Author/Authors :
Illg, Christian Max Planck Institute for Intelligent Systems - Heisenbergstr. 3, 70569 Stuttgart, Germany , Haag, Michael Max Planck Institute for Intelligent Systems - Heisenbergstr. 3, 70569 Stuttgart, Germany , Teeny, Nicolas Max Planck Institute for Nuclear Physics - Saupfercheckweg 1 - 69117 Heidelberg, Germany , Wirth, Jens Institut fu¨r Analysis - Dynamik und Modellierung - Universita¨t Stuttgart - Pfaffenwaldring 57, 70569 Stuttgart, Germany , Fa¨hnle, Manfred Max Planck Institute for Intelligent Systems - Heisenbergstr. 3, 70569 Stuttgart, Germany
Abstract :
Scatterings of electrons at quasiparticles or photons are very important for many topics in solid-state
physics, e.g., spintronics, magnonics or photonics, and
therefore a correct numerical treatment of these scatterings
is very important. For a quantum-mechanical description of
these scatterings, Fermi’s golden rule is used to calculate
the transition rate from an initial state to a final state in a
first-order time-dependent perturbation theory. One can
calculate the total transition rate from all initial states to all
final states with Boltzmann rate equations involving Brillouin
zone integrations. The numerical treatment of these
integrations on a finite grid is often done via a replacement
of the Dirac delta distribution by a Gaussian. The Dirac
delta distribution appears in Fermi’s golden rule where it
describes the energy conservation among the interacting
particles. Since the Dirac delta distribution is a not a
function it is not clear from a mathematical point of view that this procedure is justified. We show with physical and
mathematical arguments that this numerical procedure is in
general correct, and we comment on critical points.
Keywords :
Electron scattering , Boltzmann rate equations , Brillouin zone integration , Treatment of Diracs delta distribution