mirror of https://gitlab.com/QEF/q-e.git
2811 lines
215 KiB
Plaintext
2811 lines
215 KiB
Plaintext
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``:oss/
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`.+s+. .+ys--yh+ `./ss+.
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-sh//yy+` +yy +yy -+h+-oyy
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-yh- .oyy/.-sh. .syo-.:sy- /yh
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`.-.` `yh+ -oyyyo. `/syys: oys `.`
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`/+ssys+-` `sh+ ` oys` .:osyo`
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-yh- ./syyooyo` .sys+/oyo--yh/
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`yy+ .-:-. `-/+/:` -sh-
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/yh. oys
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``..---hho---------` .---------..` `.-----.` -hd+---.
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`./osmNMMMMMMMMMMMMMMMs. +NNMMMMMMMMNNmh+. yNMMMMMNm- oNMMMMMNmo++:`
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+sy--/sdMMMhyyyyyyyNMMh- .oyNMMmyyyyyhNMMm+` -yMMMdyyo:` .oyyNMMNhs+syy`
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-yy/ /MMM+.`-+/``mMMy- `mMMh:`````.dMMN:` `MMMy-`-dhhy```mMMy:``+hs
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-yy+` /MMMo:-mMM+`-oo/. mMMh: `dMMN/` dMMm:`dMMMMy..MMMo-.+yo`
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.sys`/MMMMNNMMMs- mMMmyooooymMMNo: oMMM/sMMMMMM++MMN//oh:
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`sh+/MMMhyyMMMs- `-` mMMMMMMMMMNmy+-` -MMMhMMMsmMMmdMMd/yy+
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`-/+++oyy-/MMM+.`/hh/.`mNm:` mMMd+/////:-.` NMMMMMd/:NMMMMMy:/yyo/:.`
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+os+//:-..-oMMMo:--:::-/MMMo. .-mMMd+---` hMMMMN+. oMMMMMo. `-+osyso:`
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syo `mNMMMMMNNNNNNNNMMMo.oNNMMMMMNNNN:` +MMMMs:` dMMMN/` ``:syo
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/yh` :syyyyyyyyyyyyyyyy+.`+syyyyyyyyo:` .oyys:` .oyys:` +yh
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-yh- ```````````````` ````````` `` `` oys
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-+h/------------------------::::::::://////++++++++++++++++++++++///////::::/yd:
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shdddddddddddddddddddddddddddddhhhhhhhhyyyyyssssssssssssssssyyyyyyyhhhhhhhddddh`
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S. Ponce, E. R. Margine, C. Verdi, and F. Giustino,
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Comput. Phys. Commun. 209, 116 (2016)
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Program EPW v.5.0.0 starts on 11Oct2018 at 14:45:59
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This program is part of the open-source Quantum ESPRESSO suite
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for quantum simulation of materials; please cite
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"P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009);
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"P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017);
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URL http://www.quantum-espresso.org",
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in publications or presentations arising from this work. More details at
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http://www.quantum-espresso.org/quote
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Parallel version (MPI), running on 1 processors
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MPI processes distributed on 1 nodes
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------------------------------------------------------------------------
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RESTART - RESTART - RESTART - RESTART
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Restart is done without reading PWSCF save file.
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Be aware that some consistency checks are therefore not done.
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------------------------------------------------------------------------
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--
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bravais-lattice index = 0
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lattice parameter (a_0) = 0.0000 a.u.
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unit-cell volume = 0.0000 (a.u.)^3
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number of atoms/cell = 0
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number of atomic types = 0
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kinetic-energy cut-off = 0.0000 Ry
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charge density cut-off = 0.0000 Ry
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convergence threshold = 0.0E+00
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beta = 0.0000
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number of iterations used = 0
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Exchange-correlation = not set (-1 -1 -1 -1-1-1)
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celldm(1)= 0.00000 celldm(2)= 0.00000 celldm(3)= 0.00000
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celldm(4)= 0.00000 celldm(5)= 0.00000 celldm(6)= 0.00000
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crystal axes: (cart. coord. in units of a_0)
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a(1) = ( 0.0000 0.0000 0.0000 )
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a(2) = ( 0.0000 0.0000 0.0000 )
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a(3) = ( 0.0000 0.0000 0.0000 )
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reciprocal axes: (cart. coord. in units 2 pi/a_0)
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b(1) = ( 0.0000 0.0000 0.0000 )
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b(2) = ( 0.0000 0.0000 0.0000 )
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b(3) = ( 0.0000 0.0000 0.0000 )
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Atoms inside the unit cell:
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Cartesian axes
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site n. atom mass positions (a_0 units)
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No symmetry!
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G cutoff = 0.0000 ( 0 G-vectors) FFT grid: ( 0, 0, 0)
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number of k points= 0
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cart. coord. in units 2pi/a_0
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EPW : 0.00s CPU 0.00s WALL
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EPW : 0.00s CPU 0.00s WALL
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No wavefunction gauge setting applied
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-------------------------------------------------------------------
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Using ./diam.ukk from disk
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-------------------------------------------------------------------
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Using kmap and kgmap from disk
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Do not need to read .epb files; read .fmt files
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Band disentanglement is used: nbndsub = 4
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Use zone-centred Wigner-Seitz cells
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Number of WS vectors for electrons 43
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Number of WS vectors for phonons 43
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Number of WS vectors for electron-phonon 43
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Results may improve by using use_ws == .true.
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Reading Hamiltonian, Dynamical matrix and EP vertex in Wann rep from file
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Finished reading Wann rep data from file
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===================================================================
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Memory usage: VmHWM = 14Mb
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VmPeak = 273Mb
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===================================================================
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Using q-mesh file: path.dat
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Size of q point mesh for interpolation: 201
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Using k-mesh file: path.dat
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Size of k point mesh for interpolation: 402
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Max number of k points per pool: 402
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Fermi energy coarse grid = 14.009584 eV
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===================================================================
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Fermi energy corresponds to the coarse k-mesh
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===================================================================
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ibndmin = 1 ebndmin = -0.069
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ibndmax = 4 ebndmax = 1.021
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Number of ep-matrix elements per pool : 19296 ~= 150.75 Kb (@ 8 bytes/ DP)
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===================================================================
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Electron (Imaginary) Self-Energy in the Migdal Approximation
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===================================================================
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Fermi Surface thickness = 15.000000 eV
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Golden Rule strictly enforced with T = 0.025852 eV
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Gaussian Broadening: 1.000000 eV, ngauss= 1
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Progression iq (fine) = 50/ 201
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Progression iq (fine) = 100/ 201
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Progression iq (fine) = 150/ 201
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Progression iq (fine) = 200/ 201
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Average over degenerate eigenstates is performed
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WARNING: only the eigenstates within the Fermi window are meaningful
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ik = 1 coord.: 0.5000000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.0314 eV Re[Sigma]= -92.999168 meV Im[Sigma]= 488.126519 meV Z= 1.264580 lam= -0.209223
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E( 2 )= -0.4915 eV Re[Sigma]= -6.737754 meV Im[Sigma]= 441.636541 meV Z= 1.213168 lam= -0.175712
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E( 3 )= 10.6149 eV Re[Sigma]= -63.562927 meV Im[Sigma]= 440.801323 meV Z= 1.183988 lam= -0.155397
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E( 4 )= 10.6149 eV Re[Sigma]= -63.562927 meV Im[Sigma]= 440.801323 meV Z= 1.183988 lam= -0.155397
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-------------------------------------------------------------------
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ik = 2 coord.: 0.4950000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.0404 eV Re[Sigma]= -104.300358 meV Im[Sigma]= 502.485245 meV Z= 1.276193 lam= -0.216420
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E( 2 )= -0.4805 eV Re[Sigma]= -2.768109 meV Im[Sigma]= 446.136161 meV Z= 1.220980 lam= -0.180986
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E( 3 )= 10.6158 eV Re[Sigma]= -59.640954 meV Im[Sigma]= 450.581536 meV Z= 1.196719 lam= -0.164382
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E( 4 )= 10.6158 eV Re[Sigma]= -59.640954 meV Im[Sigma]= 450.581536 meV Z= 1.196719 lam= -0.164382
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-------------------------------------------------------------------
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ik = 3 coord.: 0.4900000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.0668 eV Re[Sigma]= -121.824334 meV Im[Sigma]= 494.049012 meV Z= 1.265701 lam= -0.209924
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E( 2 )= -0.4481 eV Re[Sigma]= 6.495635 meV Im[Sigma]= 427.726505 meV Z= 1.207962 lam= -0.172160
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E( 3 )= 10.6184 eV Re[Sigma]= -55.206211 meV Im[Sigma]= 460.457486 meV Z= 1.210181 lam= -0.173678
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E( 4 )= 10.6184 eV Re[Sigma]= -55.206211 meV Im[Sigma]= 460.457486 meV Z= 1.210181 lam= -0.173678
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-------------------------------------------------------------------
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ik = 4 coord.: 0.4850000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.1086 eV Re[Sigma]= -142.720939 meV Im[Sigma]= 466.214417 meV Z= 1.238545 lam= -0.192601
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E( 2 )= -0.3962 eV Re[Sigma]= 18.477662 meV Im[Sigma]= 391.113810 meV Z= 1.179369 lam= -0.152089
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E( 3 )= 10.6228 eV Re[Sigma]= -50.224869 meV Im[Sigma]= 470.297844 meV Z= 1.224091 lam= -0.183067
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E( 4 )= 10.6228 eV Re[Sigma]= -50.224869 meV Im[Sigma]= 470.297844 meV Z= 1.224091 lam= -0.183067
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-------------------------------------------------------------------
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ik = 5 coord.: 0.4800000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.1632 eV Re[Sigma]= -163.859589 meV Im[Sigma]= 425.867076 meV Z= 1.203925 lam= -0.169383
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E( 2 )= -0.3275 eV Re[Sigma]= 30.269842 meV Im[Sigma]= 344.088876 meV Z= 1.143907 lam= -0.125803
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E( 3 )= 10.6289 eV Re[Sigma]= -44.675661 meV Im[Sigma]= 479.958869 meV Z= 1.238037 lam= -0.192270
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E( 4 )= 10.6289 eV Re[Sigma]= -44.675661 meV Im[Sigma]= 479.958869 meV Z= 1.238037 lam= -0.192270
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-------------------------------------------------------------------
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ik = 6 coord.: 0.4750000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.2281 eV Re[Sigma]= -183.035459 meV Im[Sigma]= 380.388470 meV Z= 1.169315 lam= -0.144798
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E( 2 )= -0.2445 eV Re[Sigma]= 39.817752 meV Im[Sigma]= 294.542857 meV Z= 1.108895 lam= -0.098201
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E( 3 )= 10.6367 eV Re[Sigma]= -38.555553 meV Im[Sigma]= 489.288097 meV Z= 1.251476 lam= -0.200944
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E( 4 )= 10.6367 eV Re[Sigma]= -38.555553 meV Im[Sigma]= 489.288097 meV Z= 1.251476 lam= -0.200944
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-------------------------------------------------------------------
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ik = 7 coord.: 0.4700000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.3010 eV Re[Sigma]= -199.240298 meV Im[Sigma]= 335.230841 meV Z= 1.138167 lam= -0.121394
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E( 2 )= -0.1496 eV Re[Sigma]= 46.250132 meV Im[Sigma]= 248.244767 meV Z= 1.078377 lam= -0.072680
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E( 3 )= 10.6463 eV Re[Sigma]= -31.885266 meV Im[Sigma]= 498.129368 meV Z= 1.263755 lam= -0.208708
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E( 4 )= 10.6463 eV Re[Sigma]= -31.885266 meV Im[Sigma]= 498.129368 meV Z= 1.263755 lam= -0.208708
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-------------------------------------------------------------------
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ik = 8 coord.: 0.4650000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.3799 eV Re[Sigma]= -212.261180 meV Im[Sigma]= 293.098160 meV Z= 1.110503 lam= -0.099507
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E( 2 )= -0.0448 eV Re[Sigma]= 49.598423 meV Im[Sigma]= 208.148854 meV Z= 1.053685 lam= -0.050950
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E( 3 )= 10.6576 eV Re[Sigma]= -24.713354 meV Im[Sigma]= 506.329142 meV Z= 1.274173 lam= -0.215177
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E( 4 )= 10.6576 eV Re[Sigma]= -24.713354 meV Im[Sigma]= 506.329142 meV Z= 1.274173 lam= -0.215177
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-------------------------------------------------------------------
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ik = 9 coord.: 0.4600000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.4632 eV Re[Sigma]= -222.135099 meV Im[Sigma]= 254.553696 meV Z= 1.084785 lam= -0.078159
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E( 2 )= 0.0686 eV Re[Sigma]= 50.355078 meV Im[Sigma]= 174.944085 meV Z= 1.034628 lam= -0.033469
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E( 3 )= 10.6706 eV Re[Sigma]= -17.117172 meV Im[Sigma]= 513.743899 meV Z= 1.282080 lam= -0.220017
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E( 4 )= 10.6706 eV Re[Sigma]= -17.117172 meV Im[Sigma]= 513.743899 meV Z= 1.282080 lam= -0.220017
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-------------------------------------------------------------------
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ik = 10 coord.: 0.4550000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.5499 eV Re[Sigma]= -228.852552 meV Im[Sigma]= 219.192538 meV Z= 1.060072 lam= -0.056668
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E( 2 )= 0.1891 eV Re[Sigma]= 49.176570 meV Im[Sigma]= 148.056053 meV Z= 1.020388 lam= -0.019980
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E( 3 )= 10.6853 eV Re[Sigma]= -9.201020 meV Im[Sigma]= 520.248250 meV Z= 1.286999 lam= -0.222999
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E( 4 )= 10.6853 eV Re[Sigma]= -9.201020 meV Im[Sigma]= 520.248250 meV Z= 1.286999 lam= -0.222999
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-------------------------------------------------------------------
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ik = 11 coord.: 0.4500000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.6391 eV Re[Sigma]= -232.422244 meV Im[Sigma]= 186.597079 meV Z= 1.037200 lam= -0.035866
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E( 2 )= 0.3160 eV Re[Sigma]= 46.693318 meV Im[Sigma]= 126.452893 meV Z= 1.009970 lam= -0.009871
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E( 3 )= 10.7016 eV Re[Sigma]= -1.088806 meV Im[Sigma]= 525.743217 meV Z= 1.288741 lam= -0.224049
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E( 4 )= 10.7016 eV Re[Sigma]= -1.088806 meV Im[Sigma]= 525.743217 meV Z= 1.288741 lam= -0.224049
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-------------------------------------------------------------------
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ik = 12 coord.: 0.4450000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.7300 eV Re[Sigma]= -233.087271 meV Im[Sigma]= 156.759852 meV Z= 1.017954 lam= -0.017638
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E( 2 )= 0.4486 eV Re[Sigma]= 43.401829 meV Im[Sigma]= 109.104788 meV Z= 1.002442 lam= -0.002436
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E( 3 )= 10.7196 eV Re[Sigma]= 7.088411 meV Im[Sigma]= 530.163957 meV Z= 1.287458 lam= -0.223276
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E( 4 )= 10.7196 eV Re[Sigma]= 7.088411 meV Im[Sigma]= 530.163957 meV Z= 1.287458 lam= -0.223276
