sigma]= 222.499548 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 59 coord.: 0.1666667 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212619 meV Im[Sigma]= 154.377805 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061039 meV Im[Sigma]= 191.379003 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490738 meV Im[Sigma]= 147.532911 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360870 meV Im[Sigma]= 176.003068 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 60 coord.: 0.1666667 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518914 meV Im[Sigma]= 230.831334 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312917 meV Im[Sigma]= 196.831230 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480115 meV Im[Sigma]= 169.159161 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907379 meV Im[Sigma]= 257.594012 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 61 coord.: 0.1666667 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.879854 meV Im[Sigma]= 263.993021 meV Z= 1.064098 lam= -0.060237 E( 2 )= -7.5294 eV Re[Sigma]= -10.788174 meV Im[Sigma]= 199.121587 meV Z= 1.047636 lam= -0.045470 E( 3 )= -3.4617 eV Re[Sigma]= 25.268820 meV Im[Sigma]= 246.341100 meV Z= 1.037336 lam= -0.035992 E( 4 )= -1.4850 eV Re[Sigma]= 167.274317 meV Im[Sigma]= 322.679574 meV Z= 1.090637 lam= -0.083105 ------------------------------------------------------------------- ik = 62 coord.: 0.1666667 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.932512 meV Im[Sigma]= 289.844009 meV Z= 1.074752 lam= -0.069553 E( 2 )= -8.4181 eV Re[Sigma]= -24.130869 meV Im[Sigma]= 141.909762 meV Z= 1.001588 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.419513 meV Im[Sigma]= 292.832518 meV Z= 1.060072 lam= -0.056668 E( 4 )= -2.2693 eV Re[Sigma]= 91.265978 meV Im[Sigma]= 336.780415 meV Z= 1.099799 lam= -0.090743 ------------------------------------------------------------------- ik = 63 coord.: 0.1666667 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518902 meV Im[Sigma]= 230.831330 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312914 meV Im[Sigma]= 196.831227 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480119 meV Im[Sigma]= 169.159158 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907395 meV Im[Sigma]= 257.594043 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 64 coord.: 0.1666667 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212871 meV Im[Sigma]= 154.378035 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.060776 meV Im[Sigma]= 191.380416 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491077 meV Im[Sigma]= 147.532145 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360896 meV Im[Sigma]= 176.001316 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 65 coord.: 0.1666667 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251132 meV Im[Sigma]= 270.916722 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055703 meV Im[Sigma]= 193.370796 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374281 meV Im[Sigma]= 179.517878 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493697 meV Im[Sigma]= 222.501500 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 66 coord.: 0.1666667 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295163 meV Im[Sigma]= 285.688705 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061776 meV Im[Sigma]= 148.204283 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429119 meV Im[Sigma]= 187.980679 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933390 meV Im[Sigma]= 337.075481 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 67 coord.: 0.1666667 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.951834 meV Im[Sigma]= 147.989465 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.980883 meV Im[Sigma]= 242.987539 meV Z= 1.019648 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297724 meV Im[Sigma]= 350.700210 meV Z= 1.103680 lam= -0.093940 E( 4 )= -0.6189 eV Re[Sigma]= 224.007519 meV Im[Sigma]= 185.540526 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 68 coord.: 0.1666667 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047979 meV Im[Sigma]= 175.366411 meV Z= 1.024655 lam= -0.024062 E( 2 )= -5.0893 eV Re[Sigma]= -22.700370 meV Im[Sigma]= 195.269992 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.865527 meV Im[Sigma]= 360.052949 meV Z= 1.116205 lam= -0.104107 E( 4 )= -1.7453 eV Re[Sigma]= 147.322874 meV Im[Sigma]= 350.524842 meV Z= 1.110210 lam= -0.099270 ------------------------------------------------------------------- ik = 69 coord.: 0.1666667 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295165 meV Im[Sigma]= 285.688702 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061769 meV Im[Sigma]= 148.204274 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429117 meV Im[Sigma]= 187.980690 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933408 meV Im[Sigma]= 337.075502 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 70 coord.: 0.1666667 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874889 meV Im[Sigma]= 234.985939 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902660 meV Im[Sigma]= 203.481547 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650424 meV Im[Sigma]= 171.161983 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011119 meV Im[Sigma]= 255.811706 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 71 coord.: 0.1666667 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936150 meV Im[Sigma]= 290.139549 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086581 meV Im[Sigma]= 150.056495 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823025 meV Im[Sigma]= 188.967400 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420469 meV Im[Sigma]= 335.161423 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 72 coord.: 0.1666667 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040708 meV Im[Sigma]= 177.315635 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021434 meV Im[Sigma]= 199.331127 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056292 meV Im[Sigma]= 357.687152 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804935 meV Im[Sigma]= 350.591815 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 73 coord.: 0.3333333 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.664179 meV Im[Sigma]= 180.568491 meV Z= 1.019693 lam= -0.019313 E( 2 )= -6.6106 eV Re[Sigma]= -2.724637 meV Im[Sigma]= 146.307365 meV Z= 0.994023 lam= 0.006013 E( 3 )= -1.2665 eV Re[Sigma]= 189.574524 meV Im[Sigma]= 295.913213 meV Z= 1.070349 lam= -0.065725 E( 4 )= -1.2665 eV Re[Sigma]= 189.062026 meV Im[Sigma]= 290.565386 meV Z= 1.068087 lam= -0.063746 ------------------------------------------------------------------- ik = 74 coord.: 0.3333333 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040712 meV Im[Sigma]= 177.315638 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021436 meV Im[Sigma]= 199.331126 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056293 meV Im[Sigma]= 357.687149 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804946 meV Im[Sigma]= 350.591832 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 75 coord.: 0.3333333 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021725 meV Im[Sigma]= 231.203600 meV Z= 1.023297 lam= -0.022766 E( 2 )= -5.4186 eV Re[Sigma]= -25.458761 meV Im[Sigma]= 176.201810 meV Z= 1.011246 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 38.271695 meV Im[Sigma]= 275.766775 meV Z= 1.056232 lam= -0.053239 E( 4 )= -3.0665 eV Re[Sigma]= 37.443606 meV Im[Sigma]= 275.556142 meV Z= 1.056141 lam= -0.053157 ------------------------------------------------------------------- ik = 76 coord.: 0.3333333 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251125 meV Im[Sigma]= 270.916717 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055692 meV Im[Sigma]= 193.370788 meV Z= 1.037394 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374288 meV Im[Sigma]= 179.517895 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493704 meV Im[Sigma]= 222.501489 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 77 coord.: 0.3333333 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420262 meV Im[Sigma]= 247.232263 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822633 meV Im[Sigma]= 219.393954 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653234 meV Im[Sigma]= 126.505312 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924469 meV Im[Sigma]= 315.264305 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 78 coord.: 0.3333333 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479838 meV Im[Sigma]= 272.241513 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664432 meV Im[Sigma]= 204.787292 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230264 meV Im[Sigma]= 244.746508 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813946 meV Im[Sigma]= 320.509788 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 79 coord.: 0.3333333 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759105 meV Im[Sigma]= 178.950792 meV Z= 1.026313 lam= -0.025638 E( 2 )= -5.0893 eV Re[Sigma]= -20.997045 meV Im[Sigma]= 196.991477 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.359946 meV Im[Sigma]= 356.031891 meV Z= 1.113999 lam= -0.102333 E( 4 )= -1.7453 eV Re[Sigma]= 148.676434 meV Im[Sigma]= 348.112916 meV Z= 1.109261 lam= -0.098499 ------------------------------------------------------------------- ik = 80 coord.: 0.3333333 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811989 meV Im[Sigma]= 150.896674 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445630 meV Im[Sigma]= 243.591004 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587926 meV Im[Sigma]= 352.916637 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316924 meV Im[Sigma]= 182.010555 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 81 coord.: 0.3333333 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759751 meV Im[Sigma]= 178.948962 meV Z= 1.026312 lam= -0.025637 E( 2 )= -5.0893 eV Re[Sigma]= -20.996954 meV Im[Sigma]= 196.990645 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.357980 meV Im[Sigma]= 356.038721 meV Z= 1.114003 lam= -0.102336 E( 4 )= -1.7453 eV Re[Sigma]= 148.676677 meV Im[Sigma]= 348.113817 meV Z= 1.109262 lam= -0.098500 ------------------------------------------------------------------- ik = 82 coord.: 0.3333333 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936151 meV Im[Sigma]= 290.139548 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086571 meV Im[Sigma]= 150.056493 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823021 meV Im[Sigma]= 188.967411 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420476 meV Im[Sigma]= 335.161434 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 83 coord.: 0.3333333 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052654 meV Im[Sigma]= 237.818223 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387167 meV Im[Sigma]= 205.091121 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395927 meV Im[Sigma]= 170.067053 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299969 meV Im[Sigma]= 255.318654 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 84 coord.: 0.3333333 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935861 meV Im[Sigma]= 290.139389 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086580 meV Im[Sigma]= 150.056173 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823035 meV Im[Sigma]= 188.968553 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419608 meV Im[Sigma]= 335.162854 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 85 coord.: 0.3333333 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021156 meV Im[Sigma]= 231.204223 meV Z= 1.023297 lam= -0.022767 E( 2 )= -5.4186 eV Re[Sigma]= -25.458566 meV Im[Sigma]= 176.201139 meV Z= 1.011245 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 38.493130 meV Im[Sigma]= 275.824241 meV Z= 1.056258 lam= -0.053262 E( 4 )= -3.0665 eV Re[Sigma]= 37.222034 meV Im[Sigma]= 275.501587 meV Z= 1.056117 lam= -0.053135 ------------------------------------------------------------------- ik = 86 coord.: 0.3333333 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041153 meV Im[Sigma]= 177.314870 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021965 meV Im[Sigma]= 199.329970 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053487 meV Im[Sigma]= 357.696714 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804046 meV Im[Sigma]= 350.595450 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 87 coord.: 0.3333333 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.665604 meV Im[Sigma]= 180.564025 meV Z= 1.019691 lam= -0.019310 E( 2 )= -6.6106 eV Re[Sigma]= -2.723598 meV Im[Sigma]= 146.303265 meV Z= 0.994022 lam= 0.006014 E( 3 )= -1.2665 eV Re[Sigma]= 189.262910 meV Im[Sigma]= 292.674732 meV Z= 1.068978 lam= -0.064527 E( 4 )= -1.2665 eV Re[Sigma]= 189.372079 meV Im[Sigma]= 293.815036 meV Z= 1.069460 lam= -0.064949 ------------------------------------------------------------------- ik = 88 coord.: 0.3333333 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482314 meV Im[Sigma]= 272.239665 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662986 meV Im[Sigma]= 204.784502 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230543 meV Im[Sigma]= 244.747277 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813479 meV Im[Sigma]= 320.510213 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 89 coord.: 0.3333333 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420283 meV Im[Sigma]= 247.232267 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822627 meV Im[Sigma]= 219.393944 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653226 meV Im[Sigma]= 126.505306 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924474 meV Im[Sigma]= 315.264350 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 90 coord.: 0.3333333 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251786 meV Im[Sigma]= 270.915187 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054342 meV Im[Sigma]= 193.371036 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373778 meV Im[Sigma]= 179.515763 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492318 meV Im[Sigma]= 222.499574 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 91 coord.: 0.3333333 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899240 meV Im[Sigma]= 267.550204 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457429 meV Im[Sigma]= 188.748672 meV Z= 1.036062 lam= -0.034807 E( 3 )= -4.6413 eV Re[Sigma]= 16.532393 meV Im[Sigma]= 177.586891 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.736209 meV Im[Sigma]= 225.008060 meV Z= 1.032040 lam= -0.031045 ------------------------------------------------------------------- ik = 92 coord.: 0.3333333 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294708 meV Im[Sigma]= 285.688363 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061620 meV Im[Sigma]= 148.203663 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428592 meV Im[Sigma]= 187.981159 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932355 meV Im[Sigma]= 337.074287 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 93 coord.: 0.3333333 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.073774 meV Im[Sigma]= 268.832738 meV Z= 1.066517 lam= -0.062368 E( 2 )= -7.5294 eV Re[Sigma]= -12.455899 meV Im[Sigma]= 206.039028 meV Z= 1.049752 lam= -0.047394 E( 3 )= -3.4617 eV Re[Sigma]= 23.568173 meV Im[Sigma]= 242.558725 meV Z= 1.036926 lam= -0.035611 E( 4 )= -1.4850 eV Re[Sigma]= 166.751688 meV Im[Sigma]= 318.688645 meV Z= 1.089101 lam= -0.081811 ------------------------------------------------------------------- ik = 94 coord.: 0.3333333 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289114 meV Im[Sigma]= 298.338315 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519868 meV Im[Sigma]= 148.146413 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210358 meV Im[Sigma]= 291.976660 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522111 meV Im[Sigma]= 336.562941 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 95 coord.: 0.3333333 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052667 meV Im[Sigma]= 237.818230 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387162 meV Im[Sigma]= 205.091106 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395928 meV Im[Sigma]= 170.067042 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299959 meV Im[Sigma]= 255.318677 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 96 coord.: 0.3333333 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212895 meV Im[Sigma]= 154.378036 meV Z= 0.986410 lam= 0.013778 E( 2 )= -7.6803 eV Re[Sigma]= -41.060764 meV Im[Sigma]= 191.380416 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491077 meV Im[Sigma]= 147.532144 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360890 meV Im[Sigma]= 176.001315 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 97 coord.: 0.3333333 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047233 meV Im[Sigma]= 240.239644 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976662 meV Im[Sigma]= 215.030965 meV Z= 1.052401 lam= -0.049792 E( 3 )= -6.1421 eV Re[Sigma]= 34.445044 meV Im[Sigma]= 126.239208 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260731 meV Im[Sigma]= 314.820687 meV Z= 1.073811 lam= -0.068738 ------------------------------------------------------------------- ik = 98 coord.: 0.3333333 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518904 meV Im[Sigma]= 230.831332 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312916 meV Im[Sigma]= 196.831226 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480109 meV Im[Sigma]= 169.159146 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907373 meV Im[Sigma]= 257.594052 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 99 coord.: 0.3333333 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047624 meV Im[Sigma]= 240.238450 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976220 meV Im[Sigma]= 215.028854 meV Z= 1.052400 lam= -0.049791 E( 3 )= -6.1421 eV Re[Sigma]= 34.445096 meV Im[Sigma]= 126.239158 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260217 meV Im[Sigma]= 314.819615 meV Z= 1.073811 lam= -0.068737 ------------------------------------------------------------------- ik = 100 coord.: 0.3333333 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875227 meV Im[Sigma]= 234.984812 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902767 meV Im[Sigma]= 203.482064 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650280 meV Im[Sigma]= 171.160954 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009718 meV Im[Sigma]= 255.810331 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 101 coord.: 0.3333333 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420286 meV Im[Sigma]= 247.232270 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822626 meV Im[Sigma]= 219.393938 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653237 meV Im[Sigma]= 126.505312 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924468 meV Im[Sigma]= 315.264338 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 102 coord.: 0.3333333 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874900 meV Im[Sigma]= 234.985935 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902660 meV Im[Sigma]= 203.481547 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650420 meV Im[Sigma]= 171.161988 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011116 meV Im[Sigma]= 255.811719 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 103 coord.: 0.3333333 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.072535 meV Im[Sigma]= 268.834734 meV Z= 1.066518 lam= -0.062369 E( 2 )= -7.5294 eV Re[Sigma]= -12.457269 meV Im[Sigma]= 206.043273 meV Z= 1.049753 lam= -0.047395 E( 3 )= -3.4617 eV Re[Sigma]= 23.570337 meV Im[Sigma]= 242.559716 meV Z= 1.036928 lam= -0.035613 E( 4 )= -1.4850 eV Re[Sigma]= 166.753311 meV Im[Sigma]= 318.685772 meV Z= 1.089098 lam= -0.081809 ------------------------------------------------------------------- ik = 104 coord.: 0.3333333 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295159 meV Im[Sigma]= 285.688706 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061772 meV Im[Sigma]= 148.204282 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429125 meV Im[Sigma]= 187.980671 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933396 meV Im[Sigma]= 337.075500 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 105 coord.: 0.3333333 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899934 meV Im[Sigma]= 267.550351 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457295 meV Im[Sigma]= 188.746838 meV Z= 1.036061 lam= -0.034806 E( 3 )= -4.6413 eV Re[Sigma]= 16.531799 meV Im[Sigma]= 177.586245 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.734124 meV Im[Sigma]= 225.005331 meV Z= 1.032038 lam= -0.031043 ------------------------------------------------------------------- ik = 106 coord.: 0.3333333 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212614 meV Im[Sigma]= 154.377803 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061034 meV Im[Sigma]= 191.378999 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490742 meV Im[Sigma]= 147.532907 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360882 meV Im[Sigma]= 176.003067 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 107 coord.: 0.3333333 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052656 meV Im[Sigma]= 237.818224 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387169 meV Im[Sigma]= 205.091119 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395919 meV Im[Sigma]= 170.067034 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299954 meV Im[Sigma]= 255.318650 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 108 coord.: 0.3333333 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286696 meV Im[Sigma]= 298.340944 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520387 meV Im[Sigma]= 148.145791 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213100 meV Im[Sigma]= 291.978338 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524195 meV Im[Sigma]= 336.559962 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 109 coord.: 0.5000000 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.4659 eV Re[Sigma]= -158.589510 meV Im[Sigma]= 282.995108 meV Z= 1.080696 lam= -0.074671 E( 2 )= -9.2155 eV Re[Sigma]= 6.729108 meV Im[Sigma]= 63.706796 meV Z= 0.951883 lam= 0.050549 E( 3 )= -1.7294 eV Re[Sigma]= 141.641288 meV Im[Sigma]= 333.764701 meV Z= 1.104747 lam= -0.094815 E( 4 )= -1.7294 eV Re[Sigma]= 140.617302 meV Im[Sigma]= 330.649752 meV Z= 1.103028 lam= -0.093405 ------------------------------------------------------------------- ik = 110 coord.: 0.5000000 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286704 meV Im[Sigma]= 298.340946 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520379 meV Im[Sigma]= 148.145790 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213107 meV Im[Sigma]= 291.978346 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524191 meV Im[Sigma]= 336.559942 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 111 coord.: 0.5000000 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251130 meV Im[Sigma]= 270.916719 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055694 meV Im[Sigma]= 193.370795 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374272 meV Im[Sigma]= 179.517882 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493706 meV Im[Sigma]= 222.501484 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 112 coord.: 0.5000000 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.1466 eV Re[Sigma]= -66.998858 meV Im[Sigma]= 238.934404 meV Z= 1.048294 lam= -0.046069 E( 2 )= -7.9488 eV Re[Sigma]= -29.285916 meV Im[Sigma]= 175.808008 meV Z= 1.030885 lam= -0.029960 E( 3 )= -4.1536 eV Re[Sigma]= 23.584996 meV Im[Sigma]= 176.426263 meV Z= 1.009962 lam= -0.009864 E( 4 )= -4.1536 eV Re[Sigma]= 20.652647 meV Im[Sigma]= 172.433047 meV Z= 1.009636 lam= -0.009544 ------------------------------------------------------------------- ik = 113 coord.: 0.5000000 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251775 meV Im[Sigma]= 270.915182 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054334 meV Im[Sigma]= 193.371023 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373787 meV Im[Sigma]= 179.515766 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492307 meV Im[Sigma]= 222.499533 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 114 coord.: 0.5000000 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289119 meV Im[Sigma]= 298.338308 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519862 meV Im[Sigma]= 148.146411 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210359 meV Im[Sigma]= 291.976645 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522108 meV Im[Sigma]= 336.562915 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 115 coord.: 0.5000000 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.424978 meV Im[Sigma]= 299.488493 meV Z= 1.079309 lam= -0.073481 E( 2 )= -8.4181 eV Re[Sigma]= -25.264850 meV Im[Sigma]= 148.073941 meV Z= 1.003430 lam= -0.003419 E( 3 )= -2.9817 eV Re[Sigma]= 42.139204 meV Im[Sigma]= 293.348052 meV Z= 1.061021 