lammps/examples/USER/atc/drift_diffusion/Cu_cddm.mat

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#=====================================================
material Vacuum metal
#### two temperature ####################
#### drift diffusion #####################
electric_field linear
#permittivity 1.0
permittivity 1.085 # estimate based on speed of light in Cu and Cu's relative permeability of 1
end
end
#=====================================================
material Cu metal
heat_capacity constant
capacity 0.211977459280654
end
heat_flux linear
conductivity 67.4479848
end
electron_heat_capacity linear no_density
#capacity 6.8439866929411762e-05 # value from TTM paper divided by bulk electron density in Cu
capacity 5.8294334393503992e-05 # source 96.8 J m^-3 K^-2 in Lin & Zhigilei 08 (ref 47), converted to AtC units and divided by bulk electron density in Cu, NOTE: should not be multiplied by electron effective mass, only electron number density
end
electron_heat_flux linear
conductivity 441.362750535
end
electron_phonon_exchange hertel
debeye_temperature 343.5 # source wikipedia
mass_enhancement 0.08 # source Hertel 2002, ref 62
end
electric_field linear
permittivity 1.085 # estimate based on speed of light in Cu and Cu's relative permeability of 1
end
effective_mass constant
inv_effective_mass 0.8997 # source: Tolman & Stewart, 1916
end
electron_drag linear
inv_momentum_relaxation_time 100. # order of magnitude estimate for metals ~ 10^-14 s
end
electron_flux convection
end
end
electron_recombination linear
inv_relaxation_time 0.0
equilibrium_carrier_density 0.0
end
end