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-------------------------------------------------------------------
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ik = 13 coord.: 0.4400000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.8223 eV Re[Sigma]= -231.392514 meV Im[Sigma]= 130.047773 meV Z= 1.003417 lam= -0.003405
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E( 2 )= 0.5863 eV Re[Sigma]= 39.667680 meV Im[Sigma]= 95.144621 meV Z= 0.997028 lam= 0.002981
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E( 3 )= 10.7392 eV Re[Sigma]= 15.205603 meV Im[Sigma]= 533.486143 meV Z= 1.283625 lam= -0.220956
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E( 4 )= 10.7392 eV Re[Sigma]= 15.205603 meV Im[Sigma]= 533.486143 meV Z= 1.283625 lam= -0.220956
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-------------------------------------------------------------------
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ik = 14 coord.: 0.4350000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -2.9156 eV Re[Sigma]= -228.027606 meV Im[Sigma]= 106.939443 meV Z= 0.993409 lam= 0.006635
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E( 2 )= 0.7288 eV Re[Sigma]= 35.742708 meV Im[Sigma]= 83.882542 meV Z= 0.993130 lam= 0.006917
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E( 3 )= 10.7605 eV Re[Sigma]= 23.156675 meV Im[Sigma]= 535.730173 meV Z= 1.277942 lam= -0.217492
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E( 4 )= 10.7605 eV Re[Sigma]= 23.156675 meV Im[Sigma]= 535.730173 meV Z= 1.277942 lam= -0.217492
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-------------------------------------------------------------------
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ik = 15 coord.: 0.4300000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.0096 eV Re[Sigma]= -223.632209 meV Im[Sigma]= 87.754279 meV Z= 0.987015 lam= 0.013156
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E( 2 )= 0.8756 eV Re[Sigma]= 31.791001 meV Im[Sigma]= 74.780197 meV Z= 0.990324 lam= 0.009771
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E( 3 )= 10.7833 eV Re[Sigma]= 30.864124 meV Im[Sigma]= 536.962490 meV Z= 1.271195 lam= -0.213338
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E( 4 )= 10.7833 eV Re[Sigma]= 30.864124 meV Im[Sigma]= 536.962490 meV Z= 1.271195 lam= -0.213338
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-------------------------------------------------------------------
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ik = 16 coord.: 0.4250000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.1040 eV Re[Sigma]= -218.696906 meV Im[Sigma]= 72.499112 meV Z= 0.983209 lam= 0.017078
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E( 2 )= 1.0267 eV Re[Sigma]= 27.915770 meV Im[Sigma]= 67.426628 meV Z= 0.988317 lam= 0.011821
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E( 3 )= 10.8076 eV Re[Sigma]= 38.283720 meV Im[Sigma]= 537.293485 meV Z= 1.264118 lam= -0.208935
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E( 4 )= 10.8076 eV Re[Sigma]= 38.283720 meV Im[Sigma]= 537.293485 meV Z= 1.264118 lam= -0.208935
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-------------------------------------------------------------------
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ik = 17 coord.: 0.4200000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.1987 eV Re[Sigma]= -213.553788 meV Im[Sigma]= 60.860037 meV Z= 0.981151 lam= 0.019211
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E( 2 )= 1.1816 eV Re[Sigma]= 24.183921 meV Im[Sigma]= 61.531245 meV Z= 0.986917 lam= 0.013256
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E( 3 )= 10.8335 eV Re[Sigma]= 45.404128 meV Im[Sigma]= 536.871802 meV Z= 1.257306 lam= -0.204648
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E( 4 )= 10.8335 eV Re[Sigma]= 45.404128 meV Im[Sigma]= 536.871802 meV Z= 1.257306 lam= -0.204648
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-------------------------------------------------------------------
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ik = 18 coord.: 0.4150000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.2937 eV Re[Sigma]= -208.406659 meV Im[Sigma]= 52.299027 meV Z= 0.980246 lam= 0.020152
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E( 2 )= 1.3404 eV Re[Sigma]= 20.648031 meV Im[Sigma]= 56.903836 meV Z= 0.985988 lam= 0.014211
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E( 3 )= 10.8608 eV Re[Sigma]= 52.242462 meV Im[Sigma]= 535.875249 meV Z= 1.251159 lam= -0.200741
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E( 4 )= 10.8608 eV Re[Sigma]= 52.242462 meV Im[Sigma]= 535.875249 meV Z= 1.251159 lam= -0.200741
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-------------------------------------------------------------------
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ik = 19 coord.: 0.4100000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.3887 eV Re[Sigma]= -203.377829 meV Im[Sigma]= 46.188532 meV Z= 0.980089 lam= 0.020315
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E( 2 )= 1.5028 eV Re[Sigma]= 17.343103 meV Im[Sigma]= 53.295549 meV Z= 0.985408 lam= 0.014808
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E( 3 )= 10.8897 eV Re[Sigma]= 58.836687 meV Im[Sigma]= 534.498932 meV Z= 1.245893 lam= -0.197363
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E( 4 )= 10.8897 eV Re[Sigma]= 58.836687 meV Im[Sigma]= 534.498932 meV Z= 1.245893 lam= -0.197363
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-------------------------------------------------------------------
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ik = 20 coord.: 0.4050000 0.0000000 0.0000000
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-------------------------------------------------------------------
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E( 1 )= -3.4838 eV Re[Sigma]= -198.548613 meV Im[Sigma]= 41.927448 meV Z= 0.980410 lam= 0.019981
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E( 2 )= 1.6686 eV Re[Sigma]= 14.264336 meV Im[Sigma]= 50.413638 meV Z= 0.985085 lam= 0.015141
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E( 3 )= 10.9199 eV Re[Sigma]= 65.236985 meV Im[Sigma]= 532.941620 meV Z= 1.241562 lam= -0.194563
|
|
E( 4 )= 10.9199 eV Re[Sigma]= 65.236985 meV Im[Sigma]= 532.941620 meV Z= 1.241562 lam= -0.194563
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 21 coord.: 0.4000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.5788 eV Re[Sigma]= -193.987698 meV Im[Sigma]= 39.010558 meV Z= 0.981020 lam= 0.019347
|
|
E( 2 )= 1.8378 eV Re[Sigma]= 11.351005 meV Im[Sigma]= 48.020635 meV Z= 0.984987 lam= 0.015242
|
|
E( 3 )= 10.9515 eV Re[Sigma]= 71.497637 meV Im[Sigma]= 531.391595 meV Z= 1.238101 lam= -0.192312
|
|
E( 4 )= 10.9515 eV Re[Sigma]= 71.497637 meV Im[Sigma]= 531.391595 meV Z= 1.238101 lam= -0.192312
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 22 coord.: 0.3950000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.6737 eV Re[Sigma]= -189.698135 meV Im[Sigma]= 37.051012 meV Z= 0.981808 lam= 0.018530
|
|
E( 2 )= 2.0103 eV Re[Sigma]= 8.613761 meV Im[Sigma]= 46.182834 meV Z= 0.985114 lam= 0.015110
|
|
E( 3 )= 10.9845 eV Re[Sigma]= 77.676008 meV Im[Sigma]= 530.013365 meV Z= 1.235367 lam= -0.190524
|
|
E( 4 )= 10.9845 eV Re[Sigma]= 77.676008 meV Im[Sigma]= 530.013365 meV Z= 1.235367 lam= -0.190524
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 23 coord.: 0.3900000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.7685 eV Re[Sigma]= -185.659197 meV Im[Sigma]= 35.770922 meV Z= 0.982705 lam= 0.017599
|
|
E( 2 )= 2.1858 eV Re[Sigma]= 6.096344 meV Im[Sigma]= 44.894617 meV Z= 0.985449 lam= 0.014766
|
|
E( 3 )= 11.0188 eV Re[Sigma]= 83.826281 meV Im[Sigma]= 528.936499 meV Z= 1.233172 lam= -0.189083
|
|
E( 4 )= 11.0188 eV Re[Sigma]= 83.826281 meV Im[Sigma]= 528.936499 meV Z= 1.233172 lam= -0.189083
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 24 coord.: 0.3850000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.8631 eV Re[Sigma]= -181.857388 meV Im[Sigma]= 34.977640 meV Z= 0.983663 lam= 0.016608
|
|
E( 2 )= 2.3644 eV Re[Sigma]= 3.822423 meV Im[Sigma]= 43.990257 meV Z= 0.985965 lam= 0.014235
|
|
E( 3 )= 11.0543 eV Re[Sigma]= 89.994498 meV Im[Sigma]= 528.247627 meV Z= 1.231319 lam= -0.187863
|
|
E( 4 )= 11.0543 eV Re[Sigma]= 89.994498 meV Im[Sigma]= 528.247627 meV Z= 1.231319 lam= -0.187863
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 25 coord.: 0.3800000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.9575 eV Re[Sigma]= -178.279117 meV Im[Sigma]= 34.538710 meV Z= 0.984648 lam= 0.015592
|
|
E( 2 )= 2.5459 eV Re[Sigma]= 1.807940 meV Im[Sigma]= 43.216525 meV Z= 0.986610 lam= 0.013571
|
|
E( 3 )= 11.0911 eV Re[Sigma]= 96.217670 meV Im[Sigma]= 527.986246 meV Z= 1.229619 lam= -0.186740
|
|
E( 4 )= 11.0911 eV Re[Sigma]= 96.217670 meV Im[Sigma]= 527.986246 meV Z= 1.229619 lam= -0.186740
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 26 coord.: 0.3750000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.0516 eV Re[Sigma]= -174.909507 meV Im[Sigma]= 34.361718 meV Z= 0.985636 lam= 0.014574
|
|
E( 2 )= 2.7301 eV Re[Sigma]= 0.053782 meV Im[Sigma]= 42.277500 meV Z= 0.987245 lam= 0.012919
|
|
E( 3 )= 11.1291 eV Re[Sigma]= 102.523420 meV Im[Sigma]= 528.144627 meV Z= 1.227909 lam= -0.185608
|
|
E( 4 )= 11.1291 eV Re[Sigma]= 102.523420 meV Im[Sigma]= 528.144627 meV Z= 1.227909 lam= -0.185608
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 27 coord.: 0.3700000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.1455 eV Re[Sigma]= -171.733234 meV Im[Sigma]= 34.380375 meV Z= 0.986611 lam= 0.013571
|
|
E( 2 )= 2.9170 eV Re[Sigma]= -1.485898 meV Im[Sigma]= 40.919019 meV Z= 0.987551 lam= 0.012606
|
|
E( 3 )= 11.1682 eV Re[Sigma]= 108.930076 meV Im[Sigma]= 528.671759 meV Z= 1.226055 lam= -0.184376
|
|
E( 4 )= 11.1682 eV Re[Sigma]= 108.930076 meV Im[Sigma]= 528.671759 meV Z= 1.226055 lam= -0.184376
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 28 coord.: 0.3650000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.2390 eV Re[Sigma]= -168.735278 meV Im[Sigma]= 34.545743 meV Z= 0.987565 lam= 0.012592
|
|
E( 2 )= 3.1065 eV Re[Sigma]= -2.950843 meV Im[Sigma]= 39.050020 meV Z= 0.987055 lam= 0.013115
|
|
E( 3 )= 11.2084 eV Re[Sigma]= 115.447043 meV Im[Sigma]= 529.481010 meV Z= 1.223958 lam= -0.182979
|
|
E( 4 )= 11.2084 eV Re[Sigma]= 115.447043 meV Im[Sigma]= 529.481010 meV Z= 1.223958 lam= -0.182979
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 29 coord.: 0.3600000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.3322 eV Re[Sigma]= -165.901391 meV Im[Sigma]= 34.820950 meV Z= 0.988490 lam= 0.011644
|
|
E( 2 )= 3.2984 eV Re[Sigma]= -4.577357 meV Im[Sigma]= 36.842046 meV Z= 0.985542 lam= 0.014670
|
|
E( 3 )= 11.2497 eV Re[Sigma]= 122.075189 meV Im[Sigma]= 530.460936 meV Z= 1.221550 lam= -0.181368
|
|
E( 4 )= 11.2497 eV Re[Sigma]= 122.075189 meV Im[Sigma]= 530.460936 meV Z= 1.221550 lam= -0.181368
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 30 coord.: 0.3550000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.4250 eV Re[Sigma]= -163.218361 meV Im[Sigma]= 35.177968 meV Z= 0.989385 lam= 0.010729
|
|
E( 2 )= 3.4925 eV Re[Sigma]= -6.571421 meV Im[Sigma]= 34.727321 meV Z= 0.983590 lam= 0.016683
|
|
E( 3 )= 11.2920 eV Re[Sigma]= 128.807033 meV Im[Sigma]= 531.488216 meV Z= 1.218790 lam= -0.179514
|
|
E( 4 )= 11.2920 eV Re[Sigma]= 128.807033 meV Im[Sigma]= 531.488216 meV Z= 1.218790 lam= -0.179514
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 31 coord.: 0.3500000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.5173 eV Re[Sigma]= -160.674149 meV Im[Sigma]= 35.595529 meV Z= 0.990247 lam= 0.009849
|
|
E( 2 )= 3.6889 eV Re[Sigma]= -8.931166 meV Im[Sigma]= 33.255705 meV Z= 0.982250 lam= 0.018070
|
|
E( 3 )= 11.3352 eV Re[Sigma]= 135.627005 meV Im[Sigma]= 532.441090 meV Z= 1.215663 lam= -0.177404
|
|
E( 4 )= 11.3352 eV Re[Sigma]= 135.627005 meV Im[Sigma]= 532.441090 meV Z= 1.215663 lam= -0.177404
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 32 coord.: 0.3450000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.6092 eV Re[Sigma]= -158.257929 meV Im[Sigma]= 36.057641 meV Z= 0.991079 lam= 0.009002
|
|
E( 2 )= 3.8873 eV Re[Sigma]= -11.427056 meV Im[Sigma]= 32.861786 meV Z= 0.982190 lam= 0.018133
|
|
E( 3 )= 11.3793 eV Re[Sigma]= 142.513002 meV Im[Sigma]= 533.210870 meV Z= 1.212193 lam= -0.175049
|
|
E( 4 )= 11.3793 eV Re[Sigma]= 142.513002 meV Im[Sigma]= 533.210870 meV Z= 1.212193 lam= -0.175049
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 33 coord.: 0.3400000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.7005 eV Re[Sigma]= -155.960083 meV Im[Sigma]= 36.552426 meV Z= 0.991880 lam= 0.008186
|
|
E( 2 )= 4.0875 eV Re[Sigma]= -13.740362 meV Im[Sigma]= 33.669779 meV Z= 0.983383 lam= 0.016898
|
|
E( 3 )= 11.4243 eV Re[Sigma]= 149.441245 meV Im[Sigma]= 533.708810 meV Z= 1.208464 lam= -0.172503
|
|
E( 4 )= 11.4243 eV Re[Sigma]= 149.441245 meV Im[Sigma]= 533.708810 meV Z= 1.208464 lam= -0.172503
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 34 coord.: 0.3350000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.7914 eV Re[Sigma]= -153.772121 meV Im[Sigma]= 37.071097 meV Z= 0.992655 lam= 0.007399
|
|
E( 2 )= 4.2895 eV Re[Sigma]= -15.629601 meV Im[Sigma]= 35.453505 meV Z= 0.985197 lam= 0.015026
|
|
E( 3 )= 11.4701 eV Re[Sigma]= 156.394327 meV Im[Sigma]= 533.866284 meV Z= 1.204616 lam= -0.169860
|
|
E( 4 )= 11.4701 eV Re[Sigma]= 156.394327 meV Im[Sigma]= 533.866284 meV Z= 1.204616 lam= -0.169860
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 35 coord.: 0.3300000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.8816 eV Re[Sigma]= -151.686045 meV Im[Sigma]= 37.606980 meV Z= 0.993407 lam= 0.006637
|
|
E( 2 )= 4.4931 eV Re[Sigma]= -17.040405 meV Im[Sigma]= 37.768440 meV Z= 0.986801 lam= 0.013375
|
|
E( 3 )= 11.5167 eV Re[Sigma]= 163.366970 meV Im[Sigma]= 533.628316 meV Z= 1.200796 lam= -0.167219
|
|
E( 4 )= 11.5167 eV Re[Sigma]= 163.366970 meV Im[Sigma]= 533.628316 meV Z= 1.200796 lam= -0.167219
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 36 coord.: 0.3250000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.9711 eV Re[Sigma]= -149.685030 meV Im[Sigma]= 38.154482 meV Z= 0.994142 lam= 0.005892
|
|
E( 2 )= 4.6981 eV Re[Sigma]= -18.061745 meV Im[Sigma]= 40.162460 meV Z= 0.987797 lam= 0.012353
|
|
E( 3 )= 11.5640 eV Re[Sigma]= 170.366149 meV Im[Sigma]= 532.943110 meV Z= 1.197092 lam= -0.164643
|
|
E( 4 )= 11.5640 eV Re[Sigma]= 170.366149 meV Im[Sigma]= 532.943110 meV Z= 1.197092 lam= -0.164643
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 37 coord.: 0.3200000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.0600 eV Re[Sigma]= -147.732955 meV Im[Sigma]= 38.707927 meV Z= 0.994875 lam= 0.005152
|
|
E( 2 )= 4.9045 eV Re[Sigma]= -18.784994 meV Im[Sigma]= 42.339333 meV Z= 0.988291 lam= 0.011848
|
|
E( 3 )= 11.6119 eV Re[Sigma]= 177.407630 meV Im[Sigma]= 531.752000 meV Z= 1.193538 lam= -0.162155
|
|
E( 4 )= 11.6119 eV Re[Sigma]= 177.407630 meV Im[Sigma]= 531.752000 meV Z= 1.193538 lam= -0.162155
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 38 coord.: 0.3150000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.1482 eV Re[Sigma]= -145.887777 meV Im[Sigma]= 39.260192 meV Z= 0.995585 lam= 0.004435
|
|
E( 2 )= 5.1119 eV Re[Sigma]= -19.364283 meV Im[Sigma]= 44.206643 meV Z= 0.988551 lam= 0.011582
|
|
E( 3 )= 11.6604 eV Re[Sigma]= 184.478135 meV Im[Sigma]= 529.983769 meV Z= 1.190140 lam= -0.159762
|
|
E( 4 )= 11.6604 eV Re[Sigma]= 184.478135 meV Im[Sigma]= 529.983769 meV Z= 1.190140 lam= -0.159762
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 39 coord.: 0.3100000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.2355 eV Re[Sigma]= -144.146362 meV Im[Sigma]= 39.801147 meV Z= 0.996276 lam= 0.003738
|
|
E( 2 )= 5.3204 eV Re[Sigma]= -19.827783 meV Im[Sigma]= 45.824943 meV Z= 0.988735 lam= 0.011394
|
|
E( 3 )= 11.7095 eV Re[Sigma]= 191.575043 meV Im[Sigma]= 527.554752 meV Z= 1.186885 lam= -0.157458
|
|
E( 4 )= 11.7095 eV Re[Sigma]= 191.575043 meV Im[Sigma]= 527.554752 meV Z= 1.186885 lam= -0.157458
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 40 coord.: 0.3050000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.3221 eV Re[Sigma]= -142.490038 meV Im[Sigma]= 40.315972 meV Z= 0.996953 lam= 0.003056
|
|
E( 2 )= 5.5296 eV Re[Sigma]= -20.160382 meV Im[Sigma]= 47.320658 meV Z= 0.988908 lam= 0.011217
|
|
E( 3 )= 11.7590 eV Re[Sigma]= 198.696281 meV Im[Sigma]= 524.373320 meV Z= 1.183747 lam= -0.155225
|
|
E( 4 )= 11.7590 eV Re[Sigma]= 198.696281 meV Im[Sigma]= 524.373320 meV Z= 1.183747 lam= -0.155225
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 41 coord.: 0.3000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.4077 eV Re[Sigma]= -140.910944 meV Im[Sigma]= 40.783573 meV Z= 0.997617 lam= 0.002388
|
|
E( 2 )= 5.7395 eV Re[Sigma]= -20.349756 meV Im[Sigma]= 48.816771 meV Z= 0.989096 lam= 0.011024
|
|
E( 3 )= 11.8091 eV Re[Sigma]= 205.832015 meV Im[Sigma]= 520.346036 meV Z= 1.180682 lam= -0.153032
|
|
E( 4 )= 11.8091 eV Re[Sigma]= 205.832015 meV Im[Sigma]= 520.346036 meV Z= 1.180682 lam= -0.153032
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 42 coord.: 0.2950000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.4925 eV Re[Sigma]= -139.403519 meV Im[Sigma]= 41.175490 meV Z= 0.998265 lam= 0.001738
|
|
E( 2 )= 5.9499 eV Re[Sigma]= -20.382136 meV Im[Sigma]= 50.401257 meV Z= 0.989311 lam= 0.010804
|
|
E( 3 )= 11.8595 eV Re[Sigma]= 212.965819 meV Im[Sigma]= 515.383595 meV Z= 1.177618 lam= -0.150828
|
|
E( 4 )= 11.8595 eV Re[Sigma]= 212.965819 meV Im[Sigma]= 515.383595 meV Z= 1.177618 lam= -0.150828
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 43 coord.: 0.2900000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.5762 eV Re[Sigma]= -137.962485 meV Im[Sigma]= 41.455812 meV Z= 0.998889 lam= 0.001112
|
|
E( 2 )= 6.1606 eV Re[Sigma]= -20.241947 meV Im[Sigma]= 52.126185 meV Z= 0.989562 lam= 0.010548
|
|
E( 3 )= 11.9102 eV Re[Sigma]= 220.073350 meV Im[Sigma]= 509.406425 meV Z= 1.174449 lam= -0.148537
|
|
E( 4 )= 11.9102 eV Re[Sigma]= 220.073350 meV Im[Sigma]= 509.406425 meV Z= 1.174449 lam= -0.148537
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 44 coord.: 0.2850000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.6589 eV Re[Sigma]= -136.581079 meV Im[Sigma]= 41.582664 meV Z= 0.999474 lam= 0.000526
|
|
E( 2 )= 6.3714 eV Re[Sigma]= -19.910641 meV Im[Sigma]= 54.021412 meV Z= 0.989858 lam= 0.010246
|
|
E( 3 )= 11.9612 eV Re[Sigma]= 227.120317 meV Im[Sigma]= 502.350904 meV Z= 1.171033 lam= -0.146053
|
|
E( 4 )= 11.9612 eV Re[Sigma]= 227.120317 meV Im[Sigma]= 502.350904 meV Z= 1.171033 lam= -0.146053
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 45 coord.: 0.2800000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.7406 eV Re[Sigma]= -135.250209 meV Im[Sigma]= 41.511701 meV Z= 0.999999 lam= 0.000001
|
|
E( 2 )= 6.5822 eV Re[Sigma]= -19.366130 meV Im[Sigma]= 56.109313 meV Z= 0.990211 lam= 0.009886
|
|
E( 3 )= 12.0125 eV Re[Sigma]= 234.059667 meV Im[Sigma]= 494.177077 meV Z= 1.167192 lam= -0.143243
|
|
E( 4 )= 12.0125 eV Re[Sigma]= 234.059667 meV Im[Sigma]= 494.177077 meV Z= 1.167192 lam= -0.143243
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 46 coord.: 0.2750000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.8211 eV Re[Sigma]= -133.957456 meV Im[Sigma]= 41.201656 meV Z= 1.000432 lam= -0.000431
|
|
E( 2 )= 6.7928 eV Re[Sigma]= -18.582415 meV Im[Sigma]= 58.409506 meV Z= 0.990636 lam= 0.009453
|
|
E( 3 )= 12.0639 eV Re[Sigma]= 240.828908 meV Im[Sigma]= 484.877762 meV Z= 1.162716 lam= -0.139945
|
|
E( 4 )= 12.0639 eV Re[Sigma]= 240.828908 meV Im[Sigma]= 484.877762 meV Z= 1.162716 lam= -0.139945
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 47 coord.: 0.2700000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.9005 eV Re[Sigma]= -132.684945 meV Im[Sigma]= 40.621424 meV Z= 1.000727 lam= -0.000726
|
|
E( 2 )= 7.0031 eV Re[Sigma]= -17.531394 meV Im[Sigma]= 60.915716 meV Z= 0.991138 lam= 0.008941
|
|
E( 3 )= 12.1154 eV Re[Sigma]= 247.348305 meV Im[Sigma]= 474.487931 meV Z= 1.157388 lam= -0.135985
|
|
E( 4 )= 12.1154 eV Re[Sigma]= 247.348305 meV Im[Sigma]= 474.487931 meV Z= 1.157388 lam= -0.135985