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.513268 meV Im[Sigma]= 333.288681 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 116 coord.: 0.5000000 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479863 meV Im[Sigma]= 272.241520 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664429 meV Im[Sigma]= 204.787287 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230269 meV Im[Sigma]= 244.746511 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813952 meV Im[Sigma]= 320.509804 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 117 coord.: 0.5000000 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936161 meV Im[Sigma]= 290.139550 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086579 meV Im[Sigma]= 150.056489 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823023 meV Im[Sigma]= 188.967406 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420473 meV Im[Sigma]= 335.161432 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 118 coord.: 0.5000000 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.800373 meV Im[Sigma]= 271.299868 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.848494 meV Im[Sigma]= 192.531534 meV Z= 1.037386 lam= -0.036039 E( 3 )= -4.6413 eV Re[Sigma]= 14.838425 meV Im[Sigma]= 178.848586 meV Z= 1.019821 lam= -0.019436 E( 4 )= -3.4814 eV Re[Sigma]= 26.577217 meV Im[Sigma]= 225.180046 meV Z= 1.033326 lam= -0.032252 ------------------------------------------------------------------- ik = 119 coord.: 0.5000000 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212873 meV Im[Sigma]= 154.378032 meV Z= 0.986410 lam= 0.013778 E( 2 )= -7.6803 eV Re[Sigma]= -41.060767 meV Im[Sigma]= 191.380411 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491081 meV Im[Sigma]= 147.532148 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360899 meV Im[Sigma]= 176.001317 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 120 coord.: 0.5000000 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875223 meV Im[Sigma]= 234.984807 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902765 meV Im[Sigma]= 203.482065 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650278 meV Im[Sigma]= 171.160946 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009723 meV Im[Sigma]= 255.810318 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 121 coord.: 0.5000000 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.799123 meV Im[Sigma]= 271.299054 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.849567 meV Im[Sigma]= 192.530091 meV Z= 1.037385 lam= -0.036038 E( 3 )= -4.6413 eV Re[Sigma]= 14.838580 meV Im[Sigma]= 178.853047 meV Z= 1.019823 lam= -0.019438 E( 4 )= -3.4814 eV Re[Sigma]= 26.578565 meV Im[Sigma]= 225.184096 meV Z= 1.033329 lam= -0.032254 ------------------------------------------------------------------- ik = 122 coord.: 0.5000000 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935879 meV Im[Sigma]= 290.139394 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086581 meV Im[Sigma]= 150.056167 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823028 meV Im[Sigma]= 188.968554 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419613 meV Im[Sigma]= 335.162869 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 123 coord.: 0.5000000 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482321 meV Im[Sigma]= 272.239670 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662988 meV Im[Sigma]= 204.784501 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230543 meV Im[Sigma]= 244.747266 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813480 meV Im[Sigma]= 320.510212 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 124 coord.: 0.5000000 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.428308 meV Im[Sigma]= 299.487836 meV Z= 1.079307 lam= -0.073480 E( 2 )= -8.4181 eV Re[Sigma]= -25.264034 meV Im[Sigma]= 148.074242 meV Z= 1.003431 lam= -0.003420 E( 3 )= -2.9817 eV Re[Sigma]= 42.139782 meV Im[Sigma]= 293.347658 meV Z= 1.061022 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.512854 meV Im[Sigma]= 333.290006 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 125 coord.: 0.5000000 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874906 meV Im[Sigma]= 234.985934 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902659 meV Im[Sigma]= 203.481551 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650419 meV Im[Sigma]= 171.161983 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011124 meV Im[Sigma]= 255.811720 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 126 coord.: 0.5000000 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212626 meV Im[Sigma]= 154.377801 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061034 meV Im[Sigma]= 191.378998 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490751 meV Im[Sigma]= 147.532908 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360876 meV Im[Sigma]= 176.003077 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 127 coord.: 0.5000000 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.1466 eV Re[Sigma]= -66.998869 meV Im[Sigma]= 238.934405 meV Z= 1.048294 lam= -0.046069 E( 2 )= -7.9488 eV Re[Sigma]= -29.285917 meV Im[Sigma]= 175.808008 meV Z= 1.030885 lam= -0.029960 E( 3 )= -4.1536 eV Re[Sigma]= 20.628273 meV Im[Sigma]= 172.399862 meV Z= 1.009633 lam= -0.009541 E( 4 )= -4.1536 eV Re[Sigma]= 23.609380 meV Im[Sigma]= 176.459470 meV Z= 1.009965 lam= -0.009866 ------------------------------------------------------------------- ik = 128 coord.: 0.5000000 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251784 meV Im[Sigma]= 270.915183 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054340 meV Im[Sigma]= 193.371034 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373785 meV Im[Sigma]= 179.515772 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492309 meV Im[Sigma]= 222.499570 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 129 coord.: 0.5000000 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289116 meV Im[Sigma]= 298.338313 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519862 meV Im[Sigma]= 148.146410 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210367 meV Im[Sigma]= 291.976673 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522109 meV Im[Sigma]= 336.562943 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 130 coord.: 0.5000000 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.4659 eV Re[Sigma]= -158.589503 meV Im[Sigma]= 282.995114 meV Z= 1.080696 lam= -0.074671 E( 2 )= -9.2155 eV Re[Sigma]= 6.729116 meV Im[Sigma]= 63.706795 meV Z= 0.951883 lam= 0.050549 E( 3 )= -1.7294 eV Re[Sigma]= 141.959997 meV Im[Sigma]= 334.734197 meV Z= 1.105283 lam= -0.095254 E( 4 )= -1.7294 eV Re[Sigma]= 140.298600 meV Im[Sigma]= 329.680268 meV Z= 1.102494 lam= -0.092966 ------------------------------------------------------------------- ik = 131 coord.: 0.5000000 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286710 meV Im[Sigma]= 298.340951 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520374 meV Im[Sigma]= 148.145780 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213104 meV Im[Sigma]= 291.978345 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524201 meV Im[Sigma]= 336.559968 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 132 coord.: 0.5000000 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251146 meV Im[Sigma]= 270.916722 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055687 meV Im[Sigma]= 193.370785 meV Z= 1.037394 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374270 meV Im[Sigma]= 179.517890 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493705 meV Im[Sigma]= 222.501507 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 133 coord.: 0.5000000 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.800383 meV Im[Sigma]= 271.299877 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.848490 meV Im[Sigma]= 192.531520 meV Z= 1.037386 lam= -0.036039 E( 3 )= -4.6413 eV Re[Sigma]= 14.838419 meV Im[Sigma]= 178.848590 meV Z= 1.019821 lam= -0.019436 E( 4 )= -3.4814 eV Re[Sigma]= 26.577219 meV Im[Sigma]= 225.180051 meV Z= 1.033326 lam= -0.032252 ------------------------------------------------------------------- ik = 134 coord.: 0.5000000 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212871 meV Im[Sigma]= 154.378035 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.060767 meV Im[Sigma]= 191.380413 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491082 meV Im[Sigma]= 147.532140 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360891 meV Im[Sigma]= 176.001318 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 135 coord.: 0.5000000 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875237 meV Im[Sigma]= 234.984812 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902760 meV Im[Sigma]= 203.482056 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650283 meV Im[Sigma]= 171.160961 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009709 meV Im[Sigma]= 255.810335 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 136 coord.: 0.5000000 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.424978 meV Im[Sigma]= 299.488492 meV Z= 1.079309 lam= -0.073481 E( 2 )= -8.4181 eV Re[Sigma]= -25.264850 meV Im[Sigma]= 148.073941 meV Z= 1.003430 lam= -0.003419 E( 3 )= -2.9817 eV Re[Sigma]= 42.139210 meV Im[Sigma]= 293.348081 meV Z= 1.061021 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.513264 meV Im[Sigma]= 333.288681 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 137 coord.: 0.5000000 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479856 meV Im[Sigma]= 272.241523 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664422 meV Im[Sigma]= 204.787279 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230268 meV Im[Sigma]= 244.746514 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813953 meV Im[Sigma]= 320.509808 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 138 coord.: 0.5000000 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936169 meV Im[Sigma]= 290.139552 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086572 meV Im[Sigma]= 150.056489 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823019 meV Im[Sigma]= 188.967411 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420477 meV Im[Sigma]= 335.161443 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 139 coord.: 0.5000000 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.428315 meV Im[Sigma]= 299.487835 meV Z= 1.079307 lam= -0.073480 E( 2 )= -8.4181 eV Re[Sigma]= -25.264035 meV Im[Sigma]= 148.074240 meV Z= 1.003431 lam= -0.003420 E( 3 )= -2.9817 eV Re[Sigma]= 42.139784 meV Im[Sigma]= 293.347666 meV Z= 1.061022 lam= -0.057512 E( 4 )= -2.2693 eV Re[Sigma]= 91.512852 meV Im[Sigma]= 333.290001 meV Z= 1.098074 lam= -0.089315 ------------------------------------------------------------------- ik = 140 coord.: 0.5000000 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874889 meV Im[Sigma]= 234.985933 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902655 meV Im[Sigma]= 203.481549 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650416 meV Im[Sigma]= 171.161984 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011108 meV Im[Sigma]= 255.811707 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 141 coord.: 0.5000000 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212618 meV Im[Sigma]= 154.377806 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061036 meV Im[Sigma]= 191.379000 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490743 meV Im[Sigma]= 147.532898 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360864 meV Im[Sigma]= 176.003070 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 142 coord.: 0.5000000 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -92.799126 meV Im[Sigma]= 271.299050 meV Z= 1.051156 lam= -0.048666 E( 2 )= -7.3701 eV Re[Sigma]= -18.849563 meV Im[Sigma]= 192.530076 meV Z= 1.037385 lam= -0.036038 E( 3 )= -4.6413 eV Re[Sigma]= 14.838565 meV Im[Sigma]= 178.853029 meV Z= 1.019823 lam= -0.019438 E( 4 )= -3.4814 eV Re[Sigma]= 26.578565 meV Im[Sigma]= 225.184105 meV Z= 1.033329 lam= -0.032254 ------------------------------------------------------------------- ik = 143 coord.: 0.5000000 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935874 meV Im[Sigma]= 290.139397 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086573 meV Im[Sigma]= 150.056153 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823034 meV Im[Sigma]= 188.968546 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419606 meV Im[Sigma]= 335.162849 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 144 coord.: 0.5000000 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482328 meV Im[Sigma]= 272.239668 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662982 meV Im[Sigma]= 204.784495 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230545 meV Im[Sigma]= 244.747260 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813478 meV Im[Sigma]= 320.510206 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 145 coord.: 0.6666667 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.665609 meV Im[Sigma]= 180.564029 meV Z= 1.019691 lam= -0.019310 E( 2 )= -6.6106 eV Re[Sigma]= -2.723596 meV Im[Sigma]= 146.303267 meV Z= 0.994022 lam= 0.006014 E( 3 )= -1.2665 eV Re[Sigma]= 189.221162 meV Im[Sigma]= 292.238707 meV Z= 1.068793 lam= -0.064366 E( 4 )= -1.2665 eV Re[Sigma]= 189.413821 meV Im[Sigma]= 294.251040 meV Z= 1.069645 lam= -0.065110 ------------------------------------------------------------------- ik = 146 coord.: 0.6666667 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482328 meV Im[Sigma]= 272.239672 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662983 meV Im[Sigma]= 204.784504 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230544 meV Im[Sigma]= 244.747272 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813466 meV Im[Sigma]= 320.510176 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 147 coord.: 0.6666667 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420286 meV Im[Sigma]= 247.232266 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822631 meV Im[Sigma]= 219.393942 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653236 meV Im[Sigma]= 126.505310 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924469 meV Im[Sigma]= 315.264301 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 148 coord.: 0.6666667 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251780 meV Im[Sigma]= 270.915184 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054338 meV Im[Sigma]= 193.371028 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373776 meV Im[Sigma]= 179.515765 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492305 meV Im[Sigma]= 222.499532 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 149 coord.: 0.6666667 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021155 meV Im[Sigma]= 231.204220 meV Z= 1.023297 lam= -0.022767 E( 2 )= -5.4186 eV Re[Sigma]= -25.458555 meV Im[Sigma]= 176.201120 meV Z= 1.011245 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 36.999905 meV Im[Sigma]= 275.445105 meV Z= 1.056092 lam= -0.053113 E( 4 )= -3.0665 eV Re[Sigma]= 38.715251 meV Im[Sigma]= 275.880642 meV Z= 1.056283 lam= -0.053284 ------------------------------------------------------------------- ik = 150 coord.: 0.6666667 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041153 meV Im[Sigma]= 177.314868 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021961 meV Im[Sigma]= 199.329969 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053477 meV Im[Sigma]= 357.696651 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804036 meV Im[Sigma]= 350.595420 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 151 coord.: 0.6666667 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.073781 meV Im[Sigma]= 268.832738 meV Z= 1.066517 lam= -0.062368 E( 2 )= -7.5294 eV Re[Sigma]= -12.455902 meV Im[Sigma]= 206.039035 meV Z= 1.049752 lam= -0.047394 E( 3 )= -3.4617 eV Re[Sigma]= 23.568171 meV Im[Sigma]= 242.558699 meV Z= 1.036926 lam= -0.035611 E( 4 )= -1.4850 eV Re[Sigma]= 166.751688 meV Im[Sigma]= 318.688631 meV Z= 1.089101 lam= -0.081811 ------------------------------------------------------------------- ik = 152 coord.: 0.6666667 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289128 meV Im[Sigma]= 298.338323 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519864 meV Im[Sigma]= 148.146420 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210366 meV Im[Sigma]= 291.976648 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522108 meV Im[Sigma]= 336.562927 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 153 coord.: 0.6666667 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052669 meV Im[Sigma]= 237.818227 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387173 meV Im[Sigma]= 205.091125 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395919 meV Im[Sigma]= 170.067037 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299964 meV Im[Sigma]= 255.318643 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 154 coord.: 0.6666667 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212868 meV Im[Sigma]= 154.378034 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.060774 meV Im[Sigma]= 191.380423 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491080 meV Im[Sigma]= 147.532131 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360895 meV Im[Sigma]= 176.001307 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 155 coord.: 0.6666667 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899229 meV Im[Sigma]= 267.550199 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457423 meV Im[Sigma]= 188.748666 meV Z= 1.036062 lam= -0.034807 E( 3 )= -4.6413 eV Re[Sigma]= 16.532394 meV Im[Sigma]= 177.586863 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.736209 meV Im[Sigma]= 225.008046 meV Z= 1.032040 lam= -0.031045 ------------------------------------------------------------------- ik = 156 coord.: 0.6666667 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294704 meV Im[Sigma]= 285.688358 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061620 meV Im[Sigma]= 148.203659 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428591 meV Im[Sigma]= 187.981144 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932358 meV Im[Sigma]= 337.074243 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 157 coord.: 0.6666667 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047624 meV Im[Sigma]= 240.238454 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976218 meV Im[Sigma]= 215.028860 meV Z= 1.052400 lam= -0.049791 E( 3 )= -6.1421 eV Re[Sigma]= 34.445103 meV Im[Sigma]= 126.239165 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260211 meV Im[Sigma]= 314.819581 meV Z= 1.073811 lam= -0.068737 ------------------------------------------------------------------- ik = 158 coord.: 0.6666667 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875243 meV Im[Sigma]= 234.984818 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902770 meV Im[Sigma]= 203.482071 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650283 meV Im[Sigma]= 171.160942 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009718 meV Im[Sigma]= 255.810331 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 159 coord.: 0.6666667 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420296 meV Im[Sigma]= 247.232272 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822630 meV Im[Sigma]= 219.393947 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653236 meV Im[Sigma]= 126.505309 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924468 meV Im[Sigma]= 315.264323 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 160 coord.: 0.6666667 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874895 meV Im[Sigma]= 234.985940 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902653 meV Im[Sigma]= 203.481558 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650415 meV Im[Sigma]= 171.161973 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011117 meV Im[Sigma]= 255.811716 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 161 coord.: 0.6666667 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -83.047248 meV Im[Sigma]= 240.239650 meV Z= 1.046971 lam= -0.044864 E( 2 )= -7.4953 eV Re[Sigma]= -31.976655 meV Im[Sigma]= 215.030964 meV Z= 1.052401 lam= -0.049792 E( 3 )= -6.1421 eV Re[Sigma]= 34.445047 meV Im[Sigma]= 126.239206 meV Z= 0.986426 lam= 0.013760 E( 4 )= -2.6245 eV Re[Sigma]= 63.260732 meV Im[Sigma]= 314.820664 meV Z= 1.073811 lam= -0.068738 ------------------------------------------------------------------- ik = 162 coord.: 0.6666667 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518909 meV Im[Sigma]= 230.831334 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312915 meV Im[Sigma]= 196.831231 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480106 meV Im[Sigma]= 169.159149 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907384 meV Im[Sigma]= 257.594020 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 163 coord.: 0.6666667 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.899928 meV Im[Sigma]= 267.550359 meV Z= 1.049753 lam= -0.047395 E( 2 )= -7.3701 eV Re[Sigma]= -18.457289 meV Im[Sigma]= 188.746838 meV Z= 1.036061 lam= -0.034806 E( 3 )= -4.6413 eV Re[Sigma]= 16.531807 meV Im[Sigma]= 177.586255 meV Z= 1.019031 lam= -0.018676 E( 4 )= -3.4814 eV Re[Sigma]= 27.734122 meV Im[Sigma]= 225.005318 meV Z= 1.032038 lam= -0.031043 ------------------------------------------------------------------- ik = 164 coord.: 0.6666667 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212621 meV Im[Sigma]= 154.377809 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061041 meV Im[Sigma]= 191.379008 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490743 meV Im[Sigma]= 147.532912 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360874 meV Im[Sigma]= 176.003068 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 165 coord.: 0.6666667 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052672 meV Im[Sigma]= 237.818228 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387173 meV Im[Sigma]= 205.091120 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395920 meV Im[Sigma]= 170.067042 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299959 meV Im[Sigma]= 255.318659 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 166 coord.: 0.6666667 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286704 meV Im[Sigma]= 298.340959 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520373 meV Im[Sigma]= 148.145792 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213105 meV Im[Sigma]= 291.978332 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524202 meV Im[Sigma]= 336.559962 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 167 coord.: 0.6666667 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.072554 meV Im[Sigma]= 268.834740 meV Z= 1.066518 lam= -0.062369 E( 2 )= -7.5294 eV Re[Sigma]= -12.457263 meV Im[Sigma]= 206.043276 meV Z= 1.049753 lam= -0.047395 E( 3 )= -3.4617 eV Re[Sigma]= 23.570342 meV Im[Sigma]= 242.559709 meV Z= 1.036928 lam= -0.035613 E( 4 )= -1.4850 eV Re[Sigma]= 166.753312 meV Im[Sigma]= 318.685762 meV Z= 1.089098 lam= -0.081809 ------------------------------------------------------------------- ik = 168 coord.: 0.6666667 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295174 meV Im[Sigma]= 285.688712 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061772 meV Im[Sigma]= 148.204277 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429124 meV Im[Sigma]= 187.980680 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933401 meV Im[Sigma]= 337.075482 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 169 coord.: 0.6666667 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.9694 eV Re[Sigma]= -183.021728 meV Im[Sigma]= 231.203605 meV Z= 1.023297 lam= -0.022766 E( 2 )= -5.4186 eV Re[Sigma]= -25.458754 meV Im[Sigma]= 176.201799 meV Z= 1.011246 lam= -0.011120 E( 3 )= -3.0665 eV Re[Sigma]= 37.120998 meV Im[Sigma]= 275.474099 meV Z= 1.056106 lam= -0.053125 E( 4 )= -3.0665 eV Re[Sigma]= 38.594294 meV Im[Sigma]= 275.848821 meV Z= 1.056268 lam= -0.053271 ------------------------------------------------------------------- ik = 170 coord.: 0.6666667 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251124 meV Im[Sigma]= 270.916720 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055694 meV Im[Sigma]= 193.370796 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374290 meV Im[Sigma]= 179.517873 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493697 meV Im[Sigma]= 222.501501 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 171 coord.: 0.6666667 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0219 eV Re[Sigma]= -81.420284 meV Im[Sigma]= 247.232268 meV Z= 1.050420 lam= -0.048000 E( 2 )= -7.4953 eV Re[Sigma]= -30.822630 meV Im[Sigma]= 219.393946 meV Z= 1.053494 lam= -0.050777 E( 3 )= -6.1421 eV Re[Sigma]= 33.653236 meV Im[Sigma]= 126.505310 meV Z= 0.986069 lam= 0.014128 E( 4 )= -2.6245 eV Re[Sigma]= 62.924466 meV Im[Sigma]= 315.264330 meV Z= 1.074330 lam= -0.069187 ------------------------------------------------------------------- ik = 172 coord.: 0.6666667 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479853 meV Im[Sigma]= 272.241517 