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 48 coord.: 0.2650000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.9786 eV Re[Sigma]= -131.407568 meV Im[Sigma]= 39.757515 meV Z= 1.000833 lam= -0.000832
|
|
E( 2 )= 7.2127 eV Re[Sigma]= -16.192075 meV Im[Sigma]= 63.512920 meV Z= 0.991691 lam= 0.008379
|
|
E( 3 )= 12.1670 eV Re[Sigma]= 253.521101 meV Im[Sigma]= 463.092664 meV Z= 1.151015 lam= -0.131202
|
|
E( 4 )= 12.1670 eV Re[Sigma]= 253.521101 meV Im[Sigma]= 463.092664 meV Z= 1.151015 lam= -0.131202
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 49 coord.: 0.2600000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.0555 eV Re[Sigma]= -130.095015 meV Im[Sigma]= 38.620220 meV Z= 1.000696 lam= -0.000696
|
|
E( 2 )= 7.4217 eV Re[Sigma]= -14.579771 meV Im[Sigma]= 65.844330 meV Z= 0.992178 lam= 0.007884
|
|
E( 3 )= 12.2187 eV Re[Sigma]= 259.236033 meV Im[Sigma]= 450.831874 meV Z= 1.143487 lam= -0.125482
|
|
E( 4 )= 12.2187 eV Re[Sigma]= 259.236033 meV Im[Sigma]= 450.831874 meV Z= 1.143487 lam= -0.125482
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 50 coord.: 0.2550000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.1311 eV Re[Sigma]= -128.708130 meV Im[Sigma]= 37.246723 meV Z= 1.000287 lam= -0.000287
|
|
E( 2 )= 7.6298 eV Re[Sigma]= -12.799493 meV Im[Sigma]= 67.322035 meV Z= 0.992370 lam= 0.007689
|
|
E( 3 )= 12.2703 eV Re[Sigma]= 264.376830 meV Im[Sigma]= 437.900363 meV Z= 1.134832 lam= -0.118812
|
|
E( 4 )= 12.2703 eV Re[Sigma]= 264.376830 meV Im[Sigma]= 437.900363 meV Z= 1.134832 lam= -0.118812
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 51 coord.: 0.2500000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.2054 eV Re[Sigma]= -127.210651 meV Im[Sigma]= 35.699856 meV Z= 0.999624 lam= 0.000376
|
|
E( 2 )= 7.8368 eV Re[Sigma]= -11.109831 meV Im[Sigma]= 67.543659 meV Z= 0.992041 lam= 0.008023
|
|
E( 3 )= 12.3218 eV Re[Sigma]= 268.833385 meV Im[Sigma]= 424.542382 meV Z= 1.125264 lam= -0.111320
|
|
E( 4 )= 12.3218 eV Re[Sigma]= 268.833385 meV Im[Sigma]= 424.542382 meV Z= 1.125264 lam= -0.111320
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 52 coord.: 0.2450000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.2783 eV Re[Sigma]= -125.573570 meV Im[Sigma]= 34.062137 meV Z= 0.998795 lam= 0.001206
|
|
E( 2 )= 8.0426 eV Re[Sigma]= -9.831620 meV Im[Sigma]= 66.811303 meV Z= 0.991447 lam= 0.008627
|
|
E( 3 )= 12.3732 eV Re[Sigma]= 272.519319 meV Im[Sigma]= 411.040695 meV Z= 1.115195 lam= -0.103296
|
|
E( 4 )= 12.3732 eV Re[Sigma]= 272.519319 meV Im[Sigma]= 411.040695 meV Z= 1.115195 lam= -0.103296
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 53 coord.: 0.2400000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.3498 eV Re[Sigma]= -123.783970 meV Im[Sigma]= 32.425946 meV Z= 0.997941 lam= 0.002063
|
|
E( 2 )= 8.2470 eV Re[Sigma]= -8.979754 meV Im[Sigma]= 65.941700 meV Z= 0.991074 lam= 0.009006
|
|
E( 3 )= 12.4244 eV Re[Sigma]= 275.388027 meV Im[Sigma]= 397.701009 meV Z= 1.105169 lam= -0.095161
|
|
E( 4 )= 12.4244 eV Re[Sigma]= 275.388027 meV Im[Sigma]= 397.701009 meV Z= 1.105169 lam= -0.095161
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 54 coord.: 0.2350000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.4198 eV Re[Sigma]= -121.854509 meV Im[Sigma]= 30.881773 meV Z= 0.997208 lam= 0.002800
|
|
E( 2 )= 8.4498 eV Re[Sigma]= -8.402492 meV Im[Sigma]= 65.482292 meV Z= 0.990180 lam= 0.009917
|
|
E( 3 )= 12.4753 eV Re[Sigma]= 277.441275 meV Im[Sigma]= 384.833414 meV Z= 1.095767 lam= -0.087397
|
|
E( 4 )= 12.4753 eV Re[Sigma]= 277.441275 meV Im[Sigma]= 384.833414 meV Z= 1.095767 lam= -0.087397
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 55 coord.: 0.2300000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.4884 eV Re[Sigma]= -119.813737 meV Im[Sigma]= 29.506999 meV Z= 0.996691 lam= 0.003320
|
|
E( 2 )= 8.6509 eV Re[Sigma]= -8.167178 meV Im[Sigma]= 65.455539 meV Z= 0.988501 lam= 0.011632
|
|
E( 3 )= 12.5260 eV Re[Sigma]= 278.731217 meV Im[Sigma]= 372.732948 meV Z= 1.087478 lam= -0.080441
|
|
E( 4 )= 12.5260 eV Re[Sigma]= 278.731217 meV Im[Sigma]= 372.732948 meV Z= 1.087478 lam= -0.080441
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 56 coord.: 0.2250000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.5554 eV Re[Sigma]= -117.697765 meV Im[Sigma]= 28.357508 meV Z= 0.996419 lam= 0.003594
|
|
E( 2 )= 8.8501 eV Re[Sigma]= -8.337698 meV Im[Sigma]= 65.842590 meV Z= 0.986820 lam= 0.013356
|
|
E( 3 )= 12.5763 eV Re[Sigma]= 279.350779 meV Im[Sigma]= 361.661583 meV Z= 1.080625 lam= -0.074610
|
|
E( 4 )= 12.5763 eV Re[Sigma]= 279.350779 meV Im[Sigma]= 361.661583 meV Z= 1.080625 lam= -0.074610
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 57 coord.: 0.2200000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.6209 eV Re[Sigma]= -115.545433 meV Im[Sigma]= 27.463587 meV Z= 0.996366 lam= 0.003648
|
|
E( 2 )= 9.0473 eV Re[Sigma]= -8.814840 meV Im[Sigma]= 66.943538 meV Z= 0.985762 lam= 0.014444
|
|
E( 3 )= 12.6263 eV Re[Sigma]= 279.416714 meV Im[Sigma]= 351.833666 meV Z= 1.075339 lam= -0.070061
|
|
E( 4 )= 12.6263 eV Re[Sigma]= 279.416714 meV Im[Sigma]= 351.833666 meV Z= 1.075339 lam= -0.070061
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 58 coord.: 0.2150000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.6849 eV Re[Sigma]= -113.386957 meV Im[Sigma]= 26.830406 meV Z= 0.996483 lam= 0.003530
|
|
E( 2 )= 9.2422 eV Re[Sigma]= -9.425314 meV Im[Sigma]= 69.255803 meV Z= 0.985421 lam= 0.014794
|
|
E( 3 )= 12.6758 eV Re[Sigma]= 279.054536 meV Im[Sigma]= 343.406286 meV Z= 1.071589 lam= -0.066806
|
|
E( 4 )= 12.6758 eV Re[Sigma]= 279.054536 meV Im[Sigma]= 343.406286 meV Z= 1.071589 lam= -0.066806
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 59 coord.: 0.2100000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.7473 eV Re[Sigma]= -111.243249 meV Im[Sigma]= 26.442253 meV Z= 0.996720 lam= 0.003291
|
|
E( 2 )= 9.4348 eV Re[Sigma]= -10.015882 meV Im[Sigma]= 73.228329 meV Z= 0.985705 lam= 0.014502
|
|
E( 3 )= 12.7249 eV Re[Sigma]= 278.384843 meV Im[Sigma]= 336.475277 meV Z= 1.069235 lam= -0.064752
|
|
E( 4 )= 12.7249 eV Re[Sigma]= 278.384843 meV Im[Sigma]= 336.475277 meV Z= 1.069235 lam= -0.064752
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 60 coord.: 0.2050000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.8081 eV Re[Sigma]= -109.131535 meV Im[Sigma]= 26.269006 meV Z= 0.997034 lam= 0.002974
|
|
E( 2 )= 9.6249 eV Re[Sigma]= -10.464346 meV Im[Sigma]= 79.159581 meV Z= 0.986607 lam= 0.013575
|
|
E( 3 )= 12.7734 eV Re[Sigma]= 277.513383 meV Im[Sigma]= 331.076732 meV Z= 1.068088 lam= -0.063747
|
|
E( 4 )= 12.7734 eV Re[Sigma]= 277.513383 meV Im[Sigma]= 331.076732 meV Z= 1.068088 lam= -0.063747
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 61 coord.: 0.2000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.8672 eV Re[Sigma]= -107.061536 meV Im[Sigma]= 26.273139 meV Z= 0.997395 lam= 0.002611
|
|
E( 2 )= 9.8124 eV Re[Sigma]= -10.647104 meV Im[Sigma]= 87.199060 meV Z= 0.988286 lam= 0.011853
|
|
E( 3 )= 12.8214 eV Re[Sigma]= 276.528717 meV Im[Sigma]= 327.193263 meV Z= 1.067944 lam= -0.063621
|
|
E( 4 )= 12.8214 eV Re[Sigma]= 276.528717 meV Im[Sigma]= 327.193263 meV Z= 1.067944 lam= -0.063621
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 62 coord.: 0.1950000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.9248 eV Re[Sigma]= -105.037168 meV Im[Sigma]= 26.415869 meV Z= 0.997782 lam= 0.002223
|
|
E( 2 )= 9.9970 eV Re[Sigma]= -10.406475 meV Im[Sigma]= 97.345574 meV Z= 0.991050 lam= 0.009030
|
|
E( 3 )= 12.8687 eV Re[Sigma]= 275.501892 meV Im[Sigma]= 324.763712 meV Z= 1.068618 lam= -0.064212
|
|
E( 4 )= 12.8687 eV Re[Sigma]= 275.501892 meV Im[Sigma]= 324.763712 meV Z= 1.068618 lam= -0.064212
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 63 coord.: 0.1900000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.9806 eV Re[Sigma]= -103.063322 meV Im[Sigma]= 26.661631 meV Z= 0.998179 lam= 0.001824
|
|
E( 2 )= 10.1787 eV Re[Sigma]= -9.533227 meV Im[Sigma]= 109.414583 meV Z= 0.995283 lam= 0.004740
|
|
E( 3 )= 12.9154 eV Re[Sigma]= 274.486473 meV Im[Sigma]= 323.694851 meV Z= 1.069949 lam= -0.065376
|
|
E( 4 )= 12.9154 eV Re[Sigma]= 274.486473 meV Im[Sigma]= 323.694851 meV Z= 1.069949 lam= -0.065376
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 64 coord.: 0.1850000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.0349 eV Re[Sigma]= -101.141740 meV Im[Sigma]= 26.980647 meV Z= 0.998579 lam= 0.001423
|
|
E( 2 )= 10.3573 eV Re[Sigma]= -7.775003 meV Im[Sigma]= 123.012370 meV Z= 1.001232 lam= -0.001230
|
|
E( 3 )= 12.9614 eV Re[Sigma]= 273.522386 meV Im[Sigma]= 323.873655 meV Z= 1.071808 lam= -0.066997
|
|
E( 4 )= 12.9614 eV Re[Sigma]= 273.522386 meV Im[Sigma]= 323.873655 meV Z= 1.071808 lam= -0.066997
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 65 coord.: 0.1800000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.0875 eV Re[Sigma]= -99.270757 meV Im[Sigma]= 27.349836 meV Z= 0.998976 lam= 0.001025
|
|
E( 2 )= 10.5327 eV Re[Sigma]= -4.895372 meV Im[Sigma]= 137.562585 meV Z= 1.008692 lam= -0.008617
|
|
E( 3 )= 13.0067 eV Re[Sigma]= 272.638882 meV Im[Sigma]= 325.178885 meV Z= 1.074092 lam= -0.068981
|
|
E( 4 )= 13.0067 eV Re[Sigma]= 272.638882 meV Im[Sigma]= 325.178885 meV Z= 1.074092 lam= -0.068981
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 66 coord.: 0.1750000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.1384 eV Re[Sigma]= -97.451771 meV Im[Sigma]= 27.752537 meV Z= 0.999367 lam= 0.000634
|
|
E( 2 )= 10.7047 eV Re[Sigma]= -0.779082 meV Im[Sigma]= 152.400594 meV Z= 1.016795 lam= -0.016518
|
|
E( 3 )= 13.0512 eV Re[Sigma]= 271.855196 meV Im[Sigma]= 327.491079 meV Z= 1.076725 lam= -0.071257
|
|
E( 4 )= 13.0512 eV Re[Sigma]= 271.855196 meV Im[Sigma]= 327.491079 meV Z= 1.076725 lam= -0.071257
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 67 coord.: 0.1700000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.1876 eV Re[Sigma]= -95.684661 meV Im[Sigma]= 28.177553 meV Z= 0.999750 lam= 0.000250
|
|
E( 2 )= 10.8733 eV Re[Sigma]= 4.485352 meV Im[Sigma]= 166.913212 meV Z= 1.024291 lam= -0.023715
|
|
E( 3 )= 13.0949 eV Re[Sigma]= 271.183886 meV Im[Sigma]= 330.700314 meV Z= 1.079649 lam= -0.073773
|
|
E( 4 )= 13.0949 eV Re[Sigma]= 271.183886 meV Im[Sigma]= 330.700314 meV Z= 1.079649 lam= -0.073773
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 68 coord.: 0.1650000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.2352 eV Re[Sigma]= -93.966446 meV Im[Sigma]= 28.617966 meV Z= 1.000126 lam= -0.000126
|
|
E( 2 )= 11.0383 eV Re[Sigma]= 10.620662 meV Im[Sigma]= 180.676562 meV Z= 1.030240 lam= -0.029352
|
|
E( 3 )= 13.1377 eV Re[Sigma]= 270.632956 meV Im[Sigma]= 334.711381 meV Z= 1.082825 lam= -0.076490
|
|
E( 4 )= 13.1377 eV Re[Sigma]= 270.632956 meV Im[Sigma]= 334.711381 meV Z= 1.082825 lam= -0.076490
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 69 coord.: 0.1600000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.2811 eV Re[Sigma]= -92.297954 meV Im[Sigma]= 29.069983 meV Z= 1.000495 lam= -0.000495
|
|
E( 2 )= 11.1995 eV Re[Sigma]= 17.266561 meV Im[Sigma]= 193.542208 meV Z= 1.034438 lam= -0.033292
|
|
E( 3 )= 13.1797 eV Re[Sigma]= 270.205215 meV Im[Sigma]= 339.446302 meV Z= 1.086227 lam= -0.079382
|
|
E( 4 )= 13.1797 eV Re[Sigma]= 270.205215 meV Im[Sigma]= 339.446302 meV Z= 1.086227 lam= -0.079382
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 70 coord.: 0.1550000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.3253 eV Re[Sigma]= -90.678658 meV Im[Sigma]= 29.531976 meV Z= 1.000857 lam= -0.000857
|
|
E( 2 )= 11.3569 eV Re[Sigma]= 24.098342 meV Im[Sigma]= 205.641197 meV Z= 1.037314 lam= -0.035971
|
|
E( 3 )= 13.2207 eV Re[Sigma]= 269.900633 meV Im[Sigma]= 344.844335 meV Z= 1.089837 lam= -0.082431
|
|
E( 4 )= 13.2207 eV Re[Sigma]= 269.900633 meV Im[Sigma]= 344.844335 meV Z= 1.089837 lam= -0.082431
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 71 coord.: 0.1500000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.3679 eV Re[Sigma]= -89.105427 meV Im[Sigma]= 30.003752 meV Z= 1.001215 lam= -0.001213
|
|
E( 2 )= 11.5104 eV Re[Sigma]= 30.900687 meV Im[Sigma]= 217.307942 meV Z= 1.039629 lam= -0.038118
|
|
E( 3 )= 13.2607 eV Re[Sigma]= 269.717474 meV Im[Sigma]= 350.859873 meV Z= 1.093648 lam= -0.085629
|
|
E( 4 )= 13.2607 eV Re[Sigma]= 269.717474 meV Im[Sigma]= 350.859873 meV Z= 1.093648 lam= -0.085629
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 72 coord.: 0.1450000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.4089 eV Re[Sigma]= -87.579442 meV Im[Sigma]= 30.486033 meV Z= 1.001569 lam= -0.001566
|
|
E( 2 )= 11.6598 eV Re[Sigma]= 37.593265 meV Im[Sigma]= 228.955769 meV Z= 1.042209 lam= -0.040499
|
|
E( 3 )= 13.2998 eV Re[Sigma]= 269.650770 meV Im[Sigma]= 357.458873 meV Z= 1.097661 lam= -0.088972
|
|
E( 4 )= 13.2998 eV Re[Sigma]= 269.650770 meV Im[Sigma]= 357.458873 meV Z= 1.097661 lam= -0.088972
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 73 coord.: 0.1400000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.4482 eV Re[Sigma]= -86.099718 meV Im[Sigma]= 30.980112 meV Z= 1.001920 lam= -0.001916
|
|
E( 2 )= 11.8051 eV Re[Sigma]= 44.212923 meV Im[Sigma]= 240.949749 meV Z= 1.045667 lam= -0.043672
|
|
E( 3 )= 13.3378 eV Re[Sigma]= 269.694439 meV Im[Sigma]= 364.614631 meV Z= 1.101881 lam= -0.092461
|
|
E( 4 )= 13.3378 eV Re[Sigma]= 269.694439 meV Im[Sigma]= 364.614631 meV Z= 1.101881 lam= -0.092461
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 74 coord.: 0.1350000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.4859 eV Re[Sigma]= -84.663454 meV Im[Sigma]= 31.487626 meV Z= 1.002271 lam= -0.002266
|
|
E( 2 )= 11.9461 eV Re[Sigma]= 50.857024 meV Im[Sigma]= 253.515676 meV Z= 1.050275 lam= -0.047869
|
|
E( 3 )= 13.3748 eV Re[Sigma]= 269.841489 meV Im[Sigma]= 372.303763 meV Z= 1.106319 lam= -0.096101
|
|
E( 4 )= 13.3748 eV Re[Sigma]= 269.841489 meV Im[Sigma]= 372.303763 meV Z= 1.106319 lam= -0.096101
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 75 coord.: 0.1300000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5220 eV Re[Sigma]= -83.272432 meV Im[Sigma]= 32.010402 meV Z= 1.002624 lam= -0.002617
|
|
E( 2 )= 12.0828 eV Re[Sigma]= 57.625686 meV Im[Sigma]= 266.703512 meV Z= 1.056048 lam= -0.053073
|
|
E( 3 )= 13.4107 eV Re[Sigma]= 270.082231 meV Im[Sigma]= 380.503136 meV Z= 1.110991 lam= -0.099903
|
|
E( 4 )= 13.4107 eV Re[Sigma]= 270.082231 meV Im[Sigma]= 380.503136 meV Z= 1.110991 lam= -0.099903
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 76 coord.: 0.1250000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5565 eV Re[Sigma]= -81.924731 meV Im[Sigma]= 32.550366 meV Z= 1.002979 lam= -0.002970
|
|
E( 2 )= 12.2150 eV Re[Sigma]= 64.594630 meV Im[Sigma]= 280.401580 meV Z= 1.062882 lam= -0.059162
|
|
E( 3 )= 13.4455 eV Re[Sigma]= 270.406693 meV Im[Sigma]= 389.188247 meV Z= 1.115919 lam= -0.103877
|
|
E( 4 )= 13.4455 eV Re[Sigma]= 270.406693 meV Im[Sigma]= 389.188247 meV Z= 1.115919 lam= -0.103877
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 77 coord.: 0.1200000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5895 eV Re[Sigma]= -80.618568 meV Im[Sigma]= 33.109469 meV Z= 1.003338 lam= -0.003327
|
|
E( 2 )= 12.3427 eV Re[Sigma]= 71.807066 meV Im[Sigma]= 294.383749 meV Z= 1.070647 lam= -0.065985
|
|
E( 3 )= 13.4792 eV Re[Sigma]= 270.803611 meV Im[Sigma]= 398.333147 meV Z= 1.121127 lam= -0.108040
|
|
E( 4 )= 13.4792 eV Re[Sigma]= 270.803611 meV Im[Sigma]= 398.333147 meV Z= 1.121127 lam= -0.108040
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 78 coord.: 0.1150000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6208 eV Re[Sigma]= -79.355859 meV Im[Sigma]= 33.689639 meV Z= 1.003704 lam= -0.003690
|
|
E( 2 )= 12.4658 eV Re[Sigma]= 79.275380 meV Im[Sigma]= 308.368637 meV Z= 1.079208 lam= -0.073395
|
|
E( 3 )= 13.5116 eV Re[Sigma]= 271.259317 meV Im[Sigma]= 407.911678 meV Z= 1.126643 lam= -0.112407
|
|
E( 4 )= 13.5116 eV Re[Sigma]= 271.259317 meV Im[Sigma]= 407.911678 meV Z= 1.126643 lam= -0.112407
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 79 coord.: 0.1100000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6507 eV Re[Sigma]= -78.133515 meV Im[Sigma]= 34.292738 meV Z= 1.004078 lam= -0.004061
|
|
E( 2 )= 12.5842 eV Re[Sigma]= 86.988402 meV Im[Sigma]= 322.074409 meV Z= 1.088422 lam= -0.081239
|
|
E( 3 )= 13.5429 eV Re[Sigma]= 271.760276 meV Im[Sigma]= 417.899463 meV Z= 1.132498 lam= -0.116996
|
|
E( 4 )= 13.5429 eV Re[Sigma]= 271.760276 meV Im[Sigma]= 417.899463 meV Z= 1.132498 lam= -0.116996
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 80 coord.: 0.1050000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6790 eV Re[Sigma]= -76.951788 meV Im[Sigma]= 34.920531 meV Z= 1.004460 lam= -0.004441
|
|
E( 2 )= 12.6978 eV Re[Sigma]= 94.912972 meV Im[Sigma]= 335.260078 meV Z= 1.098132 lam= -0.089362
|
|
E( 3 )= 13.5730 eV Re[Sigma]= 272.290753 meV Im[Sigma]= 428.276019 meV Z= 1.138724 lam= -0.121824
|
|
E( 4 )= 13.5730 eV Re[Sigma]= 272.290753 meV Im[Sigma]= 428.276019 meV Z= 1.138724 lam= -0.121824
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 81 coord.: 0.1000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7058 eV Re[Sigma]= -75.811202 meV Im[Sigma]= 35.574659 meV Z= 1.004854 lam= -0.004830
|
|
E( 2 )= 12.8066 eV Re[Sigma]= 102.997973 meV Im[Sigma]= 347.750731 meV Z= 1.108157 lam= -0.097601
|
|
E( 3 )= 13.6018 eV Re[Sigma]= 272.833655 meV Im[Sigma]= 439.026380 meV Z= 1.145354 lam= -0.126907
|
|
E( 4 )= 13.6018 eV Re[Sigma]= 272.833655 meV Im[Sigma]= 439.026380 meV Z= 1.145354 lam= -0.126907
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 82 coord.: 0.0950000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7311 eV Re[Sigma]= -74.708581 meV Im[Sigma]= 36.256617 meV Z= 1.005260 lam= -0.005232
|
|
E( 2 )= 12.9105 eV Re[Sigma]= 111.178563 meV Im[Sigma]= 359.448180 meV Z= 1.118301 lam= -0.105786
|
|
E( 3 )= 13.6293 eV Re[Sigma]= 273.371849 meV Im[Sigma]= 450.141841 meV Z= 1.152419 lam= -0.132260
|
|
E( 4 )= 13.6293 eV Re[Sigma]= 273.371849 meV Im[Sigma]= 450.141841 meV Z= 1.152419 lam= -0.132260
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 83 coord.: 0.0900000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7550 eV Re[Sigma]= -73.646192 meV Im[Sigma]= 36.967740 meV Z= 1.005679 lam= -0.005647
|
|
E( 2 )= 13.0095 eV Re[Sigma]= 119.376785 meV Im[Sigma]= 370.330374 meV Z= 1.128360 lam= -0.113758
|
|
E( 3 )= 13.6556 eV Re[Sigma]= 273.885609 meV Im[Sigma]= 461.619665 meV Z= 1.159950 lam= -0.137894
|
|
E( 4 )= 13.6556 eV Re[Sigma]= 273.885609 meV Im[Sigma]= 461.619665 meV Z= 1.159950 lam= -0.137894
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 84 coord.: 0.0850000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7774 eV Re[Sigma]= -72.621644 meV Im[Sigma]= 37.709188 meV Z= 1.006112 lam= -0.006075
|
|
E( 2 )= 13.1034 eV Re[Sigma]= 127.508262 meV Im[Sigma]= 380.443238 meV Z= 1.138140 lam= -0.121373
|
|
E( 3 )= 13.6806 eV Re[Sigma]= 274.355619 meV Im[Sigma]= 473.461860 meV Z= 1.167973 lam= -0.143816
|
|
E( 4 )= 13.6806 eV Re[Sigma]= 274.355619 meV Im[Sigma]= 473.461860 meV Z= 1.167973 lam= -0.143816
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 85 coord.: 0.0800000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7985 eV Re[Sigma]= -71.634468 meV Im[Sigma]= 38.481946 meV Z= 1.006562 lam= -0.006519
|
|
E( 2 )= 13.1922 eV Re[Sigma]= 135.484584 meV Im[Sigma]= 389.888191 meV Z= 1.147480 lam= -0.128525
|
|
E( 3 )= 13.7042 eV Re[Sigma]= 274.761301 meV Im[Sigma]= 485.673307 meV Z= 1.176513 lam= -0.150030
|
|
E( 4 )= 13.7042 eV Re[Sigma]= 274.761301 meV Im[Sigma]= 485.673307 meV Z= 1.176513 lam= -0.150030
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 86 coord.: 0.0750000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8181 eV Re[Sigma]= -70.685701 meV Im[Sigma]= 39.286824 meV Z= 1.007027 lam= -0.006978
|
|
E( 2 )= 13.2760 eV Re[Sigma]= 143.217601 meV Im[Sigma]= 398.807936 meV Z= 1.156271 lam= -0.135151
|
|
E( 3 )= 13.7265 eV Re[Sigma]= 275.080964 meV Im[Sigma]= 498.259612 meV Z= 1.185592 lam= -0.156539
|
|
E( 4 )= 13.7265 eV Re[Sigma]= 275.080964 meV Im[Sigma]= 498.259612 meV Z= 1.185592 lam= -0.156539
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 87 coord.: 0.0700000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8363 eV Re[Sigma]= -69.772071 meV Im[Sigma]= 40.124458 meV Z= 1.007511 lam= -0.007455
|
|
E( 2 )= 13.3545 eV Re[Sigma]= 150.625019 meV Im[Sigma]= 407.372369 meV Z= 1.164470 lam= -0.141240
|
|
E( 3 )= 13.7474 eV Re[Sigma]= 275.293699 meV Im[Sigma]= 511.225035 meV Z= 1.195231 lam= -0.163342
|
|
E( 4 )= 13.7474 eV Re[Sigma]= 275.293699 meV Im[Sigma]= 511.225035 meV Z= 1.195231 lam= -0.163342
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 88 coord.: 0.0650000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8532 eV Re[Sigma]= -68.896348 meV Im[Sigma]= 40.995327 meV Z= 1.008012 lam= -0.007948
|
|
E( 2 )= 13.4278 eV Re[Sigma]= 157.630355 meV Im[Sigma]= 415.765850 meV Z= 1.172110 lam= -0.146837
|
|
E( 3 )= 13.7669 eV Re[Sigma]= 275.376541 meV Im[Sigma]= 524.570766 meV Z= 1.205452 lam= -0.170436
|
|
E( 4 )= 13.7669 eV Re[Sigma]= 275.376541 meV Im[Sigma]= 524.570766 meV Z= 1.205452 lam= -0.170436
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 89 coord.: 0.0600000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8688 eV Re[Sigma]= -68.056257 meV Im[Sigma]= 41.899762 meV Z= 1.008532 lam= -0.008460
|
|
E( 2 )= 13.4958 eV Re[Sigma]= 164.167776 meV Im[Sigma]= 424.176488 meV Z= 1.179291 lam= -0.152033
|
|
E( 3 )= 13.7851 eV Re[Sigma]= 275.307828 meV Im[Sigma]= 538.293743 meV Z= 1.216276 lam= -0.177818
|
|
E( 4 )= 13.7851 eV Re[Sigma]= 275.307828 meV Im[Sigma]= 538.293743 meV Z= 1.216276 lam= -0.177818
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 90 coord.: 0.0550000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8830 eV Re[Sigma]= -67.251421 meV Im[Sigma]= 42.837969 meV Z= 1.009071 lam= -0.008990
|
|
E( 2 )= 13.5586 eV Re[Sigma]= 170.180705 meV Im[Sigma]= 432.787701 meV Z= 1.186178 lam= -0.156956
|
|
E( 3 )= 13.8019 eV Re[Sigma]= 275.065581 meV Im[Sigma]= 552.386030 meV Z= 1.227723 lam= -0.185484
|
|
E( 4 )= 13.8019 eV Re[Sigma]= 275.065581 meV Im[Sigma]= 552.386030 meV Z= 1.227723 lam= -0.185484
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 91 coord.: 0.0500000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8960 eV Re[Sigma]= -66.480986 meV Im[Sigma]= 43.810051 meV Z= 1.009631 lam= -0.009539
|
|
E( 2 )= 13.6160 eV Re[Sigma]= 175.621307 meV Im[Sigma]= 441.771939 meV Z= 1.192978 lam= -0.161762
|
|
E( 3 )= 13.8172 eV Re[Sigma]= 274.628392 meV Im[Sigma]= 566.834736 meV Z= 1.239816 lam= -0.193429
|
|
E( 4 )= 13.8172 eV Re[Sigma]= 274.628392 meV Im[Sigma]= 566.834736 meV Z= 1.239816 lam= -0.193429
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 92 coord.: 0.0450000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9076 eV Re[Sigma]= -65.743858 meV Im[Sigma]= 44.816029 meV Z= 1.010211 lam= -0.010108
|
|
E( 2 )= 13.6680 eV Re[Sigma]= 180.448623 meV Im[Sigma]= 451.286300 meV Z= 1.199925 lam= -0.166615
|
|
E( 3 )= 13.8311 eV Re[Sigma]= 273.975766 meV Im[Sigma]= 581.622352 meV Z= 1.252576 lam= -0.201645
|
|
E( 4 )= 13.8311 eV Re[Sigma]= 273.975766 meV Im[Sigma]= 581.622352 meV Z= 1.252576 lam= -0.201645
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 93 coord.: 0.0400000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9180 eV Re[Sigma]= -65.040309 meV Im[Sigma]= 45.855870 meV Z= 1.010813 lam= -0.010697
|
|
E( 2 )= 13.7146 eV Re[Sigma]= 184.625539 meV Im[Sigma]= 461.469596 meV Z= 1.207267 lam= -0.171683
|
|
E( 3 )= 13.8436 eV Re[Sigma]= 273.087926 meV Im[Sigma]= 596.727372 meV Z= 1.266021 lam= -0.210124
|
|
E( 4 )= 13.8436 eV Re[Sigma]= 273.087926 meV Im[Sigma]= 596.727372 meV Z= 1.266021 lam= -0.210124
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 94 coord.: 0.0350000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9272 eV Re[Sigma]= -64.368029 meV Im[Sigma]= 46.929510 meV Z= 1.011436 lam= -0.011307
|
|
E( 2 )= 13.7558 eV Re[Sigma]= 188.116889 meV Im[Sigma]= 472.440410 meV Z= 1.215250 lam= -0.177124
|
|
E( 3 )= 13.8546 eV Re[Sigma]= 271.947163 meV Im[Sigma]= 612.125050 meV Z= 1.280170 lam= -0.218854
|
|
E( 4 )= 13.8546 eV Re[Sigma]= 271.947163 meV Im[Sigma]= 612.125050 meV Z= 1.280170 lam= -0.218854
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 95 coord.: 0.0300000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9350 eV Re[Sigma]= -63.724544 meV Im[Sigma]= 48.036885 meV Z= 1.012082 lam= -0.011938
|
|
E( 2 )= 13.7916 eV Re[Sigma]= 190.886042 meV Im[Sigma]= 484.295680 meV Z= 1.224109 lam= -0.183080
|
|
E( 3 )= 13.8642 eV Re[Sigma]= 270.536794 meV Im[Sigma]= 627.788182 meV Z= 1.295038 lam= -0.227822
|
|
E( 4 )= 13.8642 eV Re[Sigma]= 270.536794 meV Im[Sigma]= 627.788182 meV Z= 1.295038 lam= -0.227822
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 96 coord.: 0.0250000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9417 eV Re[Sigma]= -63.110104 meV Im[Sigma]= 49.177945 meV Z= 1.012751 lam= -0.012590
|
|
E( 2 )= 13.8218 eV Re[Sigma]= 192.890980 meV Im[Sigma]= 497.109380 meV Z= 1.234064 lam= -0.189670
|
|
E( 3 )= 13.8723 eV Re[Sigma]= 268.842113 meV Im[Sigma]= 643.687799 meV Z= 1.310636 lam= -0.237012
|
|
E( 4 )= 13.8723 eV Re[Sigma]= 268.842113 meV Im[Sigma]= 643.687799 meV Z= 1.310636 lam= -0.237012
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 97 coord.: 0.0200000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9471 eV Re[Sigma]= -62.526047 meV Im[Sigma]= 50.352683 meV Z= 1.013443 lam= -0.013264
|
|
E( 2 )= 13.8466 eV Re[Sigma]= 194.082857 meV Im[Sigma]= 510.930923 meV Z= 1.245312 lam= -0.196989
|
|
E( 3 )= 13.8789 eV Re[Sigma]= 266.849384 meV Im[Sigma]= 659.793718 meV Z= 1.326977 lam= -0.246407
|
|
E( 4 )= 13.8789 eV Re[Sigma]= 266.849384 meV Im[Sigma]= 659.793718 meV Z= 1.326977 lam= -0.246407
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 98 coord.: 0.0150000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9513 eV Re[Sigma]= -61.969863 meV Im[Sigma]= 51.561147 meV Z= 1.014158 lam= -0.013960
|
|
E( 2 )= 13.8659 eV Re[Sigma]= 194.405308 meV Im[Sigma]= 525.782986 meV Z= 1.258022 lam= -0.205101
|
|
E( 3 )= 13.8841 eV Re[Sigma]= 264.547413 meV Im[Sigma]= 676.074916 meV Z= 1.344066 lam= -0.255989
|
|
E( 4 )= 13.8841 eV Re[Sigma]= 264.547413 meV Im[Sigma]= 676.074916 meV Z= 1.344066 lam= -0.255989
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 99 coord.: 0.0100000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9544 eV Re[Sigma]= -61.441924 meV Im[Sigma]= 52.803453 meV Z= 1.014898 lam= -0.014679
|
|
E( 2 )= 13.8797 eV Re[Sigma]= 193.791446 meV Im[Sigma]= 541.658516 meV Z= 1.272326 lam= -0.214038
|
|
E( 3 )= 13.8878 eV Re[Sigma]= 261.925735 meV Im[Sigma]= 692.499697 meV Z= 1.361909 lam= -0.265736
|
|
E( 4 )= 13.8878 eV Re[Sigma]= 261.925735 meV Im[Sigma]= 692.499697 meV Z= 1.361909 lam= -0.265736
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 100 coord.: 0.0050000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9562 eV Re[Sigma]= -60.939698 meV Im[Sigma]= 54.079793 meV Z= 1.015662 lam= -0.015420
|
|
E( 2 )= 13.8880 eV Re[Sigma]= 192.164853 meV Im[Sigma]= 558.516769 meV Z= 1.288306 lam= -0.223787
|
|
E( 3 )= 13.8900 eV Re[Sigma]= 258.976144 meV Im[Sigma]= 709.035683 meV Z= 1.380504 lam= -0.275627
|
|
E( 4 )= 13.8900 eV Re[Sigma]= 258.976144 meV Im[Sigma]= 709.035683 meV Z= 1.380504 lam= -0.275627
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 101 coord.: 0.0000000 0.0000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9568 eV Re[Sigma]= -60.463199 meV Im[Sigma]= 55.390428 meV Z= 1.016451 lam= -0.016185
|
|
E( 2 )= 13.8908 eV Re[Sigma]= 233.606950 meV Im[Sigma]= 675.859180 meV Z= 1.367090 lam= -0.268520
|
|
E( 3 )= 13.8908 eV Re[Sigma]= 233.606950 meV Im[Sigma]= 675.859180 meV Z= 1.367090 lam= -0.268520
|
|
E( 4 )= 13.8908 eV Re[Sigma]= 233.606950 meV Im[Sigma]= 675.859180 meV Z= 1.367090 lam= -0.268520
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 102 coord.: 0.0050000 0.0050000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9560 eV Re[Sigma]= -61.036628 meV Im[Sigma]= 53.884027 meV Z= 1.015546 lam= -0.015308
|
|
E( 2 )= 13.8889 eV Re[Sigma]= 228.434102 meV Im[Sigma]= 660.979796 meV Z= 1.353131 lam= -0.260973
|
|
E( 3 )= 13.8889 eV Re[Sigma]= 241.228345 meV Im[Sigma]= 654.250768 meV Z= 1.342164 lam= -0.254935
|
|
E( 4 )= 13.8889 eV Re[Sigma]= 241.228345 meV Im[Sigma]= 654.250768 meV Z= 1.342164 lam= -0.254935
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 103 coord.: 0.0100000 0.0100000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9536 eV Re[Sigma]= -61.664160 meV Im[Sigma]= 52.425392 meV Z= 1.014675 lam= -0.014462
|
|
E( 2 )= 13.8831 eV Re[Sigma]= 231.297464 meV Im[Sigma]= 642.414021 meV Z= 1.333189 lam= -0.249919
|
|
E( 3 )= 13.8833 eV Re[Sigma]= 243.764951 meV Im[Sigma]= 634.934561 meV Z= 1.322125 lam= -0.243642
|
|
E( 4 )= 13.8833 eV Re[Sigma]= 243.764951 meV Im[Sigma]= 634.934561 meV Z= 1.322125 lam= -0.243642
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 104 coord.: 0.0150000 0.0150000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9495 eV Re[Sigma]= -62.348182 meV Im[Sigma]= 51.013653 meV Z= 1.013837 lam= -0.013648
|
|
E( 2 )= 13.8735 eV Re[Sigma]= 233.462915 meV Im[Sigma]= 624.360058 meV Z= 1.314683 lam= -0.239360
|
|
E( 3 )= 13.8740 eV Re[Sigma]= 245.674249 meV Im[Sigma]= 615.926209 meV Z= 1.303330 lam= -0.232735
|
|
E( 4 )= 13.8740 eV Re[Sigma]= 245.674249 meV Im[Sigma]= 615.926209 meV Z= 1.303330 lam= -0.232735
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 105 coord.: 0.0200000 0.0200000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9439 eV Re[Sigma]= -63.089476 meV Im[Sigma]= 49.647807 meV Z= 1.013031 lam= -0.012863
|
|
E( 2 )= 13.8600 eV Re[Sigma]= 234.991405 meV Im[Sigma]= 606.874738 meV Z= 1.297587 lam= -0.229339
|
|
E( 3 )= 13.8610 eV Re[Sigma]= 247.014020 meV Im[Sigma]= 597.286267 meV Z= 1.285769 lam= -0.222255
|
|
E( 4 )= 13.8610 eV Re[Sigma]= 247.014020 meV Im[Sigma]= 597.286267 meV Z= 1.285769 lam= -0.222255
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 106 coord.: 0.0250000 0.0250000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9367 eV Re[Sigma]= -63.889840 meV Im[Sigma]= 48.326749 meV Z= 1.012256 lam= -0.012107
|
|
E( 2 )= 13.8427 eV Re[Sigma]= 235.940412 meV Im[Sigma]= 589.999053 meV Z= 1.281852 lam= -0.219879
|
|
E( 3 )= 13.8443 eV Re[Sigma]= 247.839860 meV Im[Sigma]= 579.060841 meV Z= 1.269402 lam= -0.212227
|
|
E( 4 )= 13.8443 eV Re[Sigma]= 247.839860 meV Im[Sigma]= 579.060841 meV Z= 1.269402 lam= -0.212227
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 107 coord.: 0.0300000 0.0300000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9278 eV Re[Sigma]= -64.750684 meV Im[Sigma]= 47.049307 meV Z= 1.011510 lam= -0.011379
|
|
E( 2 )= 13.8216 eV Re[Sigma]= 236.363919 meV Im[Sigma]= 573.760749 meV Z= 1.267410 lam= -0.210989
|
|
E( 3 )= 13.8239 eV Re[Sigma]= 248.204821 meV Im[Sigma]= 561.283520 meV Z= 1.254175 lam= -0.202663
|
|
E( 4 )= 13.8239 eV Re[Sigma]= 248.204821 meV Im[Sigma]= 561.283520 meV Z= 1.254175 lam= -0.202663
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 108 coord.: 0.0350000 0.0350000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9174 eV Re[Sigma]= -65.675061 meV Im[Sigma]= 45.814255 meV Z= 1.010792 lam= -0.010676
|
|
E( 2 )= 13.7966 eV Re[Sigma]= 236.312342 meV Im[Sigma]= 558.176475 meV Z= 1.254185 lam= -0.202669
|
|
E( 3 )= 13.7998 eV Re[Sigma]= 248.158096 meV Im[Sigma]= 543.977287 meV Z= 1.240023 lam= -0.193563
|
|
E( 4 )= 13.7998 eV Re[Sigma]= 248.158096 meV Im[Sigma]= 543.977287 meV Z= 1.240023 lam= -0.193563
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 109 coord.: 0.0400000 0.0400000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.9052 eV Re[Sigma]= -66.662356 meV Im[Sigma]= 44.620339 meV Z= 1.010099 lam= -0.009998
|
|
E( 2 )= 13.7679 eV Re[Sigma]= 235.832112 meV Im[Sigma]= 543.253691 meV Z= 1.242094 lam= -0.194908
|
|
E( 3 )= 13.7721 eV Re[Sigma]= 247.747971 meV Im[Sigma]= 527.156264 meV Z= 1.226873 lam= -0.184920
|
|
E( 4 )= 13.7721 eV Re[Sigma]= 247.747971 meV Im[Sigma]= 527.156264 meV Z= 1.226873 lam= -0.184920
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 110 coord.: 0.0450000 0.0450000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8914 eV Re[Sigma]= -67.711909 meV Im[Sigma]= 43.466291 meV Z= 1.009433 lam= -0.009345
|
|
E( 2 )= 13.7353 eV Re[Sigma]= 234.966307 meV Im[Sigma]= 528.992363 meV Z= 1.231057 lam= -0.187690
|
|
E( 3 )= 13.7408 eV Re[Sigma]= 247.019128 meV Im[Sigma]= 510.827279 meV Z= 1.214652 lam= -0.176719
|
|
E( 4 )= 13.7408 eV Re[Sigma]= 247.019128 meV Im[Sigma]= 510.827279 meV Z= 1.214652 lam= -0.176719
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 111 coord.: 0.0500000 0.0500000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8760 eV Re[Sigma]= -68.823378 meV Im[Sigma]= 42.350838 meV Z= 1.008790 lam= -0.008713
|
|
E( 2 )= 13.6990 eV Re[Sigma]= 233.754433 meV Im[Sigma]= 515.386435 meV Z= 1.220991 lam= -0.180993
|
|
E( 3 )= 13.7060 eV Re[Sigma]= 246.013129 meV Im[Sigma]= 494.991248 meV Z= 1.203288 lam= -0.168944
|
|
E( 4 )= 13.7060 eV Re[Sigma]= 246.013129 meV Im[Sigma]= 494.991248 meV Z= 1.203288 lam= -0.168944
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 112 coord.: 0.0550000 0.0550000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8588 eV Re[Sigma]= -69.996692 meV Im[Sigma]= 41.272718 meV Z= 1.008170 lam= -0.008104
|
|
E( 2 )= 13.6590 eV Re[Sigma]= 232.232612 meV Im[Sigma]= 502.425117 meV Z= 1.211822 lam= -0.174796
|
|
E( 3 )= 13.6676 eV Re[Sigma]= 244.768672 meV Im[Sigma]= 479.644385 meV Z= 1.192710 lam= -0.161573
|
|
E( 4 )= 13.6676 eV Re[Sigma]= 244.768672 meV Im[Sigma]= 479.644385 meV Z= 1.192710 lam= -0.161573
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 113 coord.: 0.0600000 0.0600000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8400 eV Re[Sigma]= -71.233791 meV Im[Sigma]= 40.230682 meV Z= 1.007571 lam= -0.007514
|
|
E( 2 )= 13.6152 eV Re[Sigma]= 230.433461 meV Im[Sigma]= 490.093997 meV Z= 1.203474 lam= -0.169072
|
|
E( 3 )= 13.6257 eV Re[Sigma]= 243.321397 meV Im[Sigma]= 464.779236 meV Z= 1.182851 lam= -0.154585
|
|
E( 4 )= 13.6257 eV Re[Sigma]= 243.321397 meV Im[Sigma]= 464.779236 meV Z= 1.182851 lam= -0.154585
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 114 coord.: 0.0650000 0.0650000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.8195 eV Re[Sigma]= -72.534928 meV Im[Sigma]= 39.223507 meV Z= 1.006991 lam= -0.006943
|
|
E( 2 )= 13.5676 eV Re[Sigma]= 228.386924 meV Im[Sigma]= 478.375998 meV Z= 1.195880 lam= -0.163795
|
|
E( 3 )= 13.5804 eV Re[Sigma]= 241.704659 meV Im[Sigma]= 450.385575 meV Z= 1.173649 lam= -0.147956
|
|
E( 4 )= 13.5804 eV Re[Sigma]= 241.704659 meV Im[Sigma]= 450.385575 meV Z= 1.173649 lam= -0.147956
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 115 coord.: 0.0700000 0.0700000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7972 eV Re[Sigma]= -73.900255 meV Im[Sigma]= 38.249994 meV Z= 1.006430 lam= -0.006389
|
|
E( 2 )= 13.5164 eV Re[Sigma]= 226.120260 meV Im[Sigma]= 467.252205 meV Z= 1.188975 lam= -0.158940
|
|
E( 3 )= 13.5317 eV Re[Sigma]= 239.949459 meV Im[Sigma]= 436.451159 meV Z= 1.165043 lam= -0.141662
|
|
E( 4 )= 13.5317 eV Re[Sigma]= 239.949459 meV Im[Sigma]= 436.451159 meV Z= 1.165043 lam= -0.141662
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 116 coord.: 0.0750000 0.0750000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7731 eV Re[Sigma]= -75.329632 meV Im[Sigma]= 37.308976 meV Z= 1.005886 lam= -0.005851
|
|
E( 2 )= 13.4615 eV Re[Sigma]= 223.658265 meV Im[Sigma]= 456.702582 meV Z= 1.182702 lam= -0.154479
|
|
E( 3 )= 13.4797 eV Re[Sigma]= 238.084604 meV Im[Sigma]= 422.962372 meV Z= 1.156979 lam= -0.135680
|
|
E( 4 )= 13.4797 eV Re[Sigma]= 238.084604 meV Im[Sigma]= 422.962372 meV Z= 1.156979 lam= -0.135680
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 117 coord.: 0.0800000 0.0800000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7473 eV Re[Sigma]= -76.823013 meV Im[Sigma]= 36.399319 meV Z= 1.005357 lam= -0.005329
|
|
E( 2 )= 13.4030 eV Re[Sigma]= 221.023441 meV Im[Sigma]= 446.706606 meV Z= 1.177006 lam= -0.150387
|
|
E( 3 )= 13.4244 eV Re[Sigma]= 236.136835 meV Im[Sigma]= 409.904779 meV Z= 1.149406 lam= -0.129985
|
|
E( 4 )= 13.4244 eV Re[Sigma]= 236.136835 meV Im[Sigma]= 409.904779 meV Z= 1.149406 lam= -0.129985
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 118 coord.: 0.0850000 0.0850000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.7197 eV Re[Sigma]= -78.379853 meV Im[Sigma]= 35.519923 meV Z= 1.004844 lam= -0.004820
|
|
E( 2 )= 13.3408 eV Re[Sigma]= 218.236271 meV Im[Sigma]= 437.243848 meV Z= 1.171837 lam= -0.146639
|
|
E( 3 )= 13.3658 eV Re[Sigma]= 234.131047 meV Im[Sigma]= 397.263599 meV Z= 1.142277 lam= -0.124556
|
|
E( 4 )= 13.3658 eV Re[Sigma]= 234.131047 meV Im[Sigma]= 397.263599 meV Z= 1.142277 lam= -0.124556
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 119 coord.: 0.0900000 0.0900000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6903 eV Re[Sigma]= -80.000236 meV Im[Sigma]= 34.669723 meV Z= 1.004344 lam= -0.004325
|
|
E( 2 )= 13.2751 eV Re[Sigma]= 215.315223 meV Im[Sigma]= 428.294526 meV Z= 1.167150 lam= -0.143212
|
|
E( 3 )= 13.3041 eV Re[Sigma]= 232.090261 meV Im[Sigma]= 385.024126 meV Z= 1.135550 lam= -0.119370
|
|
E( 4 )= 13.3041 eV Re[Sigma]= 232.090261 meV Im[Sigma]= 385.024126 meV Z= 1.135550 lam= -0.119370
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 120 coord.: 0.0950000 0.0950000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6590 eV Re[Sigma]= -81.683365 meV Im[Sigma]= 33.847690 meV Z= 1.003856 lam= -0.003841
|
|
E( 2 )= 13.2058 eV Re[Sigma]= 212.277165 meV Im[Sigma]= 419.840068 meV Z= 1.162902 lam= -0.140083
|
|
E( 3 )= 13.2393 eV Re[Sigma]= 230.035994 meV Im[Sigma]= 373.172122 meV Z= 1.129185 lam= -0.114406
|
|
E( 4 )= 13.2393 eV Re[Sigma]= 230.035994 meV Im[Sigma]= 373.172122 meV Z= 1.129185 lam= -0.114406
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 121 coord.: 0.1000000 0.1000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.6258 eV Re[Sigma]= -83.429131 meV Im[Sigma]= 33.052830 meV Z= 1.003380 lam= -0.003368
|
|
E( 2 )= 13.1330 eV Re[Sigma]= 209.137234 meV Im[Sigma]= 411.863731 meV Z= 1.159057 lam= -0.137230
|
|
E( 3 )= 13.1714 eV Re[Sigma]= 227.988110 meV Im[Sigma]= 361.694192 meV Z= 1.123146 lam= -0.109644
|
|
E( 4 )= 13.1714 eV Re[Sigma]= 227.988110 meV Im[Sigma]= 361.694192 meV Z= 1.123146 lam= -0.109644
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 122 coord.: 0.1050000 0.1050000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5908 eV Re[Sigma]= -85.236897 meV Im[Sigma]= 32.284184 meV Z= 1.002914 lam= -0.002905
|
|
E( 2 )= 13.0567 eV Re[Sigma]= 205.909180 meV Im[Sigma]= 404.351308 meV Z= 1.155580 lam= -0.134634
|
|
E( 3 )= 13.1006 eV Re[Sigma]= 225.965131 meV Im[Sigma]= 350.578180 meV Z= 1.117401 lam= -0.105066
|
|
E( 4 )= 13.1006 eV Re[Sigma]= 225.965131 meV Im[Sigma]= 350.578180 meV Z= 1.117401 lam= -0.105066
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 123 coord.: 0.1100000 0.1100000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5539 eV Re[Sigma]= -87.105985 meV Im[Sigma]= 31.540825 meV Z= 1.002457 lam= -0.002451
|
|
E( 2 )= 12.9770 eV Re[Sigma]= 202.605360 meV Im[Sigma]= 397.291985 meV Z= 1.152439 lam= -0.132275
|
|
E( 3 )= 13.0270 eV Re[Sigma]= 223.984233 meV Im[Sigma]= 339.813596 meV Z= 1.111918 lam= -0.100653
|
|
E( 4 )= 13.0270 eV Re[Sigma]= 223.984233 meV Im[Sigma]= 339.813596 meV Z= 1.111918 lam= -0.100653
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 124 coord.: 0.1150000 0.1150000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.5150 eV Re[Sigma]= -89.035770 meV Im[Sigma]= 30.821862 meV Z= 1.002009 lam= -0.002005
|
|
E( 2 )= 12.8939 eV Re[Sigma]= 199.236795 meV Im[Sigma]= 390.679381 meV Z= 1.149607 lam= -0.130138
|
|
E( 3 )= 12.9505 eV Re[Sigma]= 222.061305 meV Im[Sigma]= 329.392092 meV Z= 1.106671 lam= -0.096389
|
|
E( 4 )= 12.9505 eV Re[Sigma]= 222.061305 meV Im[Sigma]= 329.392092 meV Z= 1.106671 lam= -0.096389
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 125 coord.: 0.1200000 0.1200000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.4742 eV Re[Sigma]= -91.025298 meV Im[Sigma]= 30.126432 meV Z= 1.001568 lam= -0.001566
|
|
E( 2 )= 12.8074 eV Re[Sigma]= 195.813252 meV Im[Sigma]= 384.512790 meV Z= 1.147059 lam= -0.128205
|
|
E( 3 )= 12.8713 eV Re[Sigma]= 220.211062 meV Im[Sigma]= 319.308003 meV Z= 1.101636 lam= -0.092259
|
|
E( 4 )= 12.8713 eV Re[Sigma]= 220.211062 meV Im[Sigma]= 319.308003 meV Z= 1.101636 lam= -0.092259