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664422 meV Im[Sigma]= 204.787285 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230272 meV Im[Sigma]= 244.746521 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813948 meV Im[Sigma]= 320.509797 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 173 coord.: 0.6666667 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.6846 eV Re[Sigma]= -197.664178 meV Im[Sigma]= 180.568489 meV Z= 1.019693 lam= -0.019313 E( 2 )= -6.6106 eV Re[Sigma]= -2.724631 meV Im[Sigma]= 146.307365 meV Z= 0.994023 lam= 0.006013 E( 3 )= -1.2665 eV Re[Sigma]= 189.101527 meV Im[Sigma]= 290.977569 meV Z= 1.068261 lam= -0.063899 E( 4 )= -1.2665 eV Re[Sigma]= 189.535027 meV Im[Sigma]= 295.501028 meV Z= 1.070174 lam= -0.065572 ------------------------------------------------------------------- ik = 174 coord.: 0.6666667 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040712 meV Im[Sigma]= 177.315635 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021436 meV Im[Sigma]= 199.331124 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056292 meV Im[Sigma]= 357.687145 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804945 meV Im[Sigma]= 350.591820 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 175 coord.: 0.6666667 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759753 meV Im[Sigma]= 178.948965 meV Z= 1.026312 lam= -0.025637 E( 2 )= -5.0893 eV Re[Sigma]= -20.996952 meV Im[Sigma]= 196.990641 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.357976 meV Im[Sigma]= 356.038714 meV Z= 1.114003 lam= -0.102336 E( 4 )= -1.7453 eV Re[Sigma]= 148.676681 meV Im[Sigma]= 348.113812 meV Z= 1.109262 lam= -0.098500 ------------------------------------------------------------------- ik = 176 coord.: 0.6666667 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936156 meV Im[Sigma]= 290.139558 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086578 meV Im[Sigma]= 150.056485 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823028 meV Im[Sigma]= 188.967400 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420469 meV Im[Sigma]= 335.161424 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 177 coord.: 0.6666667 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -84.052655 meV Im[Sigma]= 237.818229 meV Z= 1.045322 lam= -0.043357 E( 2 )= -7.9088 eV Re[Sigma]= -32.387166 meV Im[Sigma]= 205.091116 meV Z= 1.046300 lam= -0.044251 E( 3 )= -5.2372 eV Re[Sigma]= -1.395916 meV Im[Sigma]= 170.067024 meV Z= 1.016101 lam= -0.015846 E( 4 )= -3.1301 eV Re[Sigma]= 40.299958 meV Im[Sigma]= 255.318665 meV Z= 1.049523 lam= -0.047186 ------------------------------------------------------------------- ik = 178 coord.: 0.6666667 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935875 meV Im[Sigma]= 290.139393 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086573 meV Im[Sigma]= 150.056160 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823025 meV Im[Sigma]= 188.968547 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419609 meV Im[Sigma]= 335.162844 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 179 coord.: 0.6666667 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.759102 meV Im[Sigma]= 178.950790 meV Z= 1.026313 lam= -0.025638 E( 2 )= -5.0893 eV Re[Sigma]= -20.997035 meV Im[Sigma]= 196.991450 meV Z= 1.025595 lam= -0.024956 E( 3 )= -1.9911 eV Re[Sigma]= 123.359949 meV Im[Sigma]= 356.031890 meV Z= 1.113999 lam= -0.102333 E( 4 )= -1.7453 eV Re[Sigma]= 148.676432 meV Im[Sigma]= 348.112888 meV Z= 1.109261 lam= -0.098499 ------------------------------------------------------------------- ik = 180 coord.: 0.6666667 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811982 meV Im[Sigma]= 150.896674 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445620 meV Im[Sigma]= 243.590992 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587932 meV Im[Sigma]= 352.916617 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316919 meV Im[Sigma]= 182.010547 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 181 coord.: 0.8333333 0.0000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995546 meV Im[Sigma]= 87.928464 meV Z= 0.995272 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.014573 meV Im[Sigma]= 392.541800 meV Z= 1.122724 lam= -0.109309 E( 3 )= -0.6014 eV Re[Sigma]= 228.600160 meV Im[Sigma]= 176.945715 meV Z= 1.012237 lam= -0.012089 E( 4 )= -0.6014 eV Re[Sigma]= 230.431953 meV Im[Sigma]= 185.076374 meV Z= 1.015813 lam= -0.015567 ------------------------------------------------------------------- ik = 182 coord.: 0.8333333 0.0000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811981 meV Im[Sigma]= 150.896678 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445626 meV Im[Sigma]= 243.591014 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587923 meV Im[Sigma]= 352.916596 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316916 meV Im[Sigma]= 182.010538 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 183 coord.: 0.8333333 0.0000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.479854 meV Im[Sigma]= 272.241523 meV Z= 1.067673 lam= -0.063384 E( 2 )= -7.5294 eV Re[Sigma]= -10.664437 meV Im[Sigma]= 204.787283 meV Z= 1.049227 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230269 meV Im[Sigma]= 244.746517 meV Z= 1.037374 lam= -0.036028 E( 4 )= -1.4850 eV Re[Sigma]= 167.813938 meV Im[Sigma]= 320.509772 meV Z= 1.089642 lam= -0.082267 ------------------------------------------------------------------- ik = 184 coord.: 0.8333333 0.0000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.289122 meV Im[Sigma]= 298.338322 meV Z= 1.078728 lam= -0.072982 E( 2 )= -8.4181 eV Re[Sigma]= -27.519864 meV Im[Sigma]= 148.146414 meV Z= 1.002909 lam= -0.002901 E( 3 )= -2.9817 eV Re[Sigma]= 42.210364 meV Im[Sigma]= 291.976658 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.522103 meV Im[Sigma]= 336.562907 meV Z= 1.099955 lam= -0.090872 ------------------------------------------------------------------- ik = 185 coord.: 0.8333333 0.0000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041156 meV Im[Sigma]= 177.314874 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021955 meV Im[Sigma]= 199.329961 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053474 meV Im[Sigma]= 357.696647 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804035 meV Im[Sigma]= 350.595417 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 186 coord.: 0.8333333 0.0000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339336 meV Im[Sigma]= 97.846697 meV Z= 0.995803 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.771622 meV Im[Sigma]= 380.346834 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.574743 meV Im[Sigma]= 288.244609 meV Z= 1.062949 lam= -0.059222 E( 4 )= -1.1893 eV Re[Sigma]= 203.676928 meV Im[Sigma]= 289.716427 meV Z= 1.063325 lam= -0.059554 ------------------------------------------------------------------- ik = 187 coord.: 0.8333333 0.1666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.952271 meV Im[Sigma]= 147.989177 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.982519 meV Im[Sigma]= 242.987368 meV Z= 1.019647 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297431 meV Im[Sigma]= 350.703058 meV Z= 1.103681 lam= -0.093941 E( 4 )= -0.6189 eV Re[Sigma]= 224.007577 meV Im[Sigma]= 185.539998 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 188 coord.: 0.8333333 0.1666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.041151 meV Im[Sigma]= 177.314872 meV Z= 1.025202 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021966 meV Im[Sigma]= 199.329980 meV Z= 1.025964 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.053474 meV Im[Sigma]= 357.696648 meV Z= 1.114819 lam= -0.102994 E( 4 )= -1.7453 eV Re[Sigma]= 147.804036 meV Im[Sigma]= 350.595419 meV Z= 1.110136 lam= -0.099210 ------------------------------------------------------------------- ik = 189 coord.: 0.8333333 0.1666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.935876 meV Im[Sigma]= 290.139394 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086586 meV Im[Sigma]= 150.056174 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823030 meV Im[Sigma]= 188.968537 meV Z= 1.019061 lam= -0.018705 E( 4 )= -2.3570 eV Re[Sigma]= 83.419599 meV Im[Sigma]= 335.162812 meV Z= 1.094810 lam= -0.086600 ------------------------------------------------------------------- ik = 190 coord.: 0.8333333 0.1666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.875230 meV Im[Sigma]= 234.984807 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902774 meV Im[Sigma]= 203.482069 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650277 meV Im[Sigma]= 171.160955 meV Z= 1.016844 lam= -0.016565 E( 4 )= -3.1301 eV Re[Sigma]= 42.009708 meV Im[Sigma]= 255.810296 meV Z= 1.049064 lam= -0.046769 ------------------------------------------------------------------- ik = 191 coord.: 0.8333333 0.1666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294705 meV Im[Sigma]= 285.688373 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061617 meV Im[Sigma]= 148.203658 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428589 meV Im[Sigma]= 187.981134 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932345 meV Im[Sigma]= 337.074231 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 192 coord.: 0.8333333 0.1666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047918 meV Im[Sigma]= 175.367707 meV Z= 1.024656 lam= -0.024063 E( 2 )= -5.0893 eV Re[Sigma]= -22.701338 meV Im[Sigma]= 195.270208 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.868903 meV Im[Sigma]= 360.047252 meV Z= 1.116202 lam= -0.104105 E( 4 )= -1.7453 eV Re[Sigma]= 147.323252 meV Im[Sigma]= 350.521883 meV Z= 1.110208 lam= -0.099268 ------------------------------------------------------------------- ik = 193 coord.: 0.8333333 0.3333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.877593 meV Im[Sigma]= 263.994917 meV Z= 1.064099 lam= -0.060238 E( 2 )= -7.5294 eV Re[Sigma]= -10.789341 meV Im[Sigma]= 199.125061 meV Z= 1.047637 lam= -0.045471 E( 3 )= -3.4617 eV Re[Sigma]= 25.269184 meV Im[Sigma]= 246.342584 meV Z= 1.037337 lam= -0.035994 E( 4 )= -1.4850 eV Re[Sigma]= 167.275065 meV Im[Sigma]= 322.677866 meV Z= 1.090636 lam= -0.083104 ------------------------------------------------------------------- ik = 194 coord.: 0.8333333 0.3333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.294704 meV Im[Sigma]= 285.688363 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061625 meV Im[Sigma]= 148.203667 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.428581 meV Im[Sigma]= 187.981147 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.932361 meV Im[Sigma]= 337.074261 meV Z= 1.095468 lam= -0.087148 ------------------------------------------------------------------- ik = 195 coord.: 0.8333333 0.3333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251785 meV Im[Sigma]= 270.915186 meV Z= 1.050658 lam= -0.048215 E( 2 )= -7.3701 eV Re[Sigma]= -20.054344 meV Im[Sigma]= 193.371047 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.373779 meV Im[Sigma]= 179.515756 meV Z= 1.019697 lam= -0.019316 E( 4 )= -3.4814 eV Re[Sigma]= 24.492301 meV Im[Sigma]= 222.499542 meV Z= 1.031845 lam= -0.030862 ------------------------------------------------------------------- ik = 196 coord.: 0.8333333 0.3333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212615 meV Im[Sigma]= 154.377806 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.061043 meV Im[Sigma]= 191.379011 meV Z= 1.045113 lam= -0.043166 E( 3 )= -5.4004 eV Re[Sigma]= 4.490750 meV Im[Sigma]= 147.532901 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360865 meV Im[Sigma]= 176.003064 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 197 coord.: 0.8333333 0.3333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518892 meV Im[Sigma]= 230.831339 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312921 meV Im[Sigma]= 196.831231 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480101 meV Im[Sigma]= 169.159137 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907376 meV Im[Sigma]= 257.594019 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 198 coord.: 0.8333333 0.3333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.929827 meV Im[Sigma]= 289.845707 meV Z= 1.074754 lam= -0.069554 E( 2 )= -8.4181 eV Re[Sigma]= -24.131985 meV Im[Sigma]= 141.910654 meV Z= 1.001587 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.422000 meV Im[Sigma]= 292.832580 meV Z= 1.060071 lam= -0.056667 E( 4 )= -2.2693 eV Re[Sigma]= 91.267765 meV Im[Sigma]= 336.778459 meV Z= 1.099797 lam= -0.090742 ------------------------------------------------------------------- ik = 199 