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 126 coord.: 0.1250000 0.1250000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.4314 eV Re[Sigma]= -93.073538 meV Im[Sigma]= 29.453705 meV Z= 1.001134 lam= -0.001132
|
|
E( 2 )= 12.7176 eV Re[Sigma]= 192.343173 meV Im[Sigma]= 378.798614 meV Z= 1.144773 lam= -0.126465
|
|
E( 3 )= 12.7895 eV Re[Sigma]= 218.447037 meV Im[Sigma]= 309.558937 meV Z= 1.096790 lam= -0.088248
|
|
E( 4 )= 12.7895 eV Re[Sigma]= 218.447037 meV Im[Sigma]= 309.558937 meV Z= 1.096790 lam= -0.088248
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 127 coord.: 0.1300000 0.1300000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.3866 eV Re[Sigma]= -95.180556 meV Im[Sigma]= 28.802878 meV Z= 1.000705 lam= -0.000704
|
|
E( 2 )= 12.6245 eV Re[Sigma]= 188.833405 meV Im[Sigma]= 373.551890 meV Z= 1.142732 lam= -0.124904
|
|
E( 3 )= 12.7051 eV Re[Sigma]= 216.781420 meV Im[Sigma]= 300.146395 meV Z= 1.092114 lam= -0.084345
|
|
E( 4 )= 12.7051 eV Re[Sigma]= 216.781420 meV Im[Sigma]= 300.146395 meV Z= 1.092114 lam= -0.084345
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 128 coord.: 0.1350000 0.1350000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.3398 eV Re[Sigma]= -97.349174 meV Im[Sigma]= 28.173177 meV Z= 1.000279 lam= -0.000279
|
|
E( 2 )= 12.5282 eV Re[Sigma]= 185.288756 meV Im[Sigma]= 368.797707 meV Z= 1.140923 lam= -0.123516
|
|
E( 3 )= 12.6183 eV Re[Sigma]= 215.224792 meV Im[Sigma]= 291.076328 meV Z= 1.087593 lam= -0.080538
|
|
E( 4 )= 12.6183 eV Re[Sigma]= 215.224792 meV Im[Sigma]= 291.076328 meV Z= 1.087593 lam= -0.080538
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 129 coord.: 0.1400000 0.1400000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.2909 eV Re[Sigma]= -99.580740 meV Im[Sigma]= 27.563855 meV Z= 0.999856 lam= 0.000144
|
|
E( 2 )= 12.4288 eV Re[Sigma]= 181.712211 meV Im[Sigma]= 364.572173 meV Z= 1.139338 lam= -0.122298
|
|
E( 3 )= 12.5291 eV Re[Sigma]= 213.786644 meV Im[Sigma]= 282.359555 meV Z= 1.083212 lam= -0.076820
|
|
E( 4 )= 12.5291 eV Re[Sigma]= 213.786644 meV Im[Sigma]= 282.359555 meV Z= 1.083212 lam= -0.076820
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 130 coord.: 0.1450000 0.1450000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.2400 eV Re[Sigma]= -101.872933 meV Im[Sigma]= 26.974188 meV Z= 0.999434 lam= 0.000566
|
|
E( 2 )= 12.3262 eV Re[Sigma]= 178.104672 meV Im[Sigma]= 360.922438 meV Z= 1.137980 lam= -0.121250
|
|
E( 3 )= 12.4376 eV Re[Sigma]= 212.475572 meV Im[Sigma]= 274.011851 meV Z= 1.078963 lam= -0.073184
|
|
E( 4 )= 12.4376 eV Re[Sigma]= 212.475572 meV Im[Sigma]= 274.011851 meV Z= 1.078963 lam= -0.073184
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 131 coord.: 0.1500000 0.1500000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.1870 eV Re[Sigma]= -104.223841 meV Im[Sigma]= 26.403477 meV Z= 0.999012 lam= 0.000989
|
|
E( 2 )= 12.2205 eV Re[Sigma]= 174.463515 meV Im[Sigma]= 357.905120 meV Z= 1.136860 lam= -0.120384
|
|
E( 3 )= 12.3439 eV Re[Sigma]= 211.298489 meV Im[Sigma]= 266.053544 meV Z= 1.074839 lam= -0.069628
|
|
E( 4 )= 12.3439 eV Re[Sigma]= 211.298489 meV Im[Sigma]= 266.053544 meV Z= 1.074839 lam= -0.069628
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 132 coord.: 0.1550000 0.1550000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.1320 eV Re[Sigma]= -106.632625 meV Im[Sigma]= 25.851050 meV Z= 0.998590 lam= 0.001412
|
|
E( 2 )= 12.1119 eV Re[Sigma]= 170.781214 meV Im[Sigma]= 355.582484 meV Z= 1.136004 lam= -0.119722
|
|
E( 3 )= 12.2482 eV Re[Sigma]= 210.260227 meV Im[Sigma]= 258.508400 meV Z= 1.070842 lam= -0.066156
|
|
E( 4 )= 12.2482 eV Re[Sigma]= 210.260227 meV Im[Sigma]= 258.508400 meV Z= 1.070842 lam= -0.066156
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 133 coord.: 0.1600000 0.1600000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.0747 eV Re[Sigma]= -109.098889 meV Im[Sigma]= 25.316264 meV Z= 0.998167 lam= 0.001837
|
|
E( 2 )= 12.0002 eV Re[Sigma]= 167.043653 meV Im[Sigma]= 354.015835 meV Z= 1.135459 lam= -0.119299
|
|
E( 3 )= 12.1505 eV Re[Sigma]= 209.363205 meV Im[Sigma]= 251.401642 meV Z= 1.066978 lam= -0.062773
|
|
E( 4 )= 12.1505 eV Re[Sigma]= 209.363205 meV Im[Sigma]= 251.401642 meV Z= 1.066978 lam= -0.062773
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 134 coord.: 0.1650000 0.1650000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -7.0154 eV Re[Sigma]= -111.622426 meV Im[Sigma]= 24.798529 meV Z= 0.997740 lam= 0.002265
|
|
E( 2 )= 11.8857 eV Re[Sigma]= 163.227837 meV Im[Sigma]= 353.256013 meV Z= 1.135293 lam= -0.119170
|
|
E( 3 )= 12.0509 eV Re[Sigma]= 208.606911 meV Im[Sigma]= 244.757040 meV Z= 1.063260 lam= -0.059496
|
|
E( 4 )= 12.0509 eV Re[Sigma]= 208.606911 meV Im[Sigma]= 244.757040 meV Z= 1.063260 lam= -0.059496
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 135 coord.: 0.1700000 0.1700000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.9539 eV Re[Sigma]= -114.203154 meV Im[Sigma]= 24.297363 meV Z= 0.997310 lam= 0.002698
|
|
E( 2 )= 11.7683 eV Re[Sigma]= 159.299254 meV Im[Sigma]= 353.331549 meV Z= 1.135599 lam= -0.119407
|
|
E( 3 )= 11.9495 eV Re[Sigma]= 207.987244 meV Im[Sigma]= 238.593158 meV Z= 1.059712 lam= -0.056347
|
|
E( 4 )= 11.9495 eV Re[Sigma]= 207.987244 meV Im[Sigma]= 238.593158 meV Z= 1.059712 lam= -0.056347
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 136 coord.: 0.1750000 0.1750000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.8903 eV Re[Sigma]= -116.841112 meV Im[Sigma]= 23.812540 meV Z= 0.996873 lam= 0.003136
|
|
E( 2 )= 11.6482 eV Re[Sigma]= 155.209580 meV Im[Sigma]= 354.236018 meV Z= 1.136481 lam= -0.120091
|
|
E( 3 )= 11.8465 eV Re[Sigma]= 207.495801 meV Im[Sigma]= 232.919116 meV Z= 1.056363 lam= -0.053356
|
|
E( 4 )= 11.8465 eV Re[Sigma]= 207.495801 meV Im[Sigma]= 232.919116 meV Z= 1.056363 lam= -0.053356
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 137 coord.: 0.1800000 0.1800000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.8245 eV Re[Sigma]= -119.536456 meV Im[Sigma]= 23.344443 meV Z= 0.996430 lam= 0.003582
|
|
E( 2 )= 11.5253 eV Re[Sigma]= 150.896353 meV Im[Sigma]= 355.917190 meV Z= 1.138028 lam= -0.121287
|
|
E( 3 )= 11.7419 eV Re[Sigma]= 207.119298 meV Im[Sigma]= 227.730466 meV Z= 1.053251 lam= -0.050559
|
|
E( 4 )= 11.7419 eV Re[Sigma]= 207.119298 meV Im[Sigma]= 227.730466 meV Z= 1.053251 lam= -0.050559
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 138 coord.: 0.1850000 0.1850000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.7566 eV Re[Sigma]= -122.289438 meV Im[Sigma]= 22.894796 meV Z= 0.995980 lam= 0.004037
|
|
E( 2 )= 11.3998 eV Re[Sigma]= 146.287228 meV Im[Sigma]= 358.271651 meV Z= 1.140255 lam= -0.123003
|
|
E( 3 )= 11.6358 eV Re[Sigma]= 206.839499 meV Im[Sigma]= 223.006143 meV Z= 1.050409 lam= -0.047990
|
|
E( 4 )= 11.6358 eV Re[Sigma]= 206.839499 meV Im[Sigma]= 223.006143 meV Z= 1.050409 lam= -0.047990
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 139 coord.: 0.1900000 0.1900000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.6864 eV Re[Sigma]= -125.100351 meV Im[Sigma]= 22.468075 meV Z= 0.995520 lam= 0.004500
|
|
E( 2 )= 11.2717 eV Re[Sigma]= 141.311434 meV Im[Sigma]= 361.149447 meV Z= 1.143033 lam= -0.125134
|
|
E( 3 )= 11.5284 eV Re[Sigma]= 206.634163 meV Im[Sigma]= 218.707840 meV Z= 1.047859 lam= -0.045673
|
|
E( 4 )= 11.5284 eV Re[Sigma]= 206.634163 meV Im[Sigma]= 218.707840 meV Z= 1.047859 lam= -0.045673
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 140 coord.: 0.1950000 0.1950000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.6141 eV Re[Sigma]= -127.969408 meV Im[Sigma]= 22.073867 meV Z= 0.995053 lam= 0.004971
|
|
E( 2 )= 11.1410 eV Re[Sigma]= 135.918142 meV Im[Sigma]= 364.373723 meV Z= 1.146043 lam= -0.127432
|
|
E( 3 )= 11.4198 eV Re[Sigma]= 206.479611 meV Im[Sigma]= 214.783637 meV Z= 1.045592 lam= -0.043604
|
|
E( 4 )= 11.4198 eV Re[Sigma]= 206.479611 meV Im[Sigma]= 214.783637 meV Z= 1.045592 lam= -0.043604
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 141 coord.: 0.2000000 0.2000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.5396 eV Re[Sigma]= -130.896487 meV Im[Sigma]= 21.730280 meV Z= 0.994580 lam= 0.005450
|
|
E( 2 )= 11.0080 eV Re[Sigma]= 130.095071 meV Im[Sigma]= 367.779014 meV Z= 1.148827 lam= -0.129547
|
|
E( 3 )= 11.3100 eV Re[Sigma]= 206.355087 meV Im[Sigma]= 211.178135 meV Z= 1.043555 lam= -0.041737
|
|
E( 4 )= 11.3100 eV Re[Sigma]= 206.355087 meV Im[Sigma]= 211.178135 meV Z= 1.043555 lam= -0.041737
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 142 coord.: 0.2050000 0.2050000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.4629 eV Re[Sigma]= -133.880656 meV Im[Sigma]= 21.467948 meV Z= 0.994106 lam= 0.005929
|
|
E( 2 )= 10.8725 eV Re[Sigma]= 123.875357 meV Im[Sigma]= 371.266003 meV Z= 1.150942 lam= -0.131146
|
|
E( 3 )= 11.1993 eV Re[Sigma]= 206.248062 meV Im[Sigma]= 207.851115 meV Z= 1.041644 lam= -0.039979
|
|
E( 4 )= 11.1993 eV Re[Sigma]= 206.248062 meV Im[Sigma]= 207.851115 meV Z= 1.041644 lam= -0.039979
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 143 coord.: 0.2100000 0.2100000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.3840 eV Re[Sigma]= -136.919297 meV Im[Sigma]= 21.333219 meV Z= 0.993642 lam= 0.006399
|
|
E( 2 )= 10.7347 eV Re[Sigma]= 117.323421 meV Im[Sigma]= 374.856614 meV Z= 1.152147 lam= -0.132055
|
|
E( 3 )= 11.0876 eV Re[Sigma]= 206.158131 meV Im[Sigma]= 204.804576 meV Z= 1.039733 lam= -0.038214
|
|
E( 4 )= 11.0876 eV Re[Sigma]= 206.158131 meV Im[Sigma]= 204.804576 meV Z= 1.039733 lam= -0.038214
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 144 coord.: 0.2150000 0.2150000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.3029 eV Re[Sigma]= -140.006541 meV Im[Sigma]= 21.388066 meV Z= 0.993209 lam= 0.006838
|
|
E( 2 )= 10.5947 eV Re[Sigma]= 110.499936 meV Im[Sigma]= 378.712948 meV Z= 1.152532 lam= -0.132345
|
|
E( 3 )= 10.9751 eV Re[Sigma]= 206.096123 meV Im[Sigma]= 202.112654 meV Z= 1.037714 lam= -0.036343
|
|
E( 4 )= 10.9751 eV Re[Sigma]= 206.096123 meV Im[Sigma]= 202.112654 meV Z= 1.037714 lam= -0.036343
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 145 coord.: 0.2200000 0.2200000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.2196 eV Re[Sigma]= -143.130632 meV Im[Sigma]= 21.703858 meV Z= 0.992845 lam= 0.007207
|
|
E( 2 )= 10.4525 eV Re[Sigma]= 103.411483 meV Im[Sigma]= 383.072969 meV Z= 1.152551 lam= -0.132360
|
|
E( 3 )= 10.8620 eV Re[Sigma]= 206.075233 meV Im[Sigma]= 199.941027 meV Z= 1.035562 lam= -0.034340
|
|
E( 4 )= 10.8620 eV Re[Sigma]= 206.075233 meV Im[Sigma]= 199.941027 meV Z= 1.035562 lam= -0.034340
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 146 coord.: 0.2250000 0.2250000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.1342 eV Re[Sigma]= -146.269832 meV Im[Sigma]= 22.347203 meV Z= 0.992609 lam= 0.007446
|
|
E( 2 )= 10.3083 eV Re[Sigma]= 95.951373 meV Im[Sigma]= 388.083020 meV Z= 1.152984 lam= -0.132686
|
|
E( 3 )= 10.7483 eV Re[Sigma]= 206.092216 meV Im[Sigma]= 198.536695 meV Z= 1.033392 lam= -0.032313
|
|
E( 4 )= 10.7483 eV Re[Sigma]= 206.092216 meV Im[Sigma]= 198.536695 meV Z= 1.033392 lam= -0.032313
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 147 coord.: 0.2300000 0.2300000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -6.0466 eV Re[Sigma]= -149.387194 meV Im[Sigma]= 23.359191 meV Z= 0.992589 lam= 0.007466
|
|
E( 2 )= 10.1620 eV Re[Sigma]= 87.860597 meV Im[Sigma]= 393.583748 meV Z= 1.154609 lam= -0.133906
|
|
E( 3 )= 10.6342 eV Re[Sigma]= 206.098146 meV Im[Sigma]= 198.172651 meV Z= 1.031501 lam= -0.030539
|
|
E( 4 )= 10.6342 eV Re[Sigma]= 206.098146 meV Im[Sigma]= 198.172651 meV Z= 1.031501 lam= -0.030539
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 148 coord.: 0.2350000 0.2350000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.9569 eV Re[Sigma]= -152.426720 meV Im[Sigma]= 24.733541 meV Z= 0.992875 lam= 0.007176
|
|
E( 2 )= 10.0138 eV Re[Sigma]= 78.803747 meV Im[Sigma]= 398.985934 meV Z= 1.157298 lam= -0.135918
|
|
E( 3 )= 10.5197 eV Re[Sigma]= 205.963266 meV Im[Sigma]= 199.048771 meV Z= 1.030349 lam= -0.029455
|
|
E( 4 )= 10.5197 eV Re[Sigma]= 205.963266 meV Im[Sigma]= 199.048771 meV Z= 1.030349 lam= -0.029455
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 149 coord.: 0.2400000 0.2400000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.8650 eV Re[Sigma]= -155.317518 meV Im[Sigma]= 26.402353 meV Z= 0.993500 lam= 0.006543
|
|
E( 2 )= 9.8637 eV Re[Sigma]= 68.623514 meV Im[Sigma]= 403.365233 meV Z= 1.159450 lam= -0.137522
|
|
E( 3 )= 10.4050 eV Re[Sigma]= 205.458256 meV Im[Sigma]= 201.174421 meV Z= 1.030378 lam= -0.029482
|
|
E( 4 )= 10.4050 eV Re[Sigma]= 205.458256 meV Im[Sigma]= 201.174421 meV Z= 1.030378 lam= -0.029482
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 150 coord.: 0.2450000 0.2450000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.7710 eV Re[Sigma]= -157.993540 meV Im[Sigma]= 28.237644 meV Z= 0.994355 lam= 0.005677
|
|
E( 2 )= 9.7118 eV Re[Sigma]= 57.521758 meV Im[Sigma]= 405.769832 meV Z= 1.159418 lam= -0.137498
|
|
E( 3 )= 10.2902 eV Re[Sigma]= 204.300192 meV Im[Sigma]= 204.278167 meV Z= 1.031597 lam= -0.030629
|
|
E( 4 )= 10.2902 eV Re[Sigma]= 204.300192 meV Im[Sigma]= 204.278167 meV Z= 1.031597 lam= -0.030629
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 151 coord.: 0.2500000 0.2500000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.6749 eV Re[Sigma]= -160.424102 meV Im[Sigma]= 30.071741 meV Z= 0.995191 lam= 0.004832
|
|
E( 2 )= 9.5582 eV Re[Sigma]= 45.898430 meV Im[Sigma]= 405.567014 meV Z= 1.156975 lam= -0.135677
|
|
E( 3 )= 10.1754 eV Re[Sigma]= 202.278365 meV Im[Sigma]= 207.795191 meV Z= 1.033375 lam= -0.032297
|
|
E( 4 )= 10.1754 eV Re[Sigma]= 202.278365 meV Im[Sigma]= 207.795191 meV Z= 1.033375 lam= -0.032297
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 152 coord.: 0.2550000 0.2550000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.5767 eV Re[Sigma]= -162.630782 meV Im[Sigma]= 31.731676 meV Z= 0.995753 lam= 0.004265
|
|
E( 2 )= 9.4030 eV Re[Sigma]= 34.103518 meV Im[Sigma]= 402.615030 meV Z= 1.152745 lam= -0.132505
|
|
E( 3 )= 10.0608 eV Re[Sigma]= 199.355478 meV Im[Sigma]= 210.965365 meV Z= 1.034883 lam= -0.033707
|
|
E( 4 )= 10.0608 eV Re[Sigma]= 199.355478 meV Im[Sigma]= 210.965365 meV Z= 1.034883 lam= -0.033707
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 153 coord.: 0.2600000 0.2600000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.4764 eV Re[Sigma]= -164.673412 meV Im[Sigma]= 33.076203 meV Z= 0.995927 lam= 0.004090
|
|
E( 2 )= 9.2462 eV Re[Sigma]= 22.356444 meV Im[Sigma]= 397.183498 meV Z= 1.147314 lam= -0.128399
|
|
E( 3 )= 9.9464 eV Re[Sigma]= 195.665045 meV Im[Sigma]= 213.029046 meV Z= 1.035501 lam= -0.034284
|
|
E( 4 )= 9.9464 eV Re[Sigma]= 195.665045 meV Im[Sigma]= 213.029046 meV Z= 1.035501 lam= -0.034284
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 154 coord.: 0.2650000 0.2650000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.3741 eV Re[Sigma]= -166.620416 meV Im[Sigma]= 34.022674 meV Z= 0.995743 lam= 0.004275
|
|
E( 2 )= 9.0880 eV Re[Sigma]= 10.778004 meV Im[Sigma]= 389.727652 meV Z= 1.140948 lam= -0.123536
|
|
E( 3 )= 9.8323 eV Re[Sigma]= 191.473334 meV Im[Sigma]= 213.447516 meV Z= 1.034867 lam= -0.033692
|
|
E( 4 )= 9.8323 eV Re[Sigma]= 191.473334 meV Im[Sigma]= 213.447516 meV Z= 1.034867 lam= -0.033692
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 155 coord.: 0.2700000 0.2700000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.2698 eV Re[Sigma]= -168.527853 meV Im[Sigma]= 34.555732 meV Z= 0.995299 lam= 0.004723
|
|
E( 2 )= 8.9283 eV Re[Sigma]= -0.557211 meV Im[Sigma]= 380.686555 meV Z= 1.133651 lam= -0.117894
|
|
E( 3 )= 9.7187 eV Re[Sigma]= 187.098382 meV Im[Sigma]= 212.044372 meV Z= 1.033088 lam= -0.032028
|
|
E( 4 )= 9.7187 eV Re[Sigma]= 187.098382 meV Im[Sigma]= 212.044372 meV Z= 1.033088 lam= -0.032028
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 156 coord.: 0.2750000 0.2750000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.1636 eV Re[Sigma]= -170.433442 meV Im[Sigma]= 34.717755 meV Z= 0.994690 lam= 0.005338
|
|
E( 2 )= 8.7673 eV Re[Sigma]= -11.583958 meV Im[Sigma]= 370.399859 meV Z= 1.125307 lam= -0.111354
|
|
E( 3 )= 9.6057 eV Re[Sigma]= 182.795461 meV Im[Sigma]= 209.001829 meV Z= 1.030626 lam= -0.029716
|
|
E( 4 )= 9.6057 eV Re[Sigma]= 182.795461 meV Im[Sigma]= 209.001829 meV Z= 1.030626 lam= -0.029716
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 157 coord.: 0.2800000 0.2800000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -5.0553 eV Re[Sigma]= -172.358888 meV Im[Sigma]= 34.587828 meV Z= 0.993989 lam= 0.006048
|
|
E( 2 )= 8.6051 eV Re[Sigma]= -22.230159 meV Im[Sigma]= 359.126618 meV Z= 1.115832 lam= -0.103808
|
|
E( 3 )= 9.4933 eV Re[Sigma]= 178.712266 meV Im[Sigma]= 204.732219 meV Z= 1.027928 lam= -0.027169
|
|
E( 4 )= 9.4933 eV Re[Sigma]= 178.712266 meV Im[Sigma]= 204.732219 meV Z= 1.027928 lam= -0.027169
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 158 coord.: 0.2850000 0.2850000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.9452 eV Re[Sigma]= -174.312998 meV Im[Sigma]= 34.258557 meV Z= 0.993243 lam= 0.006803
|
|
E( 2 )= 8.4417 eV Re[Sigma]= -32.418394 meV Im[Sigma]= 347.095834 meV Z= 1.105307 lam= -0.095274
|
|
E( 3 )= 9.3818 eV Re[Sigma]= 174.913566 meV Im[Sigma]= 199.710752 meV Z= 1.025271 lam= -0.024648
|
|
E( 4 )= 9.3818 eV Re[Sigma]= 174.913566 meV Im[Sigma]= 199.710752 meV Z= 1.025271 lam= -0.024648
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 159 coord.: 0.2900000 0.2900000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.8331 eV Re[Sigma]= -176.296283 meV Im[Sigma]= 33.818127 meV Z= 0.992483 lam= 0.007574
|
|
E( 2 )= 8.2772 eV Re[Sigma]= -42.084254 meV Im[Sigma]= 334.527453 meV Z= 1.094076 lam= -0.085986
|
|
E( 3 )= 9.2711 eV Re[Sigma]= 171.416880 meV Im[Sigma]= 194.353474 meV Z= 1.022795 lam= -0.022287
|
|
E( 4 )= 9.2711 eV Re[Sigma]= 171.416880 meV Im[Sigma]= 194.353474 meV Z= 1.022795 lam= -0.022287
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 160 coord.: 0.2950000 0.2950000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.7192 eV Re[Sigma]= -178.313353 meV Im[Sigma]= 33.340687 meV Z= 0.991726 lam= 0.008343
|
|
E( 2 )= 8.1117 eV Re[Sigma]= -51.211054 meV Im[Sigma]= 321.596854 meV Z= 1.082763 lam= -0.076437
|
|
E( 3 )= 9.1615 eV Re[Sigma]= 168.211432 meV Im[Sigma]= 188.972190 meV Z= 1.020564 lam= -0.020150
|
|
E( 4 )= 9.1615 eV Re[Sigma]= 168.211432 meV Im[Sigma]= 188.972190 meV Z= 1.020564 lam= -0.020150
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 161 coord.: 0.3000000 0.3000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.6035 eV Re[Sigma]= -180.362629 meV Im[Sigma]= 32.884208 meV Z= 0.990983 lam= 0.009099
|
|
E( 2 )= 7.9453 eV Re[Sigma]= -59.855347 meV Im[Sigma]= 308.354865 meV Z= 1.072144 lam= -0.067290
|
|
E( 3 )= 9.0529 eV Re[Sigma]= 165.277020 meV Im[Sigma]= 183.787049 meV Z= 1.018605 lam= -0.018265
|
|
E( 4 )= 9.0529 eV Re[Sigma]= 165.277020 meV Im[Sigma]= 183.787049 meV Z= 1.018605 lam= -0.018265
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 162 coord.: 0.3050000 0.3050000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.4860 eV Re[Sigma]= -182.437777 meV Im[Sigma]= 32.492892 meV Z= 0.990266 lam= 0.009829
|
|
E( 2 )= 7.7780 eV Re[Sigma]= -68.148927 meV Im[Sigma]= 294.653101 meV Z= 1.062839 lam= -0.059124
|
|
E( 3 )= 8.9456 eV Re[Sigma]= 162.588492 meV Im[Sigma]= 178.958146 meV Z= 1.016934 lam= -0.016652
|
|
E( 4 )= 8.9456 eV Re[Sigma]= 162.588492 meV Im[Sigma]= 178.958146 meV Z= 1.016934 lam= -0.016652
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 163 coord.: 0.3100000 0.3100000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.3667 eV Re[Sigma]= -184.531265 meV Im[Sigma]= 32.201052 meV Z= 0.989586 lam= 0.010524
|
|
E( 2 )= 7.6099 eV Re[Sigma]= -76.243731 meV Im[Sigma]= 280.138046 meV Z= 1.055026 lam= -0.052156
|
|
E( 3 )= 8.8396 eV Re[Sigma]= 160.113951 meV Im[Sigma]= 174.606195 meV Z= 1.015578 lam= -0.015339
|
|
E( 4 )= 8.8396 eV Re[Sigma]= 160.113951 meV Im[Sigma]= 174.606195 meV Z= 1.015578 lam= -0.015339
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 164 coord.: 0.3150000 0.3150000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.2458 eV Re[Sigma]= -186.634243 meV Im[Sigma]= 32.036389 meV Z= 0.988954 lam= 0.011169
|
|
E( 2 )= 7.4411 eV Re[Sigma]= -84.242268 meV Im[Sigma]= 264.342012 meV Z= 1.048498 lam= -0.046255
|
|
E( 3 )= 8.7350 eV Re[Sigma]= 157.811799 meV Im[Sigma]= 170.811930 meV Z= 1.014579 lam= -0.014369
|
|
E( 4 )= 8.7350 eV Re[Sigma]= 157.811799 meV Im[Sigma]= 170.811930 meV Z= 1.014579 lam= -0.014369
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 165 coord.: 0.3200000 0.3200000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -4.1232 eV Re[Sigma]= -188.735883 meV Im[Sigma]= 32.021752 meV Z= 0.988387 lam= 0.011750
|
|
E( 2 )= 7.2717 eV Re[Sigma]= -92.169399 meV Im[Sigma]= 246.837099 meV Z= 1.042697 lam= -0.040949
|
|
E( 3 )= 8.6319 eV Re[Sigma]= 155.627483 meV Im[Sigma]= 167.601757 meV Z= 1.013992 lam= -0.013799
|
|
E( 4 )= 8.6319 eV Re[Sigma]= 155.627483 meV Im[Sigma]= 167.601757 meV Z= 1.013992 lam= -0.013799
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 166 coord.: 0.3250000 0.3250000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.9989 eV Re[Sigma]= -190.823404 meV Im[Sigma]= 32.175361 meV Z= 0.987904 lam= 0.012244
|
|
E( 2 )= 7.1017 eV Re[Sigma]= -99.931496 meV Im[Sigma]= 227.387996 meV Z= 1.036561 lam= -0.035271
|
|
E( 3 )= 8.5305 eV Re[Sigma]= 153.496207 meV Im[Sigma]= 164.936605 meV Z= 1.013832 lam= -0.013643
|
|
E( 4 )= 8.5305 eV Re[Sigma]= 153.496207 meV Im[Sigma]= 164.936605 meV Z= 1.013832 lam= -0.013643
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 167 coord.: 0.3300000 0.3300000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.8731 eV Re[Sigma]= -192.880951 meV Im[Sigma]= 32.509875 meV Z= 0.987529 lam= 0.012629
|
|
E( 2 )= 6.9312 eV Re[Sigma]= -107.250134 meV Im[Sigma]= 206.059760 meV Z= 1.028728 lam= -0.027926
|
|
E( 3 )= 8.4307 eV Re[Sigma]= 151.361149 meV Im[Sigma]= 162.718555 meV Z= 1.013998 lam= -0.013805
|
|
E( 4 )= 8.4307 eV Re[Sigma]= 151.361149 meV Im[Sigma]= 162.718555 meV Z= 1.013998 lam= -0.013805
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 168 coord.: 0.3350000 0.3350000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.7458 eV Re[Sigma]= -194.890046 meV Im[Sigma]= 33.030890 meV Z= 0.987286 lam= 0.012878
|
|
E( 2 )= 6.7602 eV Re[Sigma]= -113.664374 meV Im[Sigma]= 183.266494 meV Z= 1.018380 lam= -0.018048
|
|
E( 3 )= 8.3328 eV Re[Sigma]= 149.200145 meV Im[Sigma]= 160.817446 meV Z= 1.014279 lam= -0.014078
|
|
E( 4 )= 8.3328 eV Re[Sigma]= 149.200145 meV Im[Sigma]= 160.817446 meV Z= 1.014279 lam= -0.014078
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 169 coord.: 0.3400000 0.3400000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.6169 eV Re[Sigma]= -196.828601 meV Im[Sigma]= 33.735364 meV Z= 0.987199 lam= 0.012967
|
|
E( 2 )= 6.5889 eV Re[Sigma]= -118.683544 meV Im[Sigma]= 159.752945 meV Z= 1.006127 lam= -0.006090
|
|
E( 3 )= 8.2367 eV Re[Sigma]= 147.033704 meV Im[Sigma]= 159.105977 meV Z= 1.014499 lam= -0.014292
|
|
E( 4 )= 8.2367 eV Re[Sigma]= 147.033704 meV Im[Sigma]= 159.105977 meV Z= 1.014499 lam= -0.014292
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 170 coord.: 0.3450000 0.3450000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.4866 eV Re[Sigma]= -198.672497 meV Im[Sigma]= 34.610455 meV Z= 0.987282 lam= 0.012882
|
|
E( 2 )= 6.4173 eV Re[Sigma]= -122.028376 meV Im[Sigma]= 136.500060 meV Z= 0.993843 lam= 0.006195
|
|
E( 3 )= 8.1427 eV Re[Sigma]= 144.902311 meV Im[Sigma]= 157.486817 meV Z= 1.014614 lam= -0.014404
|
|
E( 4 )= 8.1427 eV Re[Sigma]= 144.902311 meV Im[Sigma]= 157.486817 meV Z= 1.014614 lam= -0.014404
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 171 coord.: 0.3500000 0.3500000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.3548 eV Re[Sigma]= -200.396068 meV Im[Sigma]= 35.633105 meV Z= 0.987531 lam= 0.012626
|
|
E( 2 )= 6.2455 eV Re[Sigma]= -123.764328 meV Im[Sigma]= 114.563432 meV Z= 0.983390 lam= 0.016890
|
|
E( 3 )= 8.0507 eV Re[Sigma]= 142.840936 meV Im[Sigma]= 155.901464 meV Z= 1.014673 lam= -0.014460
|
|
E( 4 )= 8.0507 eV Re[Sigma]= 142.840936 meV Im[Sigma]= 155.901464 meV Z= 1.014673 lam= -0.014460
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 172 coord.: 0.3550000 0.3550000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.2218 eV Re[Sigma]= -201.975527 meV Im[Sigma]= 36.770602 meV Z= 0.987918 lam= 0.012229
|
|
E( 2 )= 6.0735 eV Re[Sigma]= -124.227541 meV Im[Sigma]= 94.884070 meV Z= 0.975642 lam= 0.024967
|
|
E( 3 )= 7.9608 eV Re[Sigma]= 140.868950 meV Im[Sigma]= 154.321990 meV Z= 1.014734 lam= -0.014520
|
|
E( 4 )= 7.9608 eV Re[Sigma]= 140.868950 meV Im[Sigma]= 154.321990 meV Z= 1.014734 lam= -0.014520
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 173 coord.: 0.3600000 0.3600000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -3.0873 eV Re[Sigma]= -203.391176 meV Im[Sigma]= 37.982194 meV Z= 0.988388 lam= 0.011748
|
|
E( 2 )= 5.9013 eV Re[Sigma]= -123.848169 meV Im[Sigma]= 78.127114 meV Z= 0.970502 lam= 0.030394
|
|
E( 3 )= 7.8732 eV Re[Sigma]= 138.992677 meV Im[Sigma]= 152.734737 meV Z= 1.014838 lam= -0.014621
|
|
E( 4 )= 7.8732 eV Re[Sigma]= 138.992677 meV Im[Sigma]= 152.734737 meV Z= 1.014838 lam= -0.014621
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 174 coord.: 0.3650000 0.3650000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.9516 eV Re[Sigma]= -204.631016 meV Im[Sigma]= 39.221646 meV Z= 0.988867 lam= 0.011258
|
|
E( 2 )= 5.7292 eV Re[Sigma]= -123.015038 meV Im[Sigma]= 64.591622 meV Z= 0.967425 lam= 0.033672
|
|
E( 3 )= 7.7880 eV Re[Sigma]= 137.210362 meV Im[Sigma]= 151.125694 meV Z= 1.015002 lam= -0.014780
|
|
E( 4 )= 7.7880 eV Re[Sigma]= 137.210362 meV Im[Sigma]= 151.125694 meV Z= 1.015002 lam= -0.014780
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 175 coord.: 0.3700000 0.3700000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.8147 eV Re[Sigma]= -205.691602 meV Im[Sigma]= 40.440493 meV Z= 0.989275 lam= 0.010841
|
|
E( 2 )= 5.5570 eV Re[Sigma]= -122.024441 meV Im[Sigma]= 54.201718 meV Z= 0.965815 lam= 0.035395
|
|
E( 3 )= 7.7051 eV Re[Sigma]= 135.516713 meV Im[Sigma]= 149.472899 meV Z= 1.015221 lam= -0.014993
|
|
E( 4 )= 7.7051 eV Re[Sigma]= 135.516713 meV Im[Sigma]= 149.472899 meV Z= 1.015221 lam= -0.014993
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 176 coord.: 0.3750000 0.3750000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.6766 eV Re[Sigma]= -206.578354 meV Im[Sigma]= 41.591644 meV Z= 0.989547 lam= 0.010564
|
|
E( 2 )= 5.3849 eV Re[Sigma]= -121.084450 meV Im[Sigma]= 46.558578 meV Z= 0.965204 lam= 0.036050
|
|
E( 3 )= 7.6247 eV Re[Sigma]= 133.905372 meV Im[Sigma]= 147.746153 meV Z= 1.015482 lam= -0.015246
|
|
E( 4 )= 7.6247 eV Re[Sigma]= 133.905372 meV Im[Sigma]= 147.746153 meV Z= 1.015482 lam= -0.015246
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 177 coord.: 0.3800000 0.3800000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.5373 eV Re[Sigma]= -207.302767 meV Im[Sigma]= 42.632814 meV Z= 0.989641 lam= 0.010468
|
|
E( 2 )= 5.2130 eV Re[Sigma]= -120.336585 meV Im[Sigma]= 41.023536 meV Z= 0.965253 lam= 0.035998
|
|
E( 3 )= 7.5468 eV Re[Sigma]= 132.370769 meV Im[Sigma]= 145.911394 meV Z= 1.015761 lam= -0.015516
|
|
E( 4 )= 7.5468 eV Re[Sigma]= 132.370769 meV Im[Sigma]= 145.911394 meV Z= 1.015761 lam= -0.015516
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 178 coord.: 0.3850000 0.3850000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.3970 eV Re[Sigma]= -207.880206 meV Im[Sigma]= 43.529539 meV Z= 0.989542 lam= 0.010568
|
|
E( 2 )= 5.0412 eV Re[Sigma]= -119.869088 meV Im[Sigma]= 36.819492 meV Z= 0.965665 lam= 0.035555
|
|
E( 3 )= 7.4716 eV Re[Sigma]= 130.908632 meV Im[Sigma]= 143.936604 meV Z= 1.016026 lam= -0.015773
|
|
E( 4 )= 7.4716 eV Re[Sigma]= 130.908632 meV Im[Sigma]= 143.936604 meV Z= 1.016026 lam= -0.015773
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 179 coord.: 0.3900000 0.3900000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.2555 eV Re[Sigma]= -208.326391 meV Im[Sigma]= 44.257134 meV Z= 0.989259 lam= 0.010858
|
|
E( 2 )= 4.8696 eV Re[Sigma]= -119.700801 meV Im[Sigma]= 33.161584 meV Z= 0.966040 lam= 0.035154
|
|
E( 3 )= 7.3990 eV Re[Sigma]= 129.516676 meV Im[Sigma]= 141.797039 meV Z= 1.016242 lam= -0.015982
|
|
E( 4 )= 7.3990 eV Re[Sigma]= 129.516676 meV Im[Sigma]= 141.797039 meV Z= 1.016242 lam= -0.015982
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 180 coord.: 0.3950000 0.3950000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -2.1131 eV Re[Sigma]= -208.656277 meV Im[Sigma]= 44.802443 meV Z= 0.988812 lam= 0.011315
|
|
E( 2 )= 4.6984 eV Re[Sigma]= -119.726861 meV Im[Sigma]= 29.425035 meV Z= 0.965770 lam= 0.035443
|
|
E( 3 )= 7.3292 eV Re[Sigma]= 128.194096 meV Im[Sigma]= 139.478717 meV Z= 1.016372 lam= -0.016109
|
|
E( 4 )= 7.3292 eV Re[Sigma]= 128.194096 meV Im[Sigma]= 139.478717 meV Z= 1.016372 lam= -0.016109
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 181 coord.: 0.4000000 0.4000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.9697 eV Re[Sigma]= -208.880350 meV Im[Sigma]= 45.163411 meV Z= 0.988232 lam= 0.011908
|
|
E( 2 )= 4.5275 eV Re[Sigma]= -119.683105 meV Im[Sigma]= 25.313267 meV Z= 0.964395 lam= 0.036920
|
|
E( 3 )= 7.2623 eV Re[Sigma]= 126.942011 meV Im[Sigma]= 136.980002 meV Z= 1.016380 lam= -0.016116
|
|
E( 4 )= 7.2623 eV Re[Sigma]= 126.942011 meV Im[Sigma]= 136.980002 meV Z= 1.016380 lam= -0.016116
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 182 coord.: 0.4050000 0.4050000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.8254 eV Re[Sigma]= -209.005752 meV Im[Sigma]= 45.351158 meV Z= 0.987551 lam= 0.012606
|
|
E( 2 )= 4.3570 eV Re[Sigma]= -119.268379 meV Im[Sigma]= 20.939477 meV Z= 0.962295 lam= 0.039182
|
|
E( 3 )= 7.1982 eV Re[Sigma]= 125.762112 meV Im[Sigma]= 134.311558 meV Z= 1.016233 lam= -0.015974
|
|
E( 4 )= 7.1982 eV Re[Sigma]= 125.762112 meV Im[Sigma]= 134.311558 meV Z= 1.016233 lam= -0.015974
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 183 coord.: 0.4100000 0.4100000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.6803 eV Re[Sigma]= -209.033014 meV Im[Sigma]= 45.391412 meV Z= 0.986801 lam= 0.013375
|
|
E( 2 )= 4.1870 eV Re[Sigma]= -118.374295 meV Im[Sigma]= 16.748518 meV Z= 0.960469 lam= 0.041158
|
|
E( 3 )= 7.1370 eV Re[Sigma]= 124.656648 meV Im[Sigma]= 131.495119 meV Z= 1.015905 lam= -0.015656
|
|
E( 4 )= 7.1370 eV Re[Sigma]= 124.656648 meV Im[Sigma]= 131.495119 meV Z= 1.015905 lam= -0.015656
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 184 coord.: 0.4150000 0.4150000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.5343 eV Re[Sigma]= -208.955405 meV Im[Sigma]= 45.332648 meV Z= 0.986017 lam= 0.014181
|
|
E( 2 )= 4.0175 eV Re[Sigma]= -117.127059 meV Im[Sigma]= 13.302710 meV Z= 0.959492 lam= 0.042218
|
|
E( 3 )= 7.0788 eV Re[Sigma]= 123.627281 meV Im[Sigma]= 128.561472 meV Z= 1.015380 lam= -0.015147
|
|
E( 4 )= 7.0788 eV Re[Sigma]= 123.627281 meV Im[Sigma]= 128.561472 meV Z= 1.015380 lam= -0.015147
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 185 coord.: 0.4200000 0.4200000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.3877 eV Re[Sigma]= -208.756483 meV Im[Sigma]= 45.259741 meV Z= 0.985232 lam= 0.014989
|
|
E( 2 )= 3.8486 eV Re[Sigma]= -115.730893 meV Im[Sigma]= 11.056743 meV Z= 0.959306 lam= 0.042421
|
|
E( 3 )= 7.0237 eV Re[Sigma]= 122.674245 meV Im[Sigma]= 125.547972 meV Z= 1.014654 lam= -0.014442
|
|
E( 4 )= 7.0237 eV Re[Sigma]= 122.674245 meV Im[Sigma]= 125.547972 meV Z= 1.014654 lam= -0.014442
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 186 coord.: 0.4250000 0.4250000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.2403 eV Re[Sigma]= -208.407920 meV Im[Sigma]= 45.304621 meV Z= 0.984478 lam= 0.015767
|
|
E( 2 )= 3.6804 eV Re[Sigma]= -114.351047 meV Im[Sigma]= 10.248537 meV Z= 0.959664 lam= 0.042032
|
|
E( 3 )= 6.9717 eV Re[Sigma]= 121.795987 meV Im[Sigma]= 122.495800 meV Z= 1.013736 lam= -0.013550
|
|
E( 4 )= 6.9717 eV Re[Sigma]= 121.795987 meV Im[Sigma]= 122.495800 meV Z= 1.013736 lam= -0.013550
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 187 coord.: 0.4300000 0.4300000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -1.0924 eV Re[Sigma]= -207.870835 meV Im[Sigma]= 45.641406 meV Z= 0.983778 lam= 0.016489
|
|
E( 2 )= 3.5130 eV Re[Sigma]= -113.101276 meV Im[Sigma]= 10.926996 meV Z= 0.960416 lam= 0.041216
|
|
E( 3 )= 6.9228 eV Re[Sigma]= 120.988375 meV Im[Sigma]= 119.447045 meV Z= 1.012646 lam= -0.012488
|
|
E( 4 )= 6.9228 eV Re[Sigma]= 120.988375 meV Im[Sigma]= 119.447045 meV Z= 1.012646 lam= -0.012488
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 188 coord.: 0.4350000 0.4350000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.9440 eV Re[Sigma]= -207.101996 meV Im[Sigma]= 46.444471 meV Z= 0.983151 lam= 0.017138
|
|
E( 2 )= 3.3464 eV Re[Sigma]= -112.078781 meV Im[Sigma]= 13.027680 meV Z= 0.961582 lam= 0.039953
|
|
E( 3 )= 6.8770 eV Re[Sigma]= 120.244365 meV Im[Sigma]= 116.441696 meV Z= 1.011416 lam= -0.011287
|
|
E( 4 )= 6.8770 eV Re[Sigma]= 120.244365 meV Im[Sigma]= 116.441696 meV Z= 1.011416 lam= -0.011287
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 189 coord.: 0.4400000 0.4400000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.7953 eV Re[Sigma]= -206.056928 meV Im[Sigma]= 47.871071 meV Z= 0.982687 lam= 0.017618
|
|
E( 2 )= 3.1808 eV Re[Sigma]= -111.413181 meV Im[Sigma]= 16.393612 meV Z= 0.963347 lam= 0.038048
|
|
E( 3 )= 6.8345 eV Re[Sigma]= 119.553258 meV Im[Sigma]= 113.514638 meV Z= 1.010083 lam= -0.009983
|
|
E( 4 )= 6.8345 eV Re[Sigma]= 119.553258 meV Im[Sigma]= 113.514638 meV Z= 1.010083 lam= -0.009983
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 190 coord.: 0.4450000 0.4450000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.6463 eV Re[Sigma]= -204.499505 meV Im[Sigma]= 50.662916 meV Z= 0.983265 lam= 0.017020
|
|
E( 2 )= 3.0163 eV Re[Sigma]= -111.355705 meV Im[Sigma]= 20.719138 meV Z= 0.965995 lam= 0.035202
|
|
E( 3 )= 6.7953 eV Re[Sigma]= 118.893922 meV Im[Sigma]= 110.692852 meV Z= 1.008691 lam= -0.008617
|
|
E( 4 )= 6.7953 eV Re[Sigma]= 118.893922 meV Im[Sigma]= 110.692852 meV Z= 1.008691 lam= -0.008617
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 191 coord.: 0.4500000 0.4500000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.4974 eV Re[Sigma]= -201.968601 meV Im[Sigma]= 53.810439 meV Z= 0.985349 lam= 0.014869
|
|
E( 2 )= 2.8532 eV Re[Sigma]= -112.112876 meV Im[Sigma]= 25.492698 meV Z= 0.969551 lam= 0.031405
|
|
E( 3 )= 6.7594 eV Re[Sigma]= 118.256575 meV Im[Sigma]= 107.993146 meV Z= 1.007281 lam= -0.007228
|
|
E( 4 )= 6.7594 eV Re[Sigma]= 118.256575 meV Im[Sigma]= 107.993146 meV Z= 1.007281 lam= -0.007228
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 192 coord.: 0.4550000 0.4550000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.3487 eV Re[Sigma]= -198.819181 meV Im[Sigma]= 55.209578 meV Z= 0.986784 lam= 0.013394
|
|
E( 2 )= 2.6917 eV Re[Sigma]= -113.754219 meV Im[Sigma]= 30.036983 meV Z= 0.973326 lam= 0.027405
|
|
E( 3 )= 6.7267 eV Re[Sigma]= 117.637506 meV Im[Sigma]= 105.420784 meV Z= 1.005886 lam= -0.005851
|
|
E( 4 )= 6.7267 eV Re[Sigma]= 117.637506 meV Im[Sigma]= 105.420784 meV Z= 1.005886 lam= -0.005851
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 193 coord.: 0.4600000 0.4600000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.2006 eV Re[Sigma]= -195.287941 meV Im[Sigma]= 55.255512 meV Z= 0.986850 lam= 0.013325
|
|
E( 2 )= 2.5322 eV Re[Sigma]= -116.289000 meV Im[Sigma]= 33.667425 meV Z= 0.976146 lam= 0.024437
|
|
E( 3 )= 6.6975 eV Re[Sigma]= 117.011332 meV Im[Sigma]= 102.969379 meV Z= 1.004542 lam= -0.004521
|
|
E( 4 )= 6.6975 eV Re[Sigma]= 117.011332 meV Im[Sigma]= 102.969379 meV Z= 1.004542 lam= -0.004521
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 194 coord.: 0.4650000 0.4650000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= -0.0538 eV Re[Sigma]= -191.597129 meV Im[Sigma]= 54.233327 meV Z= 0.985777 lam= 0.014428
|
|
E( 2 )= 2.3752 eV Re[Sigma]= -119.471594 meV Im[Sigma]= 35.915894 meV Z= 0.977347 lam= 0.023178
|
|
E( 3 )= 6.6716 eV Re[Sigma]= 116.357161 meV Im[Sigma]= 100.622228 meV Z= 1.003273 lam= -0.003262
|
|
E( 4 )= 6.6716 eV Re[Sigma]= 116.357161 meV Im[Sigma]= 100.622228 meV Z= 1.003273 lam= -0.003262
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 195 coord.: 0.4700000 0.4700000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.0909 eV Re[Sigma]= -187.813714 meV Im[Sigma]= 52.470169 meV Z= 0.984420 lam= 0.015827
|
|
E( 2 )= 2.2217 eV Re[Sigma]= -123.057468 meV Im[Sigma]= 36.677984 meV Z= 0.977275 lam= 0.023253
|
|
E( 3 )= 6.6491 eV Re[Sigma]= 115.653958 meV Im[Sigma]= 98.354993 meV Z= 1.002094 lam= -0.002090
|
|
E( 4 )= 6.6491 eV Re[Sigma]= 115.653958 meV Im[Sigma]= 98.354993 meV Z= 1.002094 lam= -0.002090
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 196 coord.: 0.4750000 0.4750000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.2322 eV Re[Sigma]= -183.751540 meV Im[Sigma]= 50.335212 meV Z= 0.983342 lam= 0.016940
|
|
E( 2 )= 2.0731 eV Re[Sigma]= -127.017121 meV Im[Sigma]= 36.196864 meV Z= 0.976575 lam= 0.023987
|
|
E( 3 )= 6.6301 eV Re[Sigma]= 114.887411 meV Im[Sigma]= 96.139370 meV Z= 1.001005 lam= -0.001004
|
|
E( 4 )= 6.6301 eV Re[Sigma]= 114.887411 meV Im[Sigma]= 96.139370 meV Z= 1.001005 lam= -0.001004
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 197 coord.: 0.4800000 0.4800000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.3675 eV Re[Sigma]= -179.033206 meV Im[Sigma]= 48.135777 meV Z= 0.982577 lam= 0.017732
|
|
E( 2 )= 1.9316 eV Re[Sigma]= -131.587283 meV Im[Sigma]= 34.904360 meV Z= 0.975609 lam= 0.025001
|
|
E( 3 )= 6.6145 eV Re[Sigma]= 114.048286 meV Im[Sigma]= 93.947143 meV Z= 0.999994 lam= 0.000006
|
|
E( 4 )= 6.6145 eV Re[Sigma]= 114.048286 meV Im[Sigma]= 93.947143 meV Z= 0.999994 lam= 0.000006
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 198 coord.: 0.4850000 0.4850000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.4928 eV Re[Sigma]= -173.091412 meV Im[Sigma]= 46.056355 meV Z= 0.981973 lam= 0.018358
|
|
E( 2 )= 1.8017 eV Re[Sigma]= -137.289432 meV Im[Sigma]= 33.219119 meV Z= 0.974466 lam= 0.026203
|
|
E( 3 )= 6.6023 eV Re[Sigma]= 113.129382 meV Im[Sigma]= 91.753964 meV Z= 0.999034 lam= 0.000967
|
|
E( 4 )= 6.6023 eV Re[Sigma]= 113.129382 meV Im[Sigma]= 91.753964 meV Z= 0.999034 lam= 0.000967
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 199 coord.: 0.4900000 0.4900000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.6003 eV Re[Sigma]= -165.129731 meV Im[Sigma]= 44.133001 meV Z= 0.981497 lam= 0.018852
|
|
E( 2 )= 1.6908 eV Re[Sigma]= -144.932130 meV Im[Sigma]= 31.441263 meV Z= 0.973137 lam= 0.027604
|
|
E( 3 )= 6.5936 eV Re[Sigma]= 112.128204 meV Im[Sigma]= 89.542264 meV Z= 0.998093 lam= 0.001911
|
|
E( 4 )= 6.5936 eV Re[Sigma]= 112.128204 meV Im[Sigma]= 89.542264 meV Z= 0.998093 lam= 0.001911
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 200 coord.: 0.4950000 0.4950000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.6769 eV Re[Sigma]= -154.513463 meV Im[Sigma]= 42.243880 meV Z= 0.981240 lam= 0.019118
|
|
E( 2 )= 1.6122 eV Re[Sigma]= -155.180796 meV Im[Sigma]= 29.814052 meV Z= 0.971657 lam= 0.029170
|
|
E( 3 )= 6.5884 eV Re[Sigma]= 111.046845 meV Im[Sigma]= 87.302942 meV Z= 0.997132 lam= 0.002876
|
|
E( 4 )= 6.5884 eV Re[Sigma]= 111.046845 meV Im[Sigma]= 87.302942 meV Z= 0.997132 lam= 0.002876
|
|
-------------------------------------------------------------------
|
|
|
|
|
|
ik = 201 coord.: 0.5000000 0.5000000 0.0000000
|
|
-------------------------------------------------------------------
|
|
E( 1 )= 0.7055 eV Re[Sigma]= -142.455579 meV Im[Sigma]= 40.190822 meV Z= 0.981166 lam= 0.019196
|
|
E( 2 )= 1.5829 eV Re[Sigma]= -166.849492 meV Im[Sigma]= 28.618337 meV Z= 0.970246 lam= 0.030666
|
|
E( 3 )= 6.5867 eV Re[Sigma]= 109.891122 meV Im[Sigma]= 85.035723 meV Z= 0.996118 lam= 0.003897
|
|
E( 4 )= 6.5867 eV Re[Sigma]= 109.891122 meV Im[Sigma]= 85.035723 meV Z= 0.996118 lam= 0.003897
|
|
-------------------------------------------------------------------
|
|
|
|
1 1 -2.0314 -92.9992 488.1265 1.2646 -0.2092
|
|
2 1 -2.0404 -104.3004 502.4852 1.2762 -0.2164
|
|
3 1 -2.0668 -121.8243 494.0490 1.2657 -0.2099
|
|
4 1 -2.1086 -142.7209 466.2144 1.2385 -0.1926
|
|
5 1 -2.1632 -163.8596 425.8671 1.2039 -0.1694
|
|
6 1 -2.2281 -183.0355 380.3885 1.1693 -0.1448
|
|
7 1 -2.3010 -199.2403 335.2308 1.1382 -0.1214
|
|
8 1 -2.3799 -212.2612 293.0982 1.1105 -0.0995
|
|
9 1 -2.4632 -222.1351 254.5537 1.0848 -0.0782
|
|
10 1 -2.5499 -228.8526 219.1925 1.0601 -0.0567
|
|
11 1 -2.6391 -232.4222 186.5971 1.0372 -0.0359
|
|