coord.: 0.8333333 0.5000000 0.0000000 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -136.932510 meV Im[Sigma]= 289.844019 meV Z= 1.074752 lam= -0.069553 E( 2 )= -8.4181 eV Re[Sigma]= -24.130865 meV Im[Sigma]= 141.909765 meV Z= 1.001588 lam= -0.001585 E( 3 )= -2.9817 eV Re[Sigma]= 41.419509 meV Im[Sigma]= 292.832513 meV Z= 1.060072 lam= -0.056668 E( 4 )= -2.2693 eV Re[Sigma]= 91.265975 meV Im[Sigma]= 336.780385 meV Z= 1.099799 lam= -0.090743 ------------------------------------------------------------------- ik = 200 coord.: 0.8333333 0.5000000 0.1666667 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -85.518911 meV Im[Sigma]= 230.831339 meV Z= 1.041875 lam= -0.040192 E( 2 )= -7.9088 eV Re[Sigma]= -30.312911 meV Im[Sigma]= 196.831231 meV Z= 1.043063 lam= -0.041285 E( 3 )= -5.2372 eV Re[Sigma]= -2.480118 meV Im[Sigma]= 169.159159 meV Z= 1.015382 lam= -0.015149 E( 4 )= -3.1301 eV Re[Sigma]= 42.907379 meV Im[Sigma]= 257.594028 meV Z= 1.048651 lam= -0.046394 ------------------------------------------------------------------- ik = 201 coord.: 0.8333333 0.5000000 0.3333333 ------------------------------------------------------------------- E( 1 )= -10.5169 eV Re[Sigma]= -75.212891 meV Im[Sigma]= 154.378041 meV Z= 0.986410 lam= 0.013777 E( 2 )= -7.6803 eV Re[Sigma]= -41.060775 meV Im[Sigma]= 191.380424 meV Z= 1.045114 lam= -0.043167 E( 3 )= -5.4004 eV Re[Sigma]= 4.491074 meV Im[Sigma]= 147.532134 meV Z= 1.005100 lam= -0.005074 E( 4 )= -4.2518 eV Re[Sigma]= 34.360890 meV Im[Sigma]= 176.001322 meV Z= 1.013549 lam= -0.013368 ------------------------------------------------------------------- ik = 202 coord.: 0.8333333 0.5000000 0.5000000 ------------------------------------------------------------------- E( 1 )= -11.4343 eV Re[Sigma]= -93.251142 meV Im[Sigma]= 270.916729 meV Z= 1.050658 lam= -0.048216 E( 2 )= -7.3701 eV Re[Sigma]= -20.055687 meV Im[Sigma]= 193.370792 meV Z= 1.037395 lam= -0.036047 E( 3 )= -4.6413 eV Re[Sigma]= 15.374280 meV Im[Sigma]= 179.517890 meV Z= 1.019697 lam= -0.019317 E( 4 )= -3.4814 eV Re[Sigma]= 24.493703 meV Im[Sigma]= 222.501497 meV Z= 1.031847 lam= -0.030864 ------------------------------------------------------------------- ik = 203 coord.: 0.8333333 0.5000000 0.6666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295167 meV Im[Sigma]= 285.688719 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061769 meV Im[Sigma]= 148.204273 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429125 meV Im[Sigma]= 187.980687 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933399 meV Im[Sigma]= 337.075495 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 204 coord.: 0.8333333 0.5000000 0.8333333 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -170.879861 meV Im[Sigma]= 263.993028 meV Z= 1.064098 lam= -0.060237 E( 2 )= -7.5294 eV Re[Sigma]= -10.788170 meV Im[Sigma]= 199.121586 meV Z= 1.047636 lam= -0.045470 E( 3 )= -3.4617 eV Re[Sigma]= 25.268820 meV Im[Sigma]= 246.341102 meV Z= 1.037336 lam= -0.035992 E( 4 )= -1.4850 eV Re[Sigma]= 167.274310 meV Im[Sigma]= 322.679553 meV Z= 1.090637 lam= -0.083105 ------------------------------------------------------------------- ik = 205 coord.: 0.8333333 0.6666667 0.0000000 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -201.047981 meV Im[Sigma]= 175.366418 meV Z= 1.024655 lam= -0.024062 E( 2 )= -5.0893 eV Re[Sigma]= -22.700365 meV Im[Sigma]= 195.269980 meV Z= 1.024937 lam= -0.024330 E( 3 )= -1.9911 eV Re[Sigma]= 122.865521 meV Im[Sigma]= 360.052930 meV Z= 1.116205 lam= -0.104107 E( 4 )= -1.7453 eV Re[Sigma]= 147.322874 meV Im[Sigma]= 350.524853 meV Z= 1.110210 lam= -0.099270 ------------------------------------------------------------------- ik = 206 coord.: 0.8333333 0.6666667 0.1666667 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.295164 meV Im[Sigma]= 285.688715 meV Z= 1.079969 lam= -0.074048 E( 2 )= -6.5385 eV Re[Sigma]= -20.061767 meV Im[Sigma]= 148.204278 meV Z= 0.994395 lam= 0.005637 E( 3 )= -4.4503 eV Re[Sigma]= 16.429123 meV Im[Sigma]= 187.980674 meV Z= 1.018538 lam= -0.018201 E( 4 )= -2.3570 eV Re[Sigma]= 82.933394 meV Im[Sigma]= 337.075489 meV Z= 1.095469 lam= -0.087149 ------------------------------------------------------------------- ik = 207 coord.: 0.8333333 0.6666667 0.3333333 ------------------------------------------------------------------- E( 1 )= -11.0077 eV Re[Sigma]= -82.874898 meV Im[Sigma]= 234.985941 meV Z= 1.043561 lam= -0.041743 E( 2 )= -7.9088 eV Re[Sigma]= -29.902665 meV Im[Sigma]= 203.481555 meV Z= 1.045547 lam= -0.043563 E( 3 )= -5.2372 eV Re[Sigma]= -1.650412 meV Im[Sigma]= 171.161983 meV Z= 1.016845 lam= -0.016566 E( 4 )= -3.1301 eV Re[Sigma]= 42.011107 meV Im[Sigma]= 255.811722 meV Z= 1.049065 lam= -0.046770 ------------------------------------------------------------------- ik = 208 coord.: 0.8333333 0.6666667 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.2739 eV Re[Sigma]= -148.936166 meV Im[Sigma]= 290.139552 meV Z= 1.081656 lam= -0.075491 E( 2 )= -6.5385 eV Re[Sigma]= -18.086570 meV Im[Sigma]= 150.056492 meV Z= 0.995071 lam= 0.004953 E( 3 )= -4.4503 eV Re[Sigma]= 15.823031 meV Im[Sigma]= 188.967402 meV Z= 1.019061 lam= -0.018704 E( 4 )= -2.3570 eV Re[Sigma]= 83.420475 meV Im[Sigma]= 335.161444 meV Z= 1.094809 lam= -0.086599 ------------------------------------------------------------------- ik = 209 coord.: 0.8333333 0.6666667 0.6666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040713 meV Im[Sigma]= 177.315638 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021431 meV Im[Sigma]= 199.331122 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056296 meV Im[Sigma]= 357.687154 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804951 meV Im[Sigma]= 350.591835 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 210 coord.: 0.8333333 0.6666667 0.8333333 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -215.951837 meV Im[Sigma]= 147.989463 meV Z= 1.009036 lam= -0.008955 E( 2 )= -4.0806 eV Re[Sigma]= -9.980883 meV Im[Sigma]= 242.987537 meV Z= 1.019648 lam= -0.019269 E( 3 )= -2.2746 eV Re[Sigma]= 97.297720 meV Im[Sigma]= 350.700208 meV Z= 1.103680 lam= -0.093940 E( 4 )= -0.6189 eV Re[Sigma]= 224.007525 meV Im[Sigma]= 185.540528 meV Z= 1.017490 lam= -0.017189 ------------------------------------------------------------------- ik = 211 coord.: 0.8333333 0.8333333 0.0000000 ------------------------------------------------------------------- E( 1 )= -15.1744 eV Re[Sigma]= -223.339164 meV Im[Sigma]= 97.847198 meV Z= 0.995804 lam= 0.004214 E( 2 )= -1.7543 eV Re[Sigma]= 153.771002 meV Im[Sigma]= 380.347036 meV Z= 1.124385 lam= -0.110625 E( 3 )= -1.1893 eV Re[Sigma]= 203.578948 meV Im[Sigma]= 288.311604 meV Z= 1.062966 lam= -0.059236 E( 4 )= -1.1893 eV Re[Sigma]= 203.671952 meV Im[Sigma]= 289.647181 meV Z= 1.063308 lam= -0.059539 ------------------------------------------------------------------- ik = 212 coord.: 0.8333333 0.8333333 0.1666667 ------------------------------------------------------------------- E( 1 )= -13.8262 eV Re[Sigma]= -202.040709 meV Im[Sigma]= 177.315640 meV Z= 1.025203 lam= -0.024583 E( 2 )= -5.0893 eV Re[Sigma]= -21.021432 meV Im[Sigma]= 199.331122 meV Z= 1.025965 lam= -0.025307 E( 3 )= -1.9911 eV Re[Sigma]= 123.056291 meV Im[Sigma]= 357.687152 meV Z= 1.114815 lam= -0.102990 E( 4 )= -1.7453 eV Re[Sigma]= 147.804937 meV Im[Sigma]= 350.591810 meV Z= 1.110133 lam= -0.099207 ------------------------------------------------------------------- ik = 213 coord.: 0.8333333 0.8333333 0.3333333 ------------------------------------------------------------------- E( 1 )= -12.1268 eV Re[Sigma]= -137.286699 meV Im[Sigma]= 298.340959 meV Z= 1.078730 lam= -0.072984 E( 2 )= -8.4181 eV Re[Sigma]= -27.520383 meV Im[Sigma]= 148.145793 meV Z= 1.002908 lam= -0.002900 E( 3 )= -2.9817 eV Re[Sigma]= 42.213105 meV Im[Sigma]= 291.978327 meV Z= 1.060462 lam= -0.057015 E( 4 )= -2.2693 eV Re[Sigma]= 89.524195 meV Im[Sigma]= 336.559968 meV Z= 1.099954 lam= -0.090871 ------------------------------------------------------------------- ik = 214 coord.: 0.8333333 0.8333333 0.5000000 ------------------------------------------------------------------- E( 1 )= -12.5779 eV Re[Sigma]= -172.482324 meV Im[Sigma]= 272.239669 meV Z= 1.067672 lam= -0.063383 E( 2 )= -7.5294 eV Re[Sigma]= -10.662987 meV Im[Sigma]= 204.784499 meV Z= 1.049226 lam= -0.046917 E( 3 )= -3.4617 eV Re[Sigma]= 26.230551 meV Im[Sigma]= 244.747264 meV Z= 1.037374 lam= -0.036027 E( 4 )= -1.4850 eV Re[Sigma]= 167.813474 meV Im[Sigma]= 320.510198 meV Z= 1.089642 lam= -0.082268 ------------------------------------------------------------------- ik = 215 coord.: 0.8333333 0.8333333 0.6666667 ------------------------------------------------------------------- E( 1 )= -14.3745 eV Re[Sigma]= -217.811982 meV Im[Sigma]= 150.896673 meV Z= 1.010168 lam= -0.010065 E( 2 )= -4.0806 eV Re[Sigma]= -7.445617 meV Im[Sigma]= 243.590997 meV Z= 1.019500 lam= -0.019127 E( 3 )= -2.2746 eV Re[Sigma]= 96.587930 meV Im[Sigma]= 352.916625 meV Z= 1.105509 lam= -0.095439 E( 4 )= -0.6189 eV Re[Sigma]= 224.316919 meV Im[Sigma]= 182.010546 meV Z= 1.015446 lam= -0.015211 ------------------------------------------------------------------- ik = 216 coord.: 0.8333333 0.8333333 0.8333333 ------------------------------------------------------------------- E( 1 )= -15.3226 eV Re[Sigma]= -223.995404 meV Im[Sigma]= 87.929010 meV Z= 0.995273 lam= 0.004750 E( 2 )= -2.2204 eV Re[Sigma]= 101.013414 meV Im[Sigma]= 392.552890 meV Z= 1.122729 lam= -0.109314 E( 3 )= -0.6014 eV Re[Sigma]= 228.605949 meV Im[Sigma]= 176.974453 meV Z= 1.012250 lam= -0.012102 E( 4 )= -0.6014 eV Re[Sigma]= 230.423209 meV Im[Sigma]= 185.038359 meV Z= 1.015796 lam= -0.015551 ------------------------------------------------------------------- 1 1 -15.7777 -224.1440 57.1475 0.9811 0.0193 2 1 -15.3226 -223.9954 87.9290 0.9953 0.0047 3 1 -13.6846 -197.6642 180.5685 1.0197 -0.0193 4 1 -12.4659 -158.5895 282.9951 1.0807 -0.0747 5 1 -13.6846 -197.6656 180.5640 1.0197 -0.0193 6 1 -15.3226 -223.9956 87.9285 0.9953 0.0048 7 1 -15.3226 -222.7957 87.8153 0.9956 0.0044 8 1 -15.1744 -223.3393 97.8467 0.9958 0.0042 9 1 -13.8262 -202.7591 178.9508 1.0263 -0.0256 10 1 -12.1268 -136.4250 299.4885 1.0793 -0.0735 11 1 -12.5779 -172.0738 268.8327 1.0665 -0.0624 12 1 -14.3745 -215.9523 147.9892 1.0090 -0.0090 13 1 -13.6846 -195.5607 177.0089 1.0190 -0.0186 14 1 -13.8262 -201.0479 175.3677 1.0247 -0.0241 15 1 -12.9694 -183.0212 231.2042 1.0233 -0.0228 16 1 -11.4343 -92.7991 271.2991 1.0512 -0.0487 17 1 -11.0219 -83.0476 240.2385 1.0470 -0.0449 18 1 -12.5779 -170.8776 263.9949 1.0641 -0.0602 19 1 -12.4659 -157.1537 271.5539 1.0743 -0.0691 20 1 -12.1268 -136.9298 289.8457 1.0748 -0.0696 21 1 -11.4343 -93.8992 267.5502 1.0498 -0.0474 22 1 -11.1466 -66.9989 238.9344 1.0483 -0.0461 23 1 -11.4343 -93.8999 267.5504 1.0498 -0.0474 24 1 -12.1268 -136.9325 289.8440 1.0748 -0.0696 25 1 -13.6846 -195.5617 177.0049 1.0190 -0.0186 26 1 -12.5779 -170.8799 263.9930 1.0641 -0.0602 27 1 -11.0219 -83.0472 240.2397 1.0470 -0.0449 28 1 -11.4343 -92.8004 271.2999 1.0512 -0.0487 29 1 -12.9694 -183.0217 231.2036 1.0233 -0.0228 30 1 -13.8262 -201.0480 175.3664 1.0247 -0.0241 31 1 -15.3226 -222.7958 87.8159 0.9956 0.0044 32 1 -14.3745 -215.9518 147.9895 1.0090 -0.0090 33 1 -12.5779 -172.0725 268.8347 1.0665 -0.0624 34 1 -12.1268 -136.4283 299.4878 1.0793 -0.0735 35 1 -13.8262 -202.7598 178.9490 1.0263 -0.0256 36 1 -15.1744 -223.3392 97.8472 0.9958 0.0042 37 1 -15.3226 -223.9954 87.9290 0.9953 0.0047 38 1 -15.1744 -223.3392 97.8472 0.9958 0.0042 39 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 40 1 -12.1268 -137.2867 298.3410 1.0787 -0.0730 41 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 42 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 43 1 -15.1744 -223.3393 97.8467 0.9958 0.0042 44 1 -15.3226 -223.9956 87.9285 0.9953 0.0048 45 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 46 1 -12.5779 -172.4798 272.2415 1.0677 -0.0634 47 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 48 1 -13.8262 -202.0412 177.3149 1.0252 -0.0246 49 1 -13.8262 -201.0479 175.3677 1.0247 -0.0241 50 1 -14.3745 -215.9523 147.9892 1.0090 -0.0090 51 1 -13.8262 -202.0411 177.3149 1.0252 -0.0246 52 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 53 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 54 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 55 1 -12.1268 -136.9298 289.8457 1.0748 -0.0696 56 1 -12.5779 -170.8776 263.9949 1.0641 -0.0602 57 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 58 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 59 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 60 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 