12 1 -2.7300 -233.0873 156.7599 1.0180 -0.0176
|
|
13 1 -2.8223 -231.3925 130.0478 1.0034 -0.0034
|
|
14 1 -2.9156 -228.0276 106.9394 0.9934 0.0066
|
|
15 1 -3.0096 -223.6322 87.7543 0.9870 0.0132
|
|
16 1 -3.1040 -218.6969 72.4991 0.9832 0.0171
|
|
17 1 -3.1987 -213.5538 60.8600 0.9812 0.0192
|
|
18 1 -3.2937 -208.4067 52.2990 0.9802 0.0202
|
|
19 1 -3.3887 -203.3778 46.1885 0.9801 0.0203
|
|
20 1 -3.4838 -198.5486 41.9274 0.9804 0.0200
|
|
21 1 -3.5788 -193.9877 39.0106 0.9810 0.0193
|
|
22 1 -3.6737 -189.6981 37.0510 0.9818 0.0185
|
|
23 1 -3.7685 -185.6592 35.7709 0.9827 0.0176
|
|
24 1 -3.8631 -181.8574 34.9776 0.9837 0.0166
|
|
25 1 -3.9575 -178.2791 34.5387 0.9846 0.0156
|
|
26 1 -4.0516 -174.9095 34.3617 0.9856 0.0146
|
|
27 1 -4.1455 -171.7332 34.3804 0.9866 0.0136
|
|
28 1 -4.2390 -168.7353 34.5457 0.9876 0.0126
|
|
29 1 -4.3322 -165.9014 34.8210 0.9885 0.0116
|
|
30 1 -4.4250 -163.2184 35.1780 0.9894 0.0107
|
|
31 1 -4.5173 -160.6741 35.5955 0.9902 0.0098
|
|
32 1 -4.6092 -158.2579 36.0576 0.9911 0.0090
|
|
33 1 -4.7005 -155.9601 36.5524 0.9919 0.0082
|
|
34 1 -4.7914 -153.7721 37.0711 0.9927 0.0074
|
|
35 1 -4.8816 -151.6860 37.6070 0.9934 0.0066
|
|
36 1 -4.9711 -149.6850 38.1545 0.9941 0.0059
|
|
37 1 -5.0600 -147.7330 38.7079 0.9949 0.0052
|
|
38 1 -5.1482 -145.8878 39.2602 0.9956 0.0044
|
|
39 1 -5.2355 -144.1464 39.8011 0.9963 0.0037
|
|
40 1 -5.3221 -142.4900 40.3160 0.9970 0.0031
|
|
41 1 -5.4077 -140.9109 40.7836 0.9976 0.0024
|
|
42 1 -5.4925 -139.4035 41.1755 0.9983 0.0017
|
|
43 1 -5.5762 -137.9625 41.4558 0.9989 0.0011
|
|
44 1 -5.6589 -136.5811 41.5827 0.9995 0.0005
|
|
45 1 -5.7406 -135.2502 41.5117 1.0000 0.0000
|
|
46 1 -5.8211 -133.9575 41.2017 1.0004 -0.0004
|
|
47 1 -5.9005 -132.6849 40.6214 1.0007 -0.0007
|
|
48 1 -5.9786 -131.4076 39.7575 1.0008 -0.0008
|
|
49 1 -6.0555 -130.0950 38.6202 1.0007 -0.0007
|
|
50 1 -6.1311 -128.7081 37.2467 1.0003 -0.0003
|
|
51 1 -6.2054 -127.2107 35.6999 0.9996 0.0004
|
|
52 1 -6.2783 -125.5736 34.0621 0.9988 0.0012
|
|
53 1 -6.3498 -123.7840 32.4259 0.9979 0.0021
|
|
54 1 -6.4198 -121.8545 30.8818 0.9972 0.0028
|
|
55 1 -6.4884 -119.8137 29.5070 0.9967 0.0033
|
|
56 1 -6.5554 -117.6978 28.3575 0.9964 0.0036
|
|
57 1 -6.6209 -115.5454 27.4636 0.9964 0.0036
|
|
58 1 -6.6849 -113.3870 26.8304 0.9965 0.0035
|
|
59 1 -6.7473 -111.2432 26.4423 0.9967 0.0033
|
|
60 1 -6.8081 -109.1315 26.2690 0.9970 0.0030
|
|
61 1 -6.8672 -107.0615 26.2731 0.9974 0.0026
|
|
62 1 -6.9248 -105.0372 26.4159 0.9978 0.0022
|
|
63 1 -6.9806 -103.0633 26.6616 0.9982 0.0018
|
|
64 1 -7.0349 -101.1417 26.9806 0.9986 0.0014
|
|
65 1 -7.0875 -99.2708 27.3498 0.9990 0.0010
|
|
66 1 -7.1384 -97.4518 27.7525 0.9994 0.0006
|
|
67 1 -7.1876 -95.6847 28.1776 0.9997 0.0003
|
|
68 1 -7.2352 -93.9664 28.6180 1.0001 -0.0001
|
|
69 1 -7.2811 -92.2980 29.0700 1.0005 -0.0005
|
|
70 1 -7.3253 -90.6787 29.5320 1.0009 -0.0009
|
|
71 1 -7.3679 -89.1054 30.0038 1.0012 -0.0012
|
|
72 1 -7.4089 -87.5794 30.4860 1.0016 -0.0016
|
|
73 1 -7.4482 -86.0997 30.9801 1.0019 -0.0019
|
|
74 1 -7.4859 -84.6635 31.4876 1.0023 -0.0023
|
|
75 1 -7.5220 -83.2724 32.0104 1.0026 -0.0026
|
|
76 1 -7.5565 -81.9247 32.5504 1.0030 -0.0030
|
|
77 1 -7.5895 -80.6186 33.1095 1.0033 -0.0033
|
|
78 1 -7.6208 -79.3559 33.6896 1.0037 -0.0037
|
|
79 1 -7.6507 -78.1335 34.2927 1.0041 -0.0041
|
|
80 1 -7.6790 -76.9518 34.9205 1.0045 -0.0044
|
|
81 1 -7.7058 -75.8112 35.5747 1.0049 -0.0048
|
|
82 1 -7.7311 -74.7086 36.2566 1.0053 -0.0052
|
|
83 1 -7.7550 -73.6462 36.9677 1.0057 -0.0056
|
|
84 1 -7.7774 -72.6216 37.7092 1.0061 -0.0061
|
|
85 1 -7.7985 -71.6345 38.4819 1.0066 -0.0065
|
|
86 1 -7.8181 -70.6857 39.2868 1.0070 -0.0070
|
|
87 1 -7.8363 -69.7721 40.1245 1.0075 -0.0075
|
|
88 1 -7.8532 -68.8963 40.9953 1.0080 -0.0079
|
|
89 1 -7.8688 -68.0563 41.8998 1.0085 -0.0085
|
|
90 1 -7.8830 -67.2514 42.8380 1.0091 -0.0090
|
|
91 1 -7.8960 -66.4810 43.8101 1.0096 -0.0095
|
|
92 1 -7.9076 -65.7439 44.8160 1.0102 -0.0101
|
|
93 1 -7.9180 -65.0403 45.8559 1.0108 -0.0107
|
|
94 1 -7.9272 -64.3680 46.9295 1.0114 -0.0113
|
|
95 1 -7.9350 -63.7245 48.0369 1.0121 -0.0119
|
|
96 1 -7.9417 -63.1101 49.1779 1.0128 -0.0126
|
|
97 1 -7.9471 -62.5260 50.3527 1.0134 -0.0133
|
|
98 1 -7.9513 -61.9699 51.5611 1.0142 -0.0140
|
|
99 1 -7.9544 -61.4419 52.8035 1.0149 -0.0147
|
|
100 1 -7.9562 -60.9397 54.0798 1.0157 -0.0154
|
|
101 1 -7.9568 -60.4632 55.3904 1.0165 -0.0162
|
|
102 1 -7.9560 -61.0366 53.8840 1.0155 -0.0153
|
|
103 1 -7.9536 -61.6642 52.4254 1.0147 -0.0145
|
|
104 1 -7.9495 -62.3482 51.0137 1.0138 -0.0136
|
|
105 1 -7.9439 -63.0895 49.6478 1.0130 -0.0129
|
|
106 1 -7.9367 -63.8898 48.3267 1.0123 -0.0121
|
|
107 1 -7.9278 -64.7507 47.0493 1.0115 -0.0114
|
|
108 1 -7.9174 -65.6751 45.8143 1.0108 -0.0107
|
|
109 1 -7.9052 -66.6624 44.6203 1.0101 -0.0100
|
|
110 1 -7.8914 -67.7119 43.4663 1.0094 -0.0093
|
|
111 1 -7.8760 -68.8234 42.3508 1.0088 -0.0087
|
|
112 1 -7.8588 -69.9967 41.2727 1.0082 -0.0081
|
|
113 1 -7.8400 -71.2338 40.2307 1.0076 -0.0075
|
|
114 1 -7.8195 -72.5349 39.2235 1.0070 -0.0069
|
|
115 1 -7.7972 -73.9003 38.2500 1.0064 -0.0064
|
|
116 1 -7.7731 -75.3296 37.3090 1.0059 -0.0059
|
|
117 1 -7.7473 -76.8230 36.3993 1.0054 -0.0053
|
|
118 1 -7.7197 -78.3799 35.5199 1.0048 -0.0048
|
|
119 1 -7.6903 -80.0002 34.6697 1.0043 -0.0043
|
|
120 1 -7.6590 -81.6834 33.8477 1.0039 -0.0038
|
|
121 1 -7.6258 -83.4291 33.0528 1.0034 -0.0034
|
|
122 1 -7.5908 -85.2369 32.2842 1.0029 -0.0029
|
|
123 1 -7.5539 -87.1060 31.5408 1.0025 -0.0025
|
|
124 1 -7.5150 -89.0358 30.8219 1.0020 -0.0020
|
|
125 1 -7.4742 -91.0253 30.1264 1.0016 -0.0016
|
|
126 1 -7.4314 -93.0735 29.4537 1.0011 -0.0011
|
|
127 1 -7.3866 -95.1806 28.8029 1.0007 -0.0007
|
|
128 1 -7.3398 -97.3492 28.1732 1.0003 -0.0003
|
|
129 1 -7.2909 -99.5807 27.5639 0.9999 0.0001
|
|
130 1 -7.2400 -101.8729 26.9742 0.9994 0.0006
|
|
131 1 -7.1870 -104.2238 26.4035 0.9990 0.0010
|
|
132 1 -7.1320 -106.6326 25.8510 0.9986 0.0014
|
|
133 1 -7.0747 -109.0989 25.3163 0.9982 0.0018
|
|
134 1 -7.0154 -111.6224 24.7985 0.9977 0.0023
|
|
135 1 -6.9539 -114.2032 24.2974 0.9973 0.0027
|
|
136 1 -6.8903 -116.8411 23.8125 0.9969 0.0031
|
|
137 1 -6.8245 -119.5365 23.3444 0.9964 0.0036
|
|
138 1 -6.7566 -122.2894 22.8948 0.9960 0.0040
|
|
139 1 -6.6864 -125.1004 22.4681 0.9955 0.0045
|
|
140 1 -6.6141 -127.9694 22.0739 0.9951 0.0050
|
|
141 1 -6.5396 -130.8965 21.7303 0.9946 0.0054
|
|
142 1 -6.4629 -133.8807 21.4679 0.9941 0.0059
|
|
143 1 -6.3840 -136.9193 21.3332 0.9936 0.0064
|
|
144 1 -6.3029 -140.0065 21.3881 0.9932 0.0068
|
|
145 1 -6.2196 -143.1306 21.7039 0.9928 0.0072
|
|
146 1 -6.1342 -146.2698 22.3472 0.9926 0.0074
|
|
147 1 -6.0466 -149.3872 23.3592 0.9926 0.0075
|
|
148 1 -5.9569 -152.4267 24.7335 0.9929 0.0072
|
|
149 1 -5.8650 -155.3175 26.4024 0.9935 0.0065
|
|
150 1 -5.7710 -157.9935 28.2376 0.9944 0.0057
|
|
151 1 -5.6749 -160.4241 30.0717 0.9952 0.0048
|
|
152 1 -5.5767 -162.6308 31.7317 0.9958 0.0043
|
|
153 1 -5.4764 -164.6734 33.0762 0.9959 0.0041
|
|
154 1 -5.3741 -166.6204 34.0227 0.9957 0.0043
|
|
155 1 -5.2698 -168.5279 34.5557 0.9953 0.0047
|
|
156 1 -5.1636 -170.4334 34.7178 0.9947 0.0053
|
|
157 1 -5.0553 -172.3589 34.5878 0.9940 0.0060
|
|
158 1 -4.9452 -174.3130 34.2586 0.9932 0.0068
|
|
159 1 -4.8331 -176.2963 33.8181 0.9925 0.0076
|
|
160 1 -4.7192 -178.3134 33.3407 0.9917 0.0083
|
|
161 1 -4.6035 -180.3626 32.8842 0.9910 0.0091
|
|
162 1 -4.4860 -182.4378 32.4929 0.9903 0.0098
|
|
163 1 -4.3667 -184.5313 32.2011 0.9896 0.0105
|
|
164 1 -4.2458 -186.6342 32.0364 0.9890 0.0112
|
|
165 1 -4.1232 -188.7359 32.0218 0.9884 0.0117
|
|
166 1 -3.9989 -190.8234 32.1754 0.9879 0.0122
|
|
167 1 -3.8731 -192.8810 32.5099 0.9875 0.0126
|
|
168 1 -3.7458 -194.8900 33.0309 0.9873 0.0129
|
|
169 1 -3.6169 -196.8286 33.7354 0.9872 0.0130
|
|
170 1 -3.4866 -198.6725 34.6105 0.9873 0.0129
|
|
171 1 -3.3548 -200.3961 35.6331 0.9875 0.0126
|
|
172 1 -3.2218 -201.9755 36.7706 0.9879 0.0122
|
|
173 1 -3.0873 -203.3912 37.9822 0.9884 0.0117
|
|
174 1 -2.9516 -204.6310 39.2216 0.9889 0.0113
|
|
175 1 -2.8147 -205.6916 40.4405 0.9893 0.0108
|
|
176 1 -2.6766 -206.5784 41.5916 0.9895 0.0106
|
|
177 1 -2.5373 -207.3028 42.6328 0.9896 0.0105
|
|
178 1 -2.3970 -207.8802 43.5295 0.9895 0.0106
|
|
179 1 -2.2555 -208.3264 44.2571 0.9893 0.0109
|
|
180 1 -2.1131 -208.6563 44.8024 0.9888 0.0113
|
|
181 1 -1.9697 -208.8803 45.1634 0.9882 0.0119
|
|
182 1 -1.8254 -209.0058 45.3512 0.9876 0.0126
|
|
183 1 -1.6803 -209.0330 45.3914 0.9868 0.0134
|
|
184 1 -1.5343 -208.9554 45.3326 0.9860 0.0142
|
|
185 1 -1.3877 -208.7565 45.2597 0.9852 0.0150
|
|
186 1 -1.2403 -208.4079 45.3046 0.9845 0.0158
|
|
187 1 -1.0924 -207.8708 45.6414 0.9838 0.0165
|
|
188 1 -0.9440 -207.1020 46.4445 0.9832 0.0171
|
|
189 1 -0.7953 -206.0569 47.8711 0.9827 0.0176
|
|
190 1 -0.6463 -204.4995 50.6629 0.9833 0.0170
|
|
191 1 -0.4974 -201.9686 53.8104 0.9853 0.0149
|
|
192 1 -0.3487 -198.8192 55.2096 0.9868 0.0134
|
|
193 1 -0.2006 -195.2879 55.2555 0.9869 0.0133
|
|
194 1 -0.0538 -191.5971 54.2333 0.9858 0.0144
|
|
195 1 0.0909 -187.8137 52.4702 0.9844 0.0158
|
|
196 1 0.2322 -183.7515 50.3352 0.9833 0.0169
|
|
197 1 0.3675 -179.0332 48.1358 0.9826 0.0177
|
|
198 1 0.4928 -173.0914 46.0564 0.9820 0.0184
|
|
199 1 0.6003 -165.1297 44.1330 0.9815 0.0189
|
|
200 1 0.6769 -154.5135 42.2439 0.9812 0.0191
|
|
201 1 0.7055 -142.4556 40.1908 0.9812 0.0192
|
|
|
|
1 2 -0.4915 -6.7378 441.6365 1.2132 -0.1757
|
|
2 2 -0.4805 -2.7681 446.1362 1.2210 -0.1810
|
|
3 2 -0.4481 6.4956 427.7265 1.2080 -0.1722
|
|
4 2 -0.3962 18.4777 391.1138 1.1794 -0.1521
|
|
5 2 -0.3275 30.2698 344.0889 1.1439 -0.1258
|
|
6 2 -0.2445 39.8178 294.5429 1.1089 -0.0982
|
|
7 2 -0.1496 46.2501 248.2448 1.0784 -0.0727
|
|
8 2 -0.0448 49.5984 208.1489 1.0537 -0.0510
|
|
9 2 0.0686 50.3551 174.9441 1.0346 -0.0335
|
|
10 2 0.1891 49.1766 148.0561 1.0204 -0.0200
|
|
11 2 0.3160 46.6933 126.4529 1.0100 -0.0099
|
|
12 2 0.4486 43.4018 109.1048 1.0024 -0.0024
|
|
13 2 0.5863 39.6677 95.1446 0.9970 0.0030
|
|
14 2 0.7288 35.7427 83.8825 0.9931 0.0069
|
|
15 2 0.8756 31.7910 74.7802 0.9903 0.0098
|
|
16 2 1.0267 27.9158 67.4266 0.9883 0.0118
|
|
17 2 1.1816 24.1839 61.5312 0.9869 0.0133
|
|
18 2 1.3404 20.6480 56.9038 0.9860 0.0142
|
|
19 2 1.5028 17.3431 53.2955 0.9854 0.0148
|
|
20 2 1.6686 14.2643 50.4136 0.9851 0.0151
|
|
21 2 1.8378 11.3510 48.0206 0.9850 0.0152
|
|
22 2 2.0103 8.6138 46.1828 0.9851 0.0151
|
|
23 2 2.1858 6.0963 44.8946 0.9854 0.0148
|
|
24 2 2.3644 3.8224 43.9903 0.9860 0.0142
|
|
25 2 2.5459 1.8079 43.2165 0.9866 0.0136
|
|
26 2 2.7301 0.0538 42.2775 0.9872 0.0129
|
|
27 2 2.9170 -1.4859 40.9190 0.9876 0.0126
|
|
28 2 3.1065 -2.9508 39.0500 0.9871 0.0131
|
|
29 2 3.2984 -4.5774 36.8420 0.9855 0.0147
|
|
30 2 3.4925 -6.5714 34.7273 0.9836 0.0167
|
|
31 2 3.6889 -8.9312 33.2557 0.9823 0.0181
|
|
32 2 3.8873 -11.4271 32.8618 0.9822 0.0181
|
|
33 2 4.0875 -13.7404 33.6698 0.9834 0.0169
|
|
34 2 4.2895 -15.6296 35.4535 0.9852 0.0150
|
|
35 2 4.4931 -17.0404 37.7684 0.9868 0.0134
|
|
36 2 4.6981 -18.0617 40.1625 0.9878 0.0124
|
|
37 2 4.9045 -18.7850 42.3393 0.9883 0.0118
|
|
38 2 5.1119 -19.3643 44.2066 0.9886 0.0116
|
|
39 2 5.3204 -19.8278 45.8249 0.9887 0.0114
|
|
40 2 5.5296 -20.1604 47.3207 0.9889 0.0112
|
|
41 2 5.7395 -20.3498 48.8168 0.9891 0.0110
|
|
42 2 5.9499 -20.3821 50.4013 0.9893 0.0108
|
|
43 2 6.1606 -20.2419 52.1262 0.9896 0.0105
|
|
44 2 6.3714 -19.9106 54.0214 0.9899 0.0102
|
|
45 2 6.5822 -19.3661 56.1093 0.9902 0.0099
|
|
46 2 6.7928 -18.5824 58.4095 0.9906 0.0095
|
|
47 2 7.0031 -17.5314 60.9157 0.9911 0.0089
|
|
48 2 7.2127 -16.1921 63.5129 0.9917 0.0084
|
|
49 2 7.4217 -14.5798 65.8443 0.9922 0.0079
|
|
50 2 7.6298 -12.7995 67.3220 0.9924 0.0077
|
|
51 2 7.8368 -11.1098 67.5437 0.9920 0.0080
|
|
52 2 8.0426 -9.8316 66.8113 0.9914 0.0086
|
|
53 2 8.2470 -8.9798 65.9417 0.9911 0.0090
|
|
54 2 8.4498 -8.4025 65.4823 0.9902 0.0099
|
|
55 2 8.6509 -8.1672 65.4555 0.9885 0.0116
|
|
56 2 8.8501 -8.3377 65.8426 0.9868 0.0134
|
|
57 2 9.0473 -8.8148 66.9435 0.9858 0.0144
|
|
58 2 9.2422 -9.4253 69.2558 0.9854 0.0148
|
|
59 2 9.4348 -10.0159 73.2283 0.9857 0.0145
|
|
60 2 9.6249 -10.4643 79.1596 0.9866 0.0136
|
|
61 2 9.8124 -10.6471 87.1991 0.9883 0.0119
|
|
62 2 9.9970 -10.4065 97.3456 0.9911 0.0090
|
|
63 2 10.1787 -9.5332 109.4146 0.9953 0.0047
|
|
64 2 10.3573 -7.7750 123.0124 1.0012 -0.0012
|
|
65 2 10.5327 -4.8954 137.5626 1.0087 -0.0086
|
|
66 2 10.7047 -0.7791 152.4006 1.0168 -0.0165
|
|
67 2 10.8733 4.4854 166.9132 1.0243 -0.0237
|
|
68 2 11.0383 10.6207 180.6766 1.0302 -0.0294
|
|
69 2 11.1995 17.2666 193.5422 1.0344 -0.0333
|
|
70 2 11.3569 24.0983 205.6412 1.0373 -0.0360
|
|
71 2 11.5104 30.9007 217.3079 1.0396 -0.0381
|
|
72 2 11.6598 37.5933 228.9558 1.0422 -0.0405
|
|
73 2 11.8051 44.2129 240.9497 1.0457 -0.0437
|
|
74 2 11.9461 50.8570 253.5157 1.0503 -0.0479
|
|
75 2 12.0828 57.6257 266.7035 1.0560 -0.0531
|
|
76 2 12.2150 64.5946 280.4016 1.0629 -0.0592
|
|
77 2 12.3427 71.8071 294.3837 1.0706 -0.0660
|
|
78 2 12.4658 79.2754 308.3686 1.0792 -0.0734
|
|
79 2 12.5842 86.9884 322.0744 1.0884 -0.0812
|
|
80 2 12.6978 94.9130 335.2601 1.0981 -0.0894
|
|
81 2 12.8066 102.9980 347.7507 1.1082 -0.0976
|
|
82 2 12.9105 111.1786 359.4482 1.1183 -0.1058
|
|
83 2 13.0095 119.3768 370.3304 1.1284 -0.1138
|
|
84 2 13.1034 127.5083 380.4432 1.1381 -0.1214
|
|
85 2 13.1922 135.4846 389.8882 1.1475 -0.1285
|
|
86 2 13.2760 143.2176 398.8079 1.1563 -0.1352
|
|
87 2 13.3545 150.6250 407.3724 1.1645 -0.1412
|
|
88 2 13.4278 157.6304 415.7658 1.1721 -0.1468
|
|
89 2 13.4958 164.1678 424.1765 1.1793 -0.1520
|
|
90 2 13.5586 170.1807 432.7877 1.1862 -0.1570
|
|
91 2 13.6160 175.6213 441.7719 1.1930 -0.1618
|
|
92 2 13.6680 180.4486 451.2863 1.1999 -0.1666
|
|
93 2 13.7146 184.6255 461.4696 1.2073 -0.1717
|
|
94 2 13.7558 188.1169 472.4404 1.2153 -0.1771
|
|
95 2 13.7916 190.8860 484.2957 1.2241 -0.1831
|
|
96 2 13.8218 192.8910 497.1094 1.2341 -0.1897
|
|
97 2 13.8466 194.0829 510.9309 1.2453 -0.1970
|
|
98 2 13.8659 194.4053 525.7830 1.2580 -0.2051
|
|
99 2 13.8797 193.7914 541.6585 1.2723 -0.2140
|
|
100 2 13.8880 192.1649 558.5168 1.2883 -0.2238
|
|
101 2 13.8908 233.6069 675.8592 1.3671 -0.2685
|
|
102 2 13.8889 228.4341 660.9798 1.3531 -0.2610
|
|
103 2 13.8831 231.2975 642.4140 1.3332 -0.2499
|
|
104 2 13.8735 233.4629 624.3601 1.3147 -0.2394
|
|
105 2 13.8600 234.9914 606.8747 1.2976 -0.2293
|
|
106 2 13.8427 235.9404 589.9991 1.2819 -0.2199
|
|
107 2 13.8216 236.3639 573.7607 1.2674 -0.2110
|
|
108 2 13.7966 236.3123 558.1765 1.2542 -0.2027
|
|
109 2 13.7679 235.8321 543.2537 1.2421 -0.1949
|
|
110 2 13.7353 234.9663 528.9924 1.2311 -0.1877
|
|
111 2 13.6990 233.7544 515.3864 1.2210 -0.1810
|
|
112 2 13.6590 232.2326 502.4251 1.2118 -0.1748
|
|
113 2 13.6152 230.4335 490.0940 1.2035 -0.1691
|
|
114 2 13.5676 228.3869 478.3760 1.1959 -0.1638
|
|
115 2 13.5164 226.1203 467.2522 1.1890 -0.1589
|
|
116 2 13.4615 223.6583 456.7026 1.1827 -0.1545
|
|
117 2 13.4030 221.0234 446.7066 1.1770 -0.1504
|
|
118 2 13.3408 218.2363 437.2438 1.1718 -0.1466
|
|
119 2 13.2751 215.3152 428.2945 1.1671 -0.1432
|
|
120 2 13.2058 212.2772 419.8401 1.1629 -0.1401
|
|
121 2 13.1330 209.1372 411.8637 1.1591 -0.1372
|
|
122 2 13.0567 205.9092 404.3513 1.1556 -0.1346
|
|
123 2 12.9770 202.6054 397.2920 1.1524 -0.1323
|
|
124 2 12.8939 199.2368 390.6794 1.1496 -0.1301
|
|
125 2 12.8074 195.8133 384.5128 1.1471 -0.1282
|
|
126 2 12.7176 192.3432 378.7986 1.1448 -0.1265
|
|
127 2 12.6245 188.8334 373.5519 1.1427 -0.1249
|
|
128 2 12.5282 185.2888 368.7977 1.1409 -0.1235
|
|
129 2 12.4288 181.7122 364.5722 1.1393 -0.1223
|
|
130 2 12.3262 178.1047 360.9224 1.1380 -0.1213
|
|
131 2 12.2205 174.4635 357.9051 1.1369 -0.1204
|
|
132 2 12.1119 170.7812 355.5825 1.1360 -0.1197
|
|
133 2 12.0002 167.0437 354.0158 1.1355 -0.1193
|
|
134 2 11.8857 163.2278 353.2560 1.1353 -0.1192
|
|
135 2 11.7683 159.2993 353.3315 1.1356 -0.1194
|
|
136 2 11.6482 155.2096 354.2360 1.1365 -0.1201
|
|
137 2 11.5253 150.8964 355.9172 1.1380 -0.1213
|
|
138 2 11.3998 146.2872 358.2717 1.1403 -0.1230
|
|
139 2 11.2717 141.3114 361.1494 1.1430 -0.1251
|
|
140 2 11.1410 135.9181 364.3737 1.1460 -0.1274
|
|
141 2 11.0080 130.0951 367.7790 1.1488 -0.1295
|
|
142 2 10.8725 123.8754 371.2660 1.1509 -0.1311
|
|
143 2 10.7347 117.3234 374.8566 1.1521 -0.1321
|
|
144 2 10.5947 110.4999 378.7129 1.1525 -0.1323
|
|
145 2 10.4525 103.4115 383.0730 1.1526 -0.1324
|
|
146 2 10.3083 95.9514 388.0830 1.1530 -0.1327
|
|
147 2 10.1620 87.8606 393.5837 1.1546 -0.1339
|
|
148 2 10.0138 78.8037 398.9859 1.1573 -0.1359
|
|
149 2 9.8637 68.6235 403.3652 1.1594 -0.1375
|
|
150 2 9.7118 57.5218 405.7698 1.1594 -0.1375
|
|
151 2 9.5582 45.8984 405.5670 1.1570 -0.1357
|
|
152 2 9.4030 34.1035 402.6150 1.1527 -0.1325
|
|
153 2 9.2462 22.3564 397.1835 1.1473 -0.1284
|
|
154 2 9.0880 10.7780 389.7277 1.1409 -0.1235
|
|
155 2 8.9283 -0.5572 380.6866 1.1337 -0.1179
|
|
156 2 8.7673 -11.5840 370.3999 1.1253 -0.1114
|
|
157 2 8.6051 -22.2302 359.1266 1.1158 -0.1038
|
|
158 2 8.4417 -32.4184 347.0958 1.1053 -0.0953
|
|
159 2 8.2772 -42.0843 334.5275 1.0941 -0.0860
|
|
160 2 8.1117 -51.2111 321.5969 1.0828 -0.0764
|
|
161 2 7.9453 -59.8553 308.3549 1.0721 -0.0673
|
|
162 2 7.7780 -68.1489 294.6531 1.0628 -0.0591
|
|
163 2 7.6099 -76.2437 280.1380 1.0550 -0.0522
|
|
164 2 7.4411 -84.2423 264.3420 1.0485 -0.0463
|
|
165 2 7.2717 -92.1694 246.8371 1.0427 -0.0409
|
|
166 2 7.1017 -99.9315 227.3880 1.0366 -0.0353
|
|
167 2 6.9312 -107.2501 206.0598 1.0287 -0.0279
|
|
168 2 6.7602 -113.6644 183.2665 1.0184 -0.0180
|
|
169 2 6.5889 -118.6835 159.7529 1.0061 -0.0061
|
|
170 2 6.4173 -122.0284 136.5001 0.9938 0.0062
|
|
171 2 6.2455 -123.7643 114.5634 0.9834 0.0169
|
|
172 2 6.0735 -124.2275 94.8841 0.9756 0.0250
|
|
173 2 5.9013 -123.8482 78.1271 0.9705 0.0304
|
|
174 2 5.7292 -123.0150 64.5916 0.9674 0.0337
|
|
175 2 5.5570 -122.0244 54.2017 0.9658 0.0354
|
|
176 2 5.3849 -121.0845 46.5586 0.9652 0.0361
|
|
177 2 5.2130 -120.3366 41.0235 0.9653 0.0360
|
|
178 2 5.0412 -119.8691 36.8195 0.9657 0.0356
|
|
179 2 4.8696 -119.7008 33.1616 0.9660 0.0352
|
|
180 2 4.6984 -119.7269 29.4250 0.9658 0.0354
|
|
181 2 4.5275 -119.6831 25.3133 0.9644 0.0369
|
|
182 2 4.3570 -119.2684 20.9395 0.9623 0.0392
|
|
183 2 4.1870 -118.3743 16.7485 0.9605 0.0412
|
|
184 2 4.0175 -117.1271 13.3027 0.9595 0.0422
|
|
185 2 3.8486 -115.7309 11.0567 0.9593 0.0424
|
|
186 2 3.6804 -114.3510 10.2485 0.9597 0.0420
|
|
187 2 3.5130 -113.1013 10.9270 0.9604 0.0412
|
|
188 2 3.3464 -112.0788 13.0277 0.9616 0.0400
|
|
189 2 3.1808 -111.4132 16.3936 0.9633 0.0380
|
|
190 2 3.0163 -111.3557 20.7191 0.9660 0.0352
|
|
191 2 2.8532 -112.1129 25.4927 0.9696 0.0314
|
|
192 2 2.6917 -113.7542 30.0370 0.9733 0.0274
|
|
193 2 2.5322 -116.2890 33.6674 0.9761 0.0244
|
|
194 2 2.3752 -119.4716 35.9159 0.9773 0.0232
|
|
195 2 2.2217 -123.0575 36.6780 0.9773 0.0233
|
|
196 2 2.0731 -127.0171 36.1969 0.9766 0.0240
|
|
197 2 1.9316 -131.5873 34.9044 0.9756 0.0250
|
|
198 2 1.8017 -137.2894 33.2191 0.9745 0.0262
|
|
199 2 1.6908 -144.9321 31.4413 0.9731 0.0276
|
|
200 2 1.6122 -155.1808 29.8141 0.9717 0.0292
|
|
201 2 1.5829 -166.8495 28.6183 0.9702 0.0307
|
|
|
|
1 3 10.6149 -63.5629 440.8013 1.1840 -0.1554
|
|
2 3 10.6158 -59.6410 450.5815 1.1967 -0.1644
|
|
3 3 10.6184 -55.2062 460.4575 1.2102 -0.1737
|
|
4 3 10.6228 -50.2249 470.2978 1.2241 -0.1831
|
|
5 3 10.6289 -44.6757 479.9589 1.2380 -0.1923
|
|
6 3 10.6367 -38.5556 489.2881 1.2515 -0.2009
|
|
7 3 10.6463 -31.8853 498.1294 1.2638 -0.2087
|
|
8 3 10.6576 -24.7134 506.3291 1.2742 -0.2152
|
|
9 3 10.6706 -17.1172 513.7439 1.2821 -0.2200
|
|
10 3 10.6853 -9.2010 520.2483 1.2870 -0.2230
|
|
11 3 10.7016 -1.0888 525.7432 1.2887 -0.2240
|
|
12 3 10.7196 7.0884 530.1640 1.2875 -0.2233
|
|
13 3 10.7392 15.2056 533.4861 1.2836 -0.2210
|
|
14 3 10.7605 23.1567 535.7302 1.2779 -0.2175
|
|
15 3 10.7833 30.8641 536.9625 1.2712 -0.2133
|
|
16 3 10.8076 38.2837 537.2935 1.2641 -0.2089
|
|
17 3 10.8335 45.4041 536.8718 1.2573 -0.2046
|
|
18 3 10.8608 52.2425 535.8752 1.2512 -0.2007
|
|
19 3 10.8897 58.8367 534.4989 1.2459 -0.1974
|
|
20 3 10.9199 65.2370 532.9416 1.2416 -0.1946
|
|
21 3 10.9515 71.4976 531.3916 1.2381 -0.1923
|
|
22 3 10.9845 77.6760 530.0134 1.2354 -0.1905
|
|
23 3 11.0188 83.8263 528.9365 1.2332 -0.1891
|
|
24 3 11.0543 89.9945 528.2476 1.2313 -0.1879