61 1 -12.5779 -170.8799 263.9930 1.0641 -0.0602 62 1 -12.1268 -136.9325 289.8440 1.0748 -0.0696 63 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 64 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 65 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 66 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 67 1 -14.3745 -215.9518 147.9895 1.0090 -0.0090 68 1 -13.8262 -201.0480 175.3664 1.0247 -0.0241 69 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 70 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 71 1 -12.2739 -148.9362 290.1395 1.0817 -0.0755 72 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 73 1 -13.6846 -197.6642 180.5685 1.0197 -0.0193 74 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 75 1 -12.9694 -183.0217 231.2036 1.0233 -0.0228 76 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 77 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 78 1 -12.5779 -172.4798 272.2415 1.0677 -0.0634 79 1 -13.8262 -202.7591 178.9508 1.0263 -0.0256 80 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 81 1 -13.8262 -202.7598 178.9490 1.0263 -0.0256 82 1 -12.2739 -148.9362 290.1395 1.0817 -0.0755 83 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 84 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 85 1 -12.9694 -183.0212 231.2042 1.0233 -0.0228 86 1 -13.8262 -202.0412 177.3149 1.0252 -0.0246 87 1 -13.6846 -197.6656 180.5640 1.0197 -0.0193 88 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 89 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 90 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 91 1 -11.4343 -93.8992 267.5502 1.0498 -0.0474 92 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 93 1 -12.5779 -172.0738 268.8327 1.0665 -0.0624 94 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 95 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 96 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 97 1 -11.0219 -83.0472 240.2396 1.0470 -0.0449 98 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 99 1 -11.0219 -83.0476 240.2385 1.0470 -0.0449 100 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 101 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 102 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 103 1 -12.5779 -172.0725 268.8347 1.0665 -0.0624 104 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 105 1 -11.4343 -93.8999 267.5504 1.0498 -0.0474 106 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 107 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 108 1 -12.1268 -137.2867 298.3409 1.0787 -0.0730 109 1 -12.4659 -158.5895 282.9951 1.0807 -0.0747 110 1 -12.1268 -137.2867 298.3409 1.0787 -0.0730 111 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 112 1 -11.1466 -66.9989 238.9344 1.0483 -0.0461 113 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 114 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 115 1 -12.1268 -136.4250 299.4885 1.0793 -0.0735 116 1 -12.5779 -172.4799 272.2415 1.0677 -0.0634 117 1 -12.2739 -148.9362 290.1396 1.0817 -0.0755 118 1 -11.4343 -92.8004 271.2999 1.0512 -0.0487 119 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 120 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 121 1 -11.4343 -92.7991 271.2991 1.0512 -0.0487 122 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 123 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 124 1 -12.1268 -136.4283 299.4878 1.0793 -0.0735 125 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 126 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 127 1 -11.1466 -66.9989 238.9344 1.0483 -0.0461 128 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 129 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 130 1 -12.4659 -158.5895 282.9951 1.0807 -0.0747 131 1 -12.1268 -137.2867 298.3410 1.0787 -0.0730 132 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 133 1 -11.4343 -92.8004 271.2999 1.0512 -0.0487 134 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 135 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 136 1 -12.1268 -136.4250 299.4885 1.0793 -0.0735 137 1 -12.5779 -172.4799 272.2415 1.0677 -0.0634 138 1 -12.2739 -148.9362 290.1396 1.0817 -0.0755 139 1 -12.1268 -136.4283 299.4878 1.0793 -0.0735 140 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 141 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 142 1 -11.4343 -92.7991 271.2991 1.0512 -0.0487 143 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 144 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 145 1 -13.6846 -197.6656 180.5640 1.0197 -0.0193 146 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 147 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 148 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 149 1 -12.9694 -183.0212 231.2042 1.0233 -0.0228 150 1 -13.8262 -202.0412 177.3149 1.0252 -0.0246 151 1 -12.5779 -172.0738 268.8327 1.0665 -0.0624 152 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 153 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 154 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 155 1 -11.4343 -93.8992 267.5502 1.0498 -0.0474 156 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 157 1 -11.0219 -83.0476 240.2385 1.0470 -0.0449 158 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 159 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 160 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 161 1 -11.0219 -83.0472 240.2397 1.0470 -0.0449 162 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 163 1 -11.4343 -93.8999 267.5504 1.0498 -0.0474 164 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 165 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 166 1 -12.1268 -137.2867 298.3410 1.0787 -0.0730 167 1 -12.5779 -172.0726 268.8347 1.0665 -0.0624 168 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 169 1 -12.9694 -183.0217 231.2036 1.0233 -0.0228 170 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 171 1 -11.0219 -81.4203 247.2323 1.0504 -0.0480 172 1 -12.5779 -172.4799 272.2415 1.0677 -0.0634 173 1 -13.6846 -197.6642 180.5685 1.0197 -0.0193 174 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 175 1 -13.8262 -202.7598 178.9490 1.0263 -0.0256 176 1 -12.2739 -148.9362 290.1396 1.0817 -0.0755 177 1 -11.0077 -84.0527 237.8182 1.0453 -0.0434 178 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 179 1 -13.8262 -202.7591 178.9508 1.0263 -0.0256 180 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 181 1 -15.3226 -223.9955 87.9285 0.9953 0.0048 182 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 183 1 -12.5779 -172.4799 272.2415 1.0677 -0.0634 184 1 -12.1268 -137.2891 298.3383 1.0787 -0.0730 185 1 -13.8262 -202.0412 177.3149 1.0252 -0.0246 186 1 -15.1744 -223.3393 97.8467 0.9958 0.0042 187 1 -14.3745 -215.9523 147.9892 1.0090 -0.0090 188 1 -13.8262 -202.0412 177.3149 1.0252 -0.0246 189 1 -12.2739 -148.9359 290.1394 1.0817 -0.0755 190 1 -11.0077 -82.8752 234.9848 1.0436 -0.0417 191 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 192 1 -13.8262 -201.0479 175.3677 1.0247 -0.0241 193 1 -12.5779 -170.8776 263.9949 1.0641 -0.0602 194 1 -12.2739 -148.2947 285.6884 1.0800 -0.0740 195 1 -11.4343 -93.2518 270.9152 1.0507 -0.0482 196 1 -10.5169 -75.2126 154.3778 0.9864 0.0138 197 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 198 1 -12.1268 -136.9298 289.8457 1.0748 -0.0696 199 1 -12.1268 -136.9325 289.8440 1.0748 -0.0696 200 1 -11.0077 -85.5189 230.8313 1.0419 -0.0402 201 1 -10.5169 -75.2129 154.3780 0.9864 0.0138 202 1 -11.4343 -93.2511 270.9167 1.0507 -0.0482 203 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 204 1 -12.5779 -170.8799 263.9930 1.0641 -0.0602 205 1 -13.8262 -201.0480 175.3664 1.0247 -0.0241 206 1 -12.2739 -148.2952 285.6887 1.0800 -0.0740 207 1 -11.0077 -82.8749 234.9859 1.0436 -0.0417 208 1 -12.2739 -148.9362 290.1396 1.0817 -0.0755 209 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 210 1 -14.3745 -215.9518 147.9895 1.0090 -0.0090 211 1 -15.1744 -223.3392 97.8472 0.9958 0.0042 212 1 -13.8262 -202.0407 177.3156 1.0252 -0.0246 213 1 -12.1268 -137.2867 298.3410 1.0787 -0.0730 214 1 -12.5779 -172.4823 272.2397 1.0677 -0.0634 215 1 -14.3745 -217.8120 150.8967 1.0102 -0.0101 216 1 -15.3226 -223.9954 87.9290 0.9953 0.0047 1 2 -0.3992 234.4441 146.2029 0.9988 0.0012 2 2 -2.2204 101.0134 392.5529 1.1227 -0.1093 3 2 -6.6106 -2.7246 146.3074 0.9940 0.0060 4 2 -9.2155 6.7291 63.7068 0.9519 0.0505 5 2 -6.6106 -2.7236 146.3033 0.9940 0.0060 6 2 -2.2204 101.0146 392.5418 1.1227 -0.1093 7 2 -2.2204 99.7196 391.3501 1.1216 -0.1084 8 2 -1.7543 153.7716 380.3469 1.1244 -0.1106 9 2 -5.0893 -20.9971 196.9915 1.0256 -0.0250 10 2 -8.4181 -25.2649 148.0739 1.0034 -0.0034 11 2 -7.5294 -12.4559 206.0390 1.0498 -0.0474 12 2 -4.0806 -9.9825 242.9874 1.0196 -0.0193 13 2 -6.6106 -3.7503 141.6108 0.9931 0.0069 14 2 -5.0893 -22.7013 195.2702 1.0249 -0.0243 15 2 -5.4186 -25.4586 176.2011 1.0112 -0.0111 16 2 -7.3701 -18.8496 192.5301 1.0374 -0.0360 17 2 -7.4953 -31.9762 215.0289 1.0524 -0.0498 18 2 -7.5294 -10.7893 199.1251 1.0476 -0.0455 19 2 -9.2155 9.5773 61.4150 0.9526 0.0497 20 2 -8.4181 -24.1320 141.9107 1.0016 -0.0016 21 2 -7.3701 -18.4574 188.7487 1.0361 -0.0348 22 2 -7.9488 -29.2859 175.8080 1.0309 -0.0300 23 2 -7.3701 -18.4573 188.7468 1.0361 -0.0348 24 2 -8.4181 -24.1309 141.9098 1.0016 -0.0016 25 2 -6.6106 -3.7485 141.6075 0.9931 0.0069 26 2 -7.5294 -10.7882 199.1216 1.0476 -0.0455 27 2 -7.4953 -31.9767 215.0310 1.0524 -0.0498 28 2 -7.3701 -18.8485 192.5315 1.0374 -0.0360 29 2 -5.4186 -25.4588 176.2018 1.0112 -0.0111 30 2 -5.0893 -22.7004 195.2700 1.0249 -0.0243 31 2 -2.2204 99.7209 391.3345 1.1216 -0.1084 32 2 -4.0806 -9.9809 242.9875 1.0196 -0.0193 33 2 -7.5294 -12.4573 206.0433 1.0498 -0.0474 34 2 -8.4181 -25.2640 148.0742 1.0034 -0.0034 35 2 -5.0893 -20.9969 196.9906 1.0256 -0.0250 36 2 -1.7543 153.7710 380.3471 1.1244 -0.1106 37 2 -2.2204 101.0134 392.5529 1.1227 -0.1093 38 2 -1.7543 153.7710 380.3470 1.1244 -0.1106 39 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 40 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 41 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 42 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 43 2 -1.7543 153.7716 380.3469 1.1244 -0.1106 44 2 -2.2204 101.0146 392.5418 1.1227 -0.1093 45 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 46 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 47 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 48 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 49 2 -5.0893 -22.7013 195.2702 1.0249 -0.0243 50 2 -4.0806 -9.9825 242.9874 1.0196 -0.0193 51 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 52 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 53 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 54 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 55 2 -8.4181 -24.1320 141.9107 1.0016 -0.0016 56 2 -7.5294 -10.7893 199.1251 1.0476 -0.0455 57 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 58 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 59 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 60 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 61 2 -7.5294 -10.7882 199.1216 1.0476 -0.0455 62 2 -8.4181 -24.1309 141.9098 1.0016 -0.0016 63 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 64 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 65 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 66 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 67 2 -4.0806 -9.9809 242.9875 1.0196 -0.0193 68 2 -5.0893 -22.7004 195.2700 1.0249 -0.0243 69 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 70 2 -7.9088 -29.9027 203.4815 1.0455 -0.0436 71 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 72 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 73 2 -6.6106 -2.7246 146.3074 0.9940 0.0060 74 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 75 2 -5.4186 -25.4588 176.2018 1.0112 -0.0111 76 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 77 2 -7.4953 -30.8226 219.3940 1.0535 -0.0508 78 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 79 2 -5.0893 -20.9970 196.9915 1.0256 -0.0250 80 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 81 2 -5.0893 -20.9970 196.9906 1.0256 -0.0250 82 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 83 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 84 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 85 2 -5.4186 -25.4586 176.2011 1.0112 -0.0111 86 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 87 2 -6.6106 -2.7236 146.3033 0.9940 0.0060 88 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 89 2 -7.4953 -30.8226 219.3939 1.0535 -0.0508 90 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 