|
|
25 3 11.0911 96.2177 527.9862 1.2296 -0.1867
|
|
26 3 11.1291 102.5234 528.1446 1.2279 -0.1856
|
|
27 3 11.1682 108.9301 528.6718 1.2261 -0.1844
|
|
28 3 11.2084 115.4470 529.4810 1.2240 -0.1830
|
|
29 3 11.2497 122.0752 530.4609 1.2216 -0.1814
|
|
30 3 11.2920 128.8070 531.4882 1.2188 -0.1795
|
|
31 3 11.3352 135.6270 532.4411 1.2157 -0.1774
|
|
32 3 11.3793 142.5130 533.2109 1.2122 -0.1750
|
|
33 3 11.4243 149.4412 533.7088 1.2085 -0.1725
|
|
34 3 11.4701 156.3943 533.8663 1.2046 -0.1699
|
|
35 3 11.5167 163.3670 533.6283 1.2008 -0.1672
|
|
36 3 11.5640 170.3661 532.9431 1.1971 -0.1646
|
|
37 3 11.6119 177.4076 531.7520 1.1935 -0.1622
|
|
38 3 11.6604 184.4781 529.9838 1.1901 -0.1598
|
|
39 3 11.7095 191.5750 527.5548 1.1869 -0.1575
|
|
40 3 11.7590 198.6963 524.3733 1.1837 -0.1552
|
|
41 3 11.8091 205.8320 520.3460 1.1807 -0.1530
|
|
42 3 11.8595 212.9658 515.3836 1.1776 -0.1508
|
|
43 3 11.9102 220.0733 509.4064 1.1744 -0.1485
|
|
44 3 11.9612 227.1203 502.3509 1.1710 -0.1461
|
|
45 3 12.0125 234.0597 494.1771 1.1672 -0.1432
|
|
46 3 12.0639 240.8289 484.8778 1.1627 -0.1399
|
|
47 3 12.1154 247.3483 474.4879 1.1574 -0.1360
|
|
48 3 12.1670 253.5211 463.0927 1.1510 -0.1312
|
|
49 3 12.2187 259.2360 450.8319 1.1435 -0.1255
|
|
50 3 12.2703 264.3768 437.9004 1.1348 -0.1188
|
|
51 3 12.3218 268.8334 424.5424 1.1253 -0.1113
|
|
52 3 12.3732 272.5193 411.0407 1.1152 -0.1033
|
|
53 3 12.4244 275.3880 397.7010 1.1052 -0.0952
|
|
54 3 12.4753 277.4413 384.8334 1.0958 -0.0874
|
|
55 3 12.5260 278.7312 372.7329 1.0875 -0.0804
|
|
56 3 12.5763 279.3508 361.6616 1.0806 -0.0746
|
|
57 3 12.6263 279.4167 351.8337 1.0753 -0.0701
|
|
58 3 12.6758 279.0545 343.4063 1.0716 -0.0668
|
|
59 3 12.7249 278.3848 336.4753 1.0692 -0.0648
|
|
60 3 12.7734 277.5134 331.0767 1.0681 -0.0637
|
|
61 3 12.8214 276.5287 327.1933 1.0679 -0.0636
|
|
62 3 12.8687 275.5019 324.7637 1.0686 -0.0642
|
|
63 3 12.9154 274.4865 323.6949 1.0699 -0.0654
|
|
64 3 12.9614 273.5224 323.8737 1.0718 -0.0670
|
|
65 3 13.0067 272.6389 325.1789 1.0741 -0.0690
|
|
66 3 13.0512 271.8552 327.4911 1.0767 -0.0713
|
|
67 3 13.0949 271.1839 330.7003 1.0796 -0.0738
|
|
68 3 13.1377 270.6330 334.7114 1.0828 -0.0765
|
|
69 3 13.1797 270.2052 339.4463 1.0862 -0.0794
|
|
70 3 13.2207 269.9006 344.8443 1.0898 -0.0824
|
|
71 3 13.2607 269.7175 350.8599 1.0936 -0.0856
|
|
72 3 13.2998 269.6508 357.4589 1.0977 -0.0890
|
|
73 3 13.3378 269.6944 364.6146 1.1019 -0.0925
|
|
74 3 13.3748 269.8415 372.3038 1.1063 -0.0961
|
|
75 3 13.4107 270.0822 380.5031 1.1110 -0.0999
|
|
76 3 13.4455 270.4067 389.1882 1.1159 -0.1039
|
|
77 3 13.4792 270.8036 398.3331 1.1211 -0.1080
|
|
78 3 13.5116 271.2593 407.9117 1.1266 -0.1124
|
|
79 3 13.5429 271.7603 417.8995 1.1325 -0.1170
|
|
80 3 13.5730 272.2908 428.2760 1.1387 -0.1218
|
|
81 3 13.6018 272.8337 439.0264 1.1454 -0.1269
|
|
82 3 13.6293 273.3718 450.1418 1.1524 -0.1323
|
|
83 3 13.6556 273.8856 461.6197 1.1599 -0.1379
|
|
84 3 13.6806 274.3556 473.4619 1.1680 -0.1438
|
|
85 3 13.7042 274.7613 485.6733 1.1765 -0.1500
|
|
86 3 13.7265 275.0810 498.2596 1.1856 -0.1565
|
|
87 3 13.7474 275.2937 511.2250 1.1952 -0.1633
|
|
88 3 13.7669 275.3765 524.5708 1.2055 -0.1704
|
|
89 3 13.7851 275.3078 538.2937 1.2163 -0.1778
|
|
90 3 13.8019 275.0656 552.3860 1.2277 -0.1855
|
|
91 3 13.8172 274.6284 566.8347 1.2398 -0.1934
|
|
92 3 13.8311 273.9758 581.6224 1.2526 -0.2016
|
|
93 3 13.8436 273.0879 596.7274 1.2660 -0.2101
|
|
94 3 13.8546 271.9472 612.1251 1.2802 -0.2189
|
|
95 3 13.8642 270.5368 627.7882 1.2950 -0.2278
|
|
96 3 13.8723 268.8421 643.6878 1.3106 -0.2370
|
|
97 3 13.8789 266.8494 659.7937 1.3270 -0.2464
|
|
98 3 13.8841 264.5474 676.0749 1.3441 -0.2560
|
|
99 3 13.8878 261.9257 692.4997 1.3619 -0.2657
|
|
100 3 13.8900 258.9761 709.0357 1.3805 -0.2756
|
|
101 3 13.8908 233.6069 675.8592 1.3671 -0.2685
|
|
102 3 13.8889 241.2283 654.2508 1.3422 -0.2549
|
|
103 3 13.8833 243.7650 634.9346 1.3221 -0.2436
|
|
104 3 13.8740 245.6742 615.9262 1.3033 -0.2327
|
|
105 3 13.8610 247.0140 597.2863 1.2858 -0.2223
|
|
106 3 13.8443 247.8399 579.0608 1.2694 -0.2122
|
|
107 3 13.8239 248.2048 561.2835 1.2542 -0.2027
|
|
108 3 13.7998 248.1581 543.9773 1.2400 -0.1936
|
|
109 3 13.7721 247.7480 527.1563 1.2269 -0.1849
|
|
110 3 13.7408 247.0191 510.8273 1.2147 -0.1767
|
|
111 3 13.7060 246.0131 494.9912 1.2033 -0.1689
|
|
112 3 13.6676 244.7687 479.6444 1.1927 -0.1616
|
|
113 3 13.6257 243.3214 464.7792 1.1829 -0.1546
|
|
114 3 13.5804 241.7047 450.3856 1.1736 -0.1480
|
|
115 3 13.5317 239.9495 436.4512 1.1650 -0.1417
|
|
116 3 13.4797 238.0846 422.9624 1.1570 -0.1357
|
|
117 3 13.4244 236.1368 409.9048 1.1494 -0.1300
|
|
118 3 13.3658 234.1310 397.2636 1.1423 -0.1246
|
|
119 3 13.3041 232.0903 385.0241 1.1356 -0.1194
|
|
120 3 13.2393 230.0360 373.1721 1.1292 -0.1144
|
|
121 3 13.1714 227.9881 361.6942 1.1231 -0.1096
|
|
122 3 13.1006 225.9651 350.5782 1.1174 -0.1051
|
|
123 3 13.0270 223.9842 339.8136 1.1119 -0.1007
|
|
124 3 12.9505 222.0613 329.3921 1.1067 -0.0964
|
|
125 3 12.8713 220.2111 319.3080 1.1016 -0.0923
|
|
126 3 12.7895 218.4470 309.5589 1.0968 -0.0882
|
|
127 3 12.7051 216.7814 300.1464 1.0921 -0.0843
|
|
128 3 12.6183 215.2248 291.0763 1.0876 -0.0805
|
|
129 3 12.5291 213.7866 282.3596 1.0832 -0.0768
|
|
130 3 12.4376 212.4756 274.0119 1.0790 -0.0732
|
|
131 3 12.3439 211.2985 266.0535 1.0748 -0.0696
|
|
132 3 12.2482 210.2602 258.5084 1.0708 -0.0662
|
|
133 3 12.1505 209.3632 251.4016 1.0670 -0.0628
|
|
134 3 12.0509 208.6069 244.7570 1.0633 -0.0595
|
|
135 3 11.9495 207.9872 238.5932 1.0597 -0.0563
|
|
136 3 11.8465 207.4958 232.9191 1.0564 -0.0534
|
|
137 3 11.7419 207.1193 227.7305 1.0533 -0.0506
|
|
138 3 11.6358 206.8395 223.0061 1.0504 -0.0480
|
|
139 3 11.5284 206.6342 218.7078 1.0479 -0.0457
|
|
140 3 11.4198 206.4796 214.7836 1.0456 -0.0436
|
|
141 3 11.3100 206.3551 211.1781 1.0436 -0.0417
|
|
142 3 11.1993 206.2481 207.8511 1.0416 -0.0400
|
|
143 3 11.0876 206.1581 204.8046 1.0397 -0.0382
|
|
144 3 10.9751 206.0961 202.1127 1.0377 -0.0363
|
|
145 3 10.8620 206.0752 199.9410 1.0356 -0.0343
|
|
146 3 10.7483 206.0922 198.5367 1.0334 -0.0323
|
|
147 3 10.6342 206.0981 198.1727 1.0315 -0.0305
|
|
148 3 10.5197 205.9633 199.0488 1.0303 -0.0295
|
|
149 3 10.4050 205.4583 201.1744 1.0304 -0.0295
|
|
150 3 10.2902 204.3002 204.2782 1.0316 -0.0306
|
|
151 3 10.1754 202.2784 207.7952 1.0334 -0.0323
|
|
152 3 10.0608 199.3555 210.9654 1.0349 -0.0337
|
|
153 3 9.9464 195.6650 213.0290 1.0355 -0.0343
|
|
154 3 9.8323 191.4733 213.4475 1.0349 -0.0337
|
|
155 3 9.7187 187.0984 212.0444 1.0331 -0.0320
|
|
156 3 9.6057 182.7955 209.0018 1.0306 -0.0297
|
|
157 3 9.4933 178.7123 204.7322 1.0279 -0.0272
|
|
158 3 9.3818 174.9136 199.7108 1.0253 -0.0246
|
|
159 3 9.2711 171.4169 194.3535 1.0228 -0.0223
|
|
160 3 9.1615 168.2114 188.9722 1.0206 -0.0201
|
|
161 3 9.0529 165.2770 183.7870 1.0186 -0.0183
|
|
162 3 8.9456 162.5885 178.9581 1.0169 -0.0167
|
|
163 3 8.8396 160.1140 174.6062 1.0156 -0.0153
|
|
164 3 8.7350 157.8118 170.8119 1.0146 -0.0144
|
|
165 3 8.6319 155.6275 167.6018 1.0140 -0.0138
|
|
166 3 8.5305 153.4962 164.9366 1.0138 -0.0136
|
|
167 3 8.4307 151.3611 162.7186 1.0140 -0.0138
|
|
168 3 8.3328 149.2001 160.8174 1.0143 -0.0141
|
|
169 3 8.2367 147.0337 159.1060 1.0145 -0.0143
|
|
170 3 8.1427 144.9023 157.4868 1.0146 -0.0144
|
|
171 3 8.0507 142.8409 155.9015 1.0147 -0.0145
|
|
172 3 7.9608 140.8689 154.3220 1.0147 -0.0145
|
|
173 3 7.8732 138.9927 152.7347 1.0148 -0.0146
|
|
174 3 7.7880 137.2104 151.1257 1.0150 -0.0148
|
|
175 3 7.7051 135.5167 149.4729 1.0152 -0.0150
|
|
176 3 7.6247 133.9054 147.7462 1.0155 -0.0152
|
|
177 3 7.5468 132.3708 145.9114 1.0158 -0.0155
|
|
178 3 7.4716 130.9086 143.9366 1.0160 -0.0158
|
|
179 3 7.3990 129.5167 141.7970 1.0162 -0.0160
|
|
180 3 7.3292 128.1941 139.4787 1.0164 -0.0161
|
|
181 3 7.2623 126.9420 136.9800 1.0164 -0.0161
|
|
182 3 7.1982 125.7621 134.3116 1.0162 -0.0160
|
|
183 3 7.1370 124.6566 131.4951 1.0159 -0.0157
|
|
184 3 7.0788 123.6273 128.5615 1.0154 -0.0151
|
|
185 3 7.0237 122.6742 125.5480 1.0147 -0.0144
|
|
186 3 6.9717 121.7960 122.4958 1.0137 -0.0135
|
|
187 3 6.9228 120.9884 119.4470 1.0126 -0.0125
|
|
188 3 6.8770 120.2444 116.4417 1.0114 -0.0113
|
|
189 3 6.8345 119.5533 113.5146 1.0101 -0.0100
|
|
190 3 6.7953 118.8939 110.6929 1.0087 -0.0086
|
|
191 3 6.7594 118.2566 107.9931 1.0073 -0.0072
|
|
192 3 6.7267 117.6375 105.4208 1.0059 -0.0059
|
|
193 3 6.6975 117.0113 102.9694 1.0045 -0.0045
|
|
194 3 6.6716 116.3572 100.6222 1.0033 -0.0033
|
|
195 3 6.6491 115.6540 98.3550 1.0021 -0.0021
|
|
196 3 6.6301 114.8874 96.1394 1.0010 -0.0010
|
|
197 3 6.6145 114.0483 93.9471 1.0000 0.0000
|
|
198 3 6.6023 113.1294 91.7540 0.9990 0.0010
|
|
199 3 6.5936 112.1282 89.5423 0.9981 0.0019
|
|
200 3 6.5884 111.0468 87.3029 0.9971 0.0029
|
|
201 3 6.5867 109.8911 85.0357 0.9961 0.0039
|
|
|
|
1 4 10.6149 -63.5629 440.8013 1.1840 -0.1554
|
|
2 4 10.6158 -59.6410 450.5815 1.1967 -0.1644
|
|
3 4 10.6184 -55.2062 460.4575 1.2102 -0.1737
|
|
4 4 10.6228 -50.2249 470.2978 1.2241 -0.1831
|
|
5 4 10.6289 -44.6757 479.9589 1.2380 -0.1923
|
|
6 4 10.6367 -38.5556 489.2881 1.2515 -0.2009
|
|
7 4 10.6463 -31.8853 498.1294 1.2638 -0.2087
|
|
8 4 10.6576 -24.7134 506.3291 1.2742 -0.2152
|
|
9 4 10.6706 -17.1172 513.7439 1.2821 -0.2200
|
|
10 4 10.6853 -9.2010 520.2483 1.2870 -0.2230
|
|
11 4 10.7016 -1.0888 525.7432 1.2887 -0.2240
|
|
12 4 10.7196 7.0884 530.1640 1.2875 -0.2233
|
|
13 4 10.7392 15.2056 533.4861 1.2836 -0.2210
|
|
14 4 10.7605 23.1567 535.7302 1.2779 -0.2175
|
|
15 4 10.7833 30.8641 536.9625 1.2712 -0.2133
|
|
16 4 10.8076 38.2837 537.2935 1.2641 -0.2089
|
|
17 4 10.8335 45.4041 536.8718 1.2573 -0.2046
|
|
18 4 10.8608 52.2425 535.8752 1.2512 -0.2007
|
|
19 4 10.8897 58.8367 534.4989 1.2459 -0.1974
|
|
20 4 10.9199 65.2370 532.9416 1.2416 -0.1946
|
|
21 4 10.9515 71.4976 531.3916 1.2381 -0.1923
|
|
22 4 10.9845 77.6760 530.0134 1.2354 -0.1905
|
|
23 4 11.0188 83.8263 528.9365 1.2332 -0.1891
|
|
24 4 11.0543 89.9945 528.2476 1.2313 -0.1879
|
|
25 4 11.0911 96.2177 527.9862 1.2296 -0.1867
|
|
26 4 11.1291 102.5234 528.1446 1.2279 -0.1856
|
|
27 4 11.1682 108.9301 528.6718 1.2261 -0.1844
|
|
28 4 11.2084 115.4470 529.4810 1.2240 -0.1830
|
|
29 4 11.2497 122.0752 530.4609 1.2216 -0.1814
|
|
30 4 11.2920 128.8070 531.4882 1.2188 -0.1795
|
|
31 4 11.3352 135.6270 532.4411 1.2157 -0.1774
|
|
32 4 11.3793 142.5130 533.2109 1.2122 -0.1750
|
|
33 4 11.4243 149.4412 533.7088 1.2085 -0.1725
|
|
34 4 11.4701 156.3943 533.8663 1.2046 -0.1699
|
|
35 4 11.5167 163.3670 533.6283 1.2008 -0.1672
|
|
36 4 11.5640 170.3661 532.9431 1.1971 -0.1646
|
|
37 4 11.6119 177.4076 531.7520 1.1935 -0.1622
|
|
38 4 11.6604 184.4781 529.9838 1.1901 -0.1598
|
|
39 4 11.7095 191.5750 527.5548 1.1869 -0.1575
|
|
40 4 11.7590 198.6963 524.3733 1.1837 -0.1552
|
|
41 4 11.8091 205.8320 520.3460 1.1807 -0.1530
|
|
42 4 11.8595 212.9658 515.3836 1.1776 -0.1508
|
|
43 4 11.9102 220.0733 509.4064 1.1744 -0.1485
|
|
44 4 11.9612 227.1203 502.3509 1.1710 -0.1461
|
|
45 4 12.0125 234.0597 494.1771 1.1672 -0.1432
|
|
46 4 12.0639 240.8289 484.8778 1.1627 -0.1399
|
|
47 4 12.1154 247.3483 474.4879 1.1574 -0.1360
|
|
48 4 12.1670 253.5211 463.0927 1.1510 -0.1312
|
|
49 4 12.2187 259.2360 450.8319 1.1435 -0.1255
|
|
50 4 12.2703 264.3768 437.9004 1.1348 -0.1188
|
|
51 4 12.3218 268.8334 424.5424 1.1253 -0.1113
|
|
52 4 12.3732 272.5193 411.0407 1.1152 -0.1033
|
|
53 4 12.4244 275.3880 397.7010 1.1052 -0.0952
|
|
54 4 12.4753 277.4413 384.8334 1.0958 -0.0874
|
|
55 4 12.5260 278.7312 372.7329 1.0875 -0.0804
|
|
56 4 12.5763 279.3508 361.6616 1.0806 -0.0746
|
|
57 4 12.6263 279.4167 351.8337 1.0753 -0.0701
|
|
58 4 12.6758 279.0545 343.4063 1.0716 -0.0668
|
|
59 4 12.7249 278.3848 336.4753 1.0692 -0.0648
|
|
60 4 12.7734 277.5134 331.0767 1.0681 -0.0637
|
|
61 4 12.8214 276.5287 327.1933 1.0679 -0.0636
|
|
62 4 12.8687 275.5019 324.7637 1.0686 -0.0642
|
|
63 4 12.9154 274.4865 323.6949 1.0699 -0.0654
|
|
64 4 12.9614 273.5224 323.8737 1.0718 -0.0670
|
|
65 4 13.0067 272.6389 325.1789 1.0741 -0.0690
|
|
66 4 13.0512 271.8552 327.4911 1.0767 -0.0713
|
|
67 4 13.0949 271.1839 330.7003 1.0796 -0.0738
|
|
68 4 13.1377 270.6330 334.7114 1.0828 -0.0765
|
|
69 4 13.1797 270.2052 339.4463 1.0862 -0.0794
|
|
70 4 13.2207 269.9006 344.8443 1.0898 -0.0824
|
|
71 4 13.2607 269.7175 350.8599 1.0936 -0.0856
|
|
72 4 13.2998 269.6508 357.4589 1.0977 -0.0890
|
|
73 4 13.3378 269.6944 364.6146 1.1019 -0.0925
|
|
74 4 13.3748 269.8415 372.3038 1.1063 -0.0961
|
|
75 4 13.4107 270.0822 380.5031 1.1110 -0.0999
|
|
76 4 13.4455 270.4067 389.1882 1.1159 -0.1039
|
|
77 4 13.4792 270.8036 398.3331 1.1211 -0.1080
|
|
78 4 13.5116 271.2593 407.9117 1.1266 -0.1124
|
|
79 4 13.5429 271.7603 417.8995 1.1325 -0.1170
|
|
80 4 13.5730 272.2908 428.2760 1.1387 -0.1218
|
|
81 4 13.6018 272.8337 439.0264 1.1454 -0.1269
|
|
82 4 13.6293 273.3718 450.1418 1.1524 -0.1323
|
|
83 4 13.6556 273.8856 461.6197 1.1599 -0.1379
|
|
84 4 13.6806 274.3556 473.4619 1.1680 -0.1438
|
|
85 4 13.7042 274.7613 485.6733 1.1765 -0.1500
|
|
86 4 13.7265 275.0810 498.2596 1.1856 -0.1565
|
|
87 4 13.7474 275.2937 511.2250 1.1952 -0.1633
|
|
88 4 13.7669 275.3765 524.5708 1.2055 -0.1704
|
|
89 4 13.7851 275.3078 538.2937 1.2163 -0.1778
|
|
90 4 13.8019 275.0656 552.3860 1.2277 -0.1855
|
|
91 4 13.8172 274.6284 566.8347 1.2398 -0.1934
|
|
92 4 13.8311 273.9758 581.6224 1.2526 -0.2016
|
|
93 4 13.8436 273.0879 596.7274 1.2660 -0.2101
|
|
94 4 13.8546 271.9472 612.1251 1.2802 -0.2189
|
|
95 4 13.8642 270.5368 627.7882 1.2950 -0.2278
|
|
96 4 13.8723 268.8421 643.6878 1.3106 -0.2370
|
|
97 4 13.8789 266.8494 659.7937 1.3270 -0.2464
|
|
98 4 13.8841 264.5474 676.0749 1.3441 -0.2560
|
|
99 4 13.8878 261.9257 692.4997 1.3619 -0.2657
|
|
100 4 13.8900 258.9761 709.0357 1.3805 -0.2756
|
|
101 4 13.8908 233.6069 675.8592 1.3671 -0.2685
|
|
102 4 13.8889 241.2283 654.2508 1.3422 -0.2549
|
|
103 4 13.8833 243.7650 634.9346 1.3221 -0.2436
|
|
104 4 13.8740 245.6742 615.9262 1.3033 -0.2327
|
|
105 4 13.8610 247.0140 597.2863 1.2858 -0.2223
|
|
106 4 13.8443 247.8399 579.0608 1.2694 -0.2122
|
|
107 4 13.8239 248.2048 561.2835 1.2542 -0.2027
|
|
108 4 13.7998 248.1581 543.9773 1.2400 -0.1936
|
|
109 4 13.7721 247.7480 527.1563 1.2269 -0.1849
|
|
110 4 13.7408 247.0191 510.8273 1.2147 -0.1767
|
|
111 4 13.7060 246.0131 494.9912 1.2033 -0.1689
|
|
112 4 13.6676 244.7687 479.6444 1.1927 -0.1616
|
|
113 4 13.6257 243.3214 464.7792 1.1829 -0.1546
|
|
114 4 13.5804 241.7047 450.3856 1.1736 -0.1480
|
|
115 4 13.5317 239.9495 436.4512 1.1650 -0.1417
|
|
116 4 13.4797 238.0846 422.9624 1.1570 -0.1357
|
|
117 4 13.4244 236.1368 409.9048 1.1494 -0.1300
|
|
118 4 13.3658 234.1310 397.2636 1.1423 -0.1246
|
|
119 4 13.3041 232.0903 385.0241 1.1356 -0.1194
|
|
120 4 13.2393 230.0360 373.1721 1.1292 -0.1144
|
|
121 4 13.1714 227.9881 361.6942 1.1231 -0.1096
|
|
122 4 13.1006 225.9651 350.5782 1.1174 -0.1051
|
|
123 4 13.0270 223.9842 339.8136 1.1119 -0.1007
|
|
124 4 12.9505 222.0613 329.3921 1.1067 -0.0964
|
|
125 4 12.8713 220.2111 319.3080 1.1016 -0.0923
|
|
126 4 12.7895 218.4470 309.5589 1.0968 -0.0882
|
|
127 4 12.7051 216.7814 300.1464 1.0921 -0.0843
|
|
128 4 12.6183 215.2248 291.0763 1.0876 -0.0805
|
|
129 4 12.5291 213.7866 282.3596 1.0832 -0.0768
|
|
130 4 12.4376 212.4756 274.0119 1.0790 -0.0732
|
|
131 4 12.3439 211.2985 266.0535 1.0748 -0.0696
|
|
132 4 12.2482 210.2602 258.5084 1.0708 -0.0662
|
|
133 4 12.1505 209.3632 251.4016 1.0670 -0.0628
|
|
134 4 12.0509 208.6069 244.7570 1.0633 -0.0595
|
|
135 4 11.9495 207.9872 238.5932 1.0597 -0.0563
|
|
136 4 11.8465 207.4958 232.9191 1.0564 -0.0534
|
|
137 4 11.7419 207.1193 227.7305 1.0533 -0.0506
|
|
138 4 11.6358 206.8395 223.0061 1.0504 -0.0480
|
|
139 4 11.5284 206.6342 218.7078 1.0479 -0.0457
|
|
140 4 11.4198 206.4796 214.7836 1.0456 -0.0436
|
|
141 4 11.3100 206.3551 211.1781 1.0436 -0.0417
|
|
142 4 11.1993 206.2481 207.8511 1.0416 -0.0400
|
|
143 4 11.0876 206.1581 204.8046 1.0397 -0.0382
|
|
144 4 10.9751 206.0961 202.1127 1.0377 -0.0363
|
|
145 4 10.8620 206.0752 199.9410 1.0356 -0.0343
|
|
146 4 10.7483 206.0922 198.5367 1.0334 -0.0323
|
|
147 4 10.6342 206.0981 198.1727 1.0315 -0.0305
|
|
148 4 10.5197 205.9633 199.0488 1.0303 -0.0295
|
|
149 4 10.4050 205.4583 201.1744 1.0304 -0.0295
|
|
150 4 10.2902 204.3002 204.2782 1.0316 -0.0306
|
|
151 4 10.1754 202.2784 207.7952 1.0334 -0.0323
|
|
152 4 10.0608 199.3555 210.9654 1.0349 -0.0337
|
|
153 4 9.9464 195.6650 213.0290 1.0355 -0.0343
|
|
154 4 9.8323 191.4733 213.4475 1.0349 -0.0337
|
|
155 4 9.7187 187.0984 212.0444 1.0331 -0.0320
|
|
156 4 9.6057 182.7955 209.0018 1.0306 -0.0297
|
|
157 4 9.4933 178.7123 204.7322 1.0279 -0.0272
|
|
158 4 9.3818 174.9136 199.7108 1.0253 -0.0246
|
|
159 4 9.2711 171.4169 194.3535 1.0228 -0.0223
|
|
160 4 9.1615 168.2114 188.9722 1.0206 -0.0201
|
|
161 4 9.0529 165.2770 183.7870 1.0186 -0.0183
|
|
162 4 8.9456 162.5885 178.9581 1.0169 -0.0167
|
|
163 4 8.8396 160.1140 174.6062 1.0156 -0.0153
|
|
164 4 8.7350 157.8118 170.8119 1.0146 -0.0144
|
|
165 4 8.6319 155.6275 167.6018 1.0140 -0.0138
|
|
166 4 8.5305 153.4962 164.9366 1.0138 -0.0136
|
|
167 4 8.4307 151.3611 162.7186 1.0140 -0.0138
|
|
168 4 8.3328 149.2001 160.8174 1.0143 -0.0141
|
|
169 4 8.2367 147.0337 159.1060 1.0145 -0.0143
|
|
170 4 8.1427 144.9023 157.4868 1.0146 -0.0144
|
|
171 4 8.0507 142.8409 155.9015 1.0147 -0.0145
|
|
172 4 7.9608 140.8689 154.3220 1.0147 -0.0145
|
|
173 4 7.8732 138.9927 152.7347 1.0148 -0.0146
|
|
174 4 7.7880 137.2104 151.1257 1.0150 -0.0148
|
|
175 4 7.7051 135.5167 149.4729 1.0152 -0.0150
|
|
176 4 7.6247 133.9054 147.7462 1.0155 -0.0152
|
|
177 4 7.5468 132.3708 145.9114 1.0158 -0.0155
|
|
178 4 7.4716 130.9086 143.9366 1.0160 -0.0158
|
|
179 4 7.3990 129.5167 141.7970 1.0162 -0.0160
|
|
180 4 7.3292 128.1941 139.4787 1.0164 -0.0161
|
|
181 4 7.2623 126.9420 136.9800 1.0164 -0.0161
|
|
182 4 7.1982 125.7621 134.3116 1.0162 -0.0160
|
|
183 4 7.1370 124.6566 131.4951 1.0159 -0.0157
|
|
184 4 7.0788 123.6273 128.5615 1.0154 -0.0151
|
|
185 4 7.0237 122.6742 125.5480 1.0147 -0.0144
|
|
186 4 6.9717 121.7960 122.4958 1.0137 -0.0135
|
|
187 4 6.9228 120.9884 119.4470 1.0126 -0.0125
|
|
188 4 6.8770 120.2444 116.4417 1.0114 -0.0113
|
|
189 4 6.8345 119.5533 113.5146 1.0101 -0.0100
|
|
190 4 6.7953 118.8939 110.6929 1.0087 -0.0086
|
|
191 4 6.7594 118.2566 107.9931 1.0073 -0.0072
|
|
192 4 6.7267 117.6375 105.4208 1.0059 -0.0059
|
|
193 4 6.6975 117.0113 102.9694 1.0045 -0.0045
|
|
194 4 6.6716 116.3572 100.6222 1.0033 -0.0033
|
|
195 4 6.6491 115.6540 98.3550 1.0021 -0.0021
|
|
196 4 6.6301 114.8874 96.1394 1.0010 -0.0010
|
|
197 4 6.6145 114.0483 93.9471 1.0000 0.0000
|
|
198 4 6.6023 113.1294 91.7540 0.9990 0.0010
|
|
199 4 6.5936 112.1282 89.5423 0.9981 0.0019
|
|
200 4 6.5884 111.0468 87.3029 0.9971 0.0029
|
|
201 4 6.5867 109.8911 85.0357 0.9961 0.0039
|
|
|
|
===================================================================
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|
Memory usage: VmHWM = 17Mb
|
|
VmPeak = 290Mb
|
|
===================================================================
|
|
|
|
|
|
Unfolding on the coarse grid
|
|
elphon_wrap : 0.00s CPU 0.00s WALL ( 1 calls)
|
|
|
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INITIALIZATION:
|
|
|
|
|
|
|
|
Electron-Phonon interpolation
|
|
ephwann : 1.22s CPU 1.33s WALL ( 1 calls)
|
|
ep-interp : 1.17s CPU 1.27s WALL ( 201 calls)
|
|
|
|
DynW2B : 0.00s CPU 0.00s WALL ( 201 calls)
|
|
HamW2B : 0.33s CPU 0.35s WALL ( 81204 calls)
|
|
ephW2Bp : 0.04s CPU 0.04s WALL ( 201 calls)
|
|
|
|
|
|
Total program execution
|
|
EPW : 1.22s CPU 1.33s WALL
|
|
|
|
|
|
Please consider citing:
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S. Ponce, E. R. Margine, C. Verdi and F. Giustino, Comput. Phys. Commun. 209, 116 (2016)
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|
|
|
In addition, if you used anisotropic Eliashberg superconductivity please cite:
|
|
E. R. Margine and F. Giustino, Phys. Rev. B 87, 024505 (2013)
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if you used transport properties (scattering rates, mobility) please cite:
|
|
S. Ponce, E. R. Margine and F. Giustino, Phys. Rev. B 97, 121201 (2018)
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