91 2 -7.3701 -18.4574 188.7487 1.0361 -0.0348 92 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 93 2 -7.5294 -12.4559 206.0390 1.0498 -0.0474 94 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 95 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 96 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 97 2 -7.4953 -31.9767 215.0310 1.0524 -0.0498 98 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 99 2 -7.4953 -31.9762 215.0289 1.0524 -0.0498 100 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 101 2 -7.4953 -30.8226 219.3939 1.0535 -0.0508 102 2 -7.9088 -29.9027 203.4815 1.0455 -0.0436 103 2 -7.5294 -12.4573 206.0433 1.0498 -0.0474 104 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 105 2 -7.3701 -18.4573 188.7468 1.0361 -0.0348 106 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 107 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 108 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 109 2 -9.2155 6.7291 63.7068 0.9519 0.0505 110 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 111 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 112 2 -7.9488 -29.2859 175.8080 1.0309 -0.0300 113 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 114 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 115 2 -8.4181 -25.2649 148.0739 1.0034 -0.0034 116 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 117 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 118 2 -7.3701 -18.8485 192.5315 1.0374 -0.0360 119 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 120 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 121 2 -7.3701 -18.8496 192.5301 1.0374 -0.0360 122 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 123 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 124 2 -8.4181 -25.2640 148.0742 1.0034 -0.0034 125 2 -7.9088 -29.9027 203.4816 1.0455 -0.0436 126 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 127 2 -7.9488 -29.2859 175.8080 1.0309 -0.0300 128 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 129 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 130 2 -9.2155 6.7291 63.7068 0.9519 0.0505 131 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 132 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 133 2 -7.3701 -18.8485 192.5315 1.0374 -0.0360 134 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 135 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 136 2 -8.4181 -25.2649 148.0739 1.0034 -0.0034 137 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 138 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 139 2 -8.4181 -25.2640 148.0742 1.0034 -0.0034 140 2 -7.9088 -29.9027 203.4815 1.0455 -0.0436 141 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 142 2 -7.3701 -18.8496 192.5301 1.0374 -0.0360 143 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 144 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 145 2 -6.6106 -2.7236 146.3033 0.9940 0.0060 146 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 147 2 -7.4953 -30.8226 219.3939 1.0535 -0.0508 148 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 149 2 -5.4186 -25.4586 176.2011 1.0112 -0.0111 150 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 151 2 -7.5294 -12.4559 206.0390 1.0498 -0.0474 152 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 153 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 154 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 155 2 -7.3701 -18.4574 188.7487 1.0361 -0.0348 156 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 157 2 -7.4953 -31.9762 215.0289 1.0524 -0.0498 158 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 159 2 -7.4953 -30.8226 219.3939 1.0535 -0.0508 160 2 -7.9088 -29.9027 203.4816 1.0455 -0.0436 161 2 -7.4953 -31.9767 215.0310 1.0524 -0.0498 162 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 163 2 -7.3701 -18.4573 188.7468 1.0361 -0.0348 164 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 165 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 166 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 167 2 -7.5294 -12.4573 206.0433 1.0498 -0.0474 168 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 169 2 -5.4186 -25.4588 176.2018 1.0112 -0.0111 170 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 171 2 -7.4953 -30.8226 219.3939 1.0535 -0.0508 172 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 173 2 -6.6106 -2.7246 146.3074 0.9940 0.0060 174 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 175 2 -5.0893 -20.9970 196.9906 1.0256 -0.0250 176 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 177 2 -7.9088 -32.3872 205.0911 1.0463 -0.0443 178 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 179 2 -5.0893 -20.9970 196.9914 1.0256 -0.0250 180 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 181 2 -2.2204 101.0146 392.5418 1.1227 -0.1093 182 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 183 2 -7.5294 -10.6644 204.7873 1.0492 -0.0469 184 2 -8.4181 -27.5199 148.1464 1.0029 -0.0029 185 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 186 2 -1.7543 153.7716 380.3468 1.1244 -0.1106 187 2 -4.0806 -9.9825 242.9874 1.0196 -0.0193 188 2 -5.0893 -21.0220 199.3300 1.0260 -0.0253 189 2 -6.5385 -18.0866 150.0562 0.9951 0.0050 190 2 -7.9088 -29.9028 203.4821 1.0455 -0.0436 191 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 192 2 -5.0893 -22.7013 195.2702 1.0249 -0.0243 193 2 -7.5294 -10.7893 199.1251 1.0476 -0.0455 194 2 -6.5385 -20.0616 148.2037 0.9944 0.0056 195 2 -7.3701 -20.0543 193.3710 1.0374 -0.0360 196 2 -7.6803 -41.0610 191.3790 1.0451 -0.0432 197 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 198 2 -8.4181 -24.1320 141.9107 1.0016 -0.0016 199 2 -8.4181 -24.1309 141.9098 1.0016 -0.0016 200 2 -7.9088 -30.3129 196.8312 1.0431 -0.0413 201 2 -7.6803 -41.0608 191.3804 1.0451 -0.0432 202 2 -7.3701 -20.0557 193.3708 1.0374 -0.0360 203 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 204 2 -7.5294 -10.7882 199.1216 1.0476 -0.0455 205 2 -5.0893 -22.7004 195.2700 1.0249 -0.0243 206 2 -6.5385 -20.0618 148.2043 0.9944 0.0056 207 2 -7.9088 -29.9027 203.4816 1.0455 -0.0436 208 2 -6.5385 -18.0866 150.0565 0.9951 0.0050 209 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 210 2 -4.0806 -9.9809 242.9875 1.0196 -0.0193 211 2 -1.7543 153.7710 380.3470 1.1244 -0.1106 212 2 -5.0893 -21.0214 199.3311 1.0260 -0.0253 213 2 -8.4181 -27.5204 148.1458 1.0029 -0.0029 214 2 -7.5294 -10.6630 204.7845 1.0492 -0.0469 215 2 -4.0806 -7.4456 243.5910 1.0195 -0.0191 216 2 -2.2204 101.0134 392.5529 1.1227 -0.1093 1 3 -0.3992 234.1607 145.3284 0.9984 0.0016 2 3 -0.6014 229.4406 180.6782 1.0139 -0.0137 3 3 -1.2665 189.1312 291.2868 1.0684 -0.0640 4 3 -1.7294 141.4369 333.1428 1.1044 -0.0945 5 3 -1.2665 189.3864 293.9650 1.0695 -0.0650 6 3 -0.6014 229.2935 180.0233 1.0136 -0.0134 7 3 -0.6014 229.2725 183.9825 1.0157 -0.0154 8 3 -1.1893 203.6408 289.1962 1.0632 -0.0594 9 3 -1.9911 123.3599 356.0319 1.1140 -0.1023 10 3 -2.9817 42.1392 293.3481 1.0610 -0.0575 11 3 -3.4617 23.5682 242.5587 1.0369 -0.0356 12 3 -2.2746 97.2974 350.7031 1.1037 -0.0939 13 3 -1.2665 189.3804 294.9343 1.0694 -0.0649 14 3 -1.9911 122.8689 360.0473 1.1162 -0.1041 15 3 -3.0665 38.5458 275.8376 1.0563 -0.0533 16 3 -4.6413 14.8386 178.8530 1.0198 -0.0194 17 3 -6.1421 34.4451 126.2392 0.9864 0.0138 18 3 -3.4617 25.2692 246.3426 1.0373 -0.0360 19 3 -1.7294 140.9789 331.1519 1.1038 -0.0940 20 3 -2.9817 41.4220 292.8326 1.0601 -0.0567 21 3 -4.6413 16.5324 177.5869 1.0190 -0.0187 22 3 -4.1536 21.5778 173.6929 1.0097 -0.0096 23 3 -4.6413 16.5318 177.5863 1.0190 -0.0187 24 3 -2.9817 41.4195 292.8325 1.0601 -0.0567 25 3 -1.2665 189.3789 294.9399 1.0694 -0.0649 26 3 -3.4617 25.2688 246.3411 1.0373 -0.0360 27 3 -6.1421 34.4450 126.2392 0.9864 0.0138 28 3 -4.6413 14.8384 178.8486 1.0198 -0.0194 29 3 -3.0665 38.4161 275.8035 1.0562 -0.0533 30 3 -1.9911 122.8655 360.0529 1.1162 -0.1041 31 3 -0.6014 229.2737 183.9879 1.0157 -0.0154 32 3 -2.2746 97.2977 350.7002 1.1037 -0.0939 33 3 -3.4617 23.5703 242.5597 1.0369 -0.0356 34 3 -2.9817 42.1398 293.3476 1.0610 -0.0575 35 3 -1.9911 123.3580 356.0387 1.1140 -0.1023 36 3 -1.1893 203.6693 289.6089 1.0633 -0.0595 37 3 -0.6014 229.8272 182.3938 1.0146 -0.0144 38 3 -1.1893 203.6475 289.2966 1.0632 -0.0595 39 3 -1.9911 123.0563 357.6871 1.1148 -0.1030 40 3 -2.9817 42.2131 291.9784 1.0605 -0.0570 41 3 -3.4617 26.2305 244.7473 1.0374 -0.0360 42 3 -2.2746 96.5879 352.9166 1.1055 -0.0954 43 3 -1.1893 203.6891 289.8922 1.0634 -0.0596 44 3 -0.6014 229.6826 181.7503 1.0143 -0.0141 45 3 -2.2746 96.5879 352.9166 1.1055 -0.0954 46 3 -3.4617 26.2303 244.7465 1.0374 -0.0360 47 3 -2.9817 42.2104 291.9767 1.0605 -0.0570 48 3 -1.9911 123.0535 357.6967 1.1148 -0.1030 49 3 -1.9911 122.8689 360.0473 1.1162 -0.1041 50 3 -2.2746 97.2974 350.7031 1.1037 -0.0939 51 3 -1.9911 123.0535 357.6967 1.1148 -0.1030 52 3 -4.4503 15.8230 188.9686 1.0191 -0.0187 53 3 -5.2372 -1.6503 171.1609 1.0168 -0.0166 54 3 -4.4503 16.4286 187.9812 1.0185 -0.0182 55 3 -2.9817 41.4220 292.8326 1.0601 -0.0567 56 3 -3.4617 25.2692 246.3426 1.0373 -0.0360 57 3 -4.4503 16.4286 187.9812 1.0185 -0.0182 58 3 -4.6413 15.3738 179.5158 1.0197 -0.0193 59 3 -5.4004 4.4907 147.5329 1.0051 -0.0051 60 3 -5.2372 -2.4801 169.1592 1.0154 -0.0151 61 3 -3.4617 25.2688 246.3411 1.0373 -0.0360 62 3 -2.9817 41.4195 292.8325 1.0601 -0.0567 63 3 -5.2372 -2.4801 169.1592 1.0154 -0.0151 64 3 -5.4004 4.4911 147.5321 1.0051 -0.0051 65 3 -4.6413 15.3743 179.5179 1.0197 -0.0193 66 3 -4.4503 16.4291 187.9807 1.0185 -0.0182 67 3 -2.2746 97.2977 350.7002 1.1037 -0.0939 68 3 -1.9911 122.8655 360.0529 1.1162 -0.1041 69 3 -4.4503 16.4291 187.9807 1.0185 -0.0182 70 3 -5.2372 -1.6504 171.1620 1.0168 -0.0166 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-0.0156 182 4 -0.6189 224.3169 182.0105 1.0154 -0.0152 183 4 -1.4850 167.8139 320.5098 1.0896 -0.0823 184 4 -2.2693 89.5221 336.5629 1.1000 -0.0909 185 4 -1.7453 147.8040 350.5954 1.1101 -0.0992 186 4 -1.1893 203.6769 289.7164 1.0633 -0.0596 187 4 -0.6189 224.0076 185.5400 1.0175 -0.0172 188 4 -1.7453 147.8040 350.5954 1.1101 -0.0992 189 4 -2.3570 83.4196 335.1628 1.0948 -0.0866 190 4 -3.1301 42.0097 255.8103 1.0491 -0.0468 191 4 -2.3570 82.9323 337.0742 1.0955 -0.0871 192 4 -1.7453 147.3233 350.5219 1.1102 -0.0993 193 4 -1.4850 167.2751 322.6779 1.0906 -0.0831 194 4 -2.3570 82.9324 337.0743 1.0955 -0.0871 195 4 -3.4814 24.4923 222.4995 1.0318 -0.0309 196 4 -4.2518 34.3609 176.0031 1.0135 -0.0134 197 4 -3.1301 42.9074 257.5940 1.0487 -0.0464 198 4 -2.2693 91.2678 336.7785 1.0998 -0.0907 199 4 -2.2693 91.2660 336.7804 1.0998 -0.0907 200 4 -3.1301 42.9074 257.5940 1.0487 -0.0464 201 4 -4.2518 34.3609 176.0013 1.0135 -0.0134 202 4 -3.4814 24.4937 222.5015 1.0318 -0.0309 203 4 -2.3570 82.9334 337.0755 1.0955 -0.0871 204 4 -1.4850 167.2743 322.6796 1.0906 -0.0831 205 4 -1.7453 147.3229 350.5249 1.1102 -0.0993 206 4 -2.3570 82.9334 337.0755 1.0955 -0.0871 207 4 -3.1301 42.0111 255.8117 1.0491 -0.0468 208 4 -2.3570 83.4205 335.1614 1.0948 -0.0866 209 4 -1.7453 147.8050 350.5918 1.1101 -0.0992 210 4 -0.6189 224.0075 185.5405 1.0175 -0.0172 211 4 -1.1893 203.6720 289.6472 1.0633 -0.0595 212 4 -1.7453 147.8049 350.5918 1.1101 -0.0992 213 4 -2.2693 89.5242 336.5600 1.1000 -0.0909 214 4 -1.4850 167.8135 320.5102 1.0896 -0.0823 215 4 -0.6189 224.3169 182.0105 1.0154 -0.0152 216 4 -0.6014 230.4232 185.0384 1.0158 -0.0156 =================================================================== Eliashberg Spectral Function in the Migdal Approximation =================================================================== lambda : 0.0786447 lambda_tr : 0.1301540 Estimated Allen-Dynes Tc logavg = 0.0058070 l_a2F = 0.0837707 mu = 0.10 Tc = ********************** K mu = 0.12 Tc = ********************** K mu = 0.14 Tc = ********************** K mu = 0.16 Tc = 471362811.111343264580 K mu = 0.18 Tc = 33076793.646851420403 K mu = 0.20 Tc = 5612221.115876531228 K a2F : 0.16s CPU 0.08s WALL ( 1 calls) Unfolding on the coarse grid elphon_wrap : 88.17s CPU 44.25s WALL ( 1 calls) INITIALIZATION: init_vloc : 0.12s CPU 0.06s WALL ( 29 calls) init_us_1 : 1.95s CPU 0.98s WALL ( 29 calls) Electron-Phonon interpolation ephwann : 8.46s CPU 4.26s WALL ( 1 calls) ep-interp : 8.08s CPU 4.06s WALL ( 216 calls) PH SELF-ENER : 0.64s CPU 0.32s WALL ( 216 calls) Ham: step 1 : 0.00s CPU 0.00s WALL ( 1 calls) Ham: step 2 : 0.00s CPU 0.00s WALL ( 1 calls) ep: step 1 : 0.00s CPU 0.00s WALL ( 162 calls) ep: step 2 : 0.07s CPU 0.03s WALL ( 162 calls) DynW2B : 0.01s CPU 0.01s WALL ( 216 calls) HamW2B : 2.97s CPU 1.48s WALL ( 93744 calls) ephW2Bp : 0.19s CPU 0.09s WALL ( 216 calls) Total program execution EPW : 1m48.70s CPU 0m54.55s WALL