The Auger process from time dependent density matrix evolution in the GKBA

ORAL

Abstract

State-of-the-art experimental techniques allow the stimulation of excited electronic dynamics on an ultra-fast timescale. For example, with XUV radiation it is possible to create highly unstable excited states, which give rise to different relaxation processes of radiative and/or non-radiative nature. As opposed to radiative decay, the nonradiative mechanisms take place on a much faster timescale, i.e. femto- to atto-seconds. A typical decay mechanism enabled by electron correlations is the Auger decay. In this process a secondary electron is expelled from the system to relax to a lower energy state. To describe the Auger mechanism it is key to include electronic correlations otherwise not accounted for in adiabatic time-dependent density functional theory approaches. Within our method we solve the Kadanoff-Baym equations (KBE) in the nonequilibrium Green's function framework by using the generalized Kadanoff-Baym ansatz (GKBA), i.e. recasting the KBE into a computationally more convenient closed equation for the one-particle density matrix. As an illustration we simulate the emission of Auger electrons in real time in one-dimensional atomic systems. This paves the way towards the description of time-dependent Auger decay in realistic systems.

Presenters

  • Fabio Covito

    Max Planck Inst Structure & Dynamics of Matter, Max Planck Institute for the Structure and Dynamics of Matter

Authors

  • Fabio Covito

    Max Planck Inst Structure & Dynamics of Matter, Max Planck Institute for the Structure and Dynamics of Matter

  • Enrico Perfetto

    Dipartimento di Fisica and European Theoretical Spectroscopy Facility (ETSF), Universita di Roma Tor Vergata

  • Gianluca Stefanucci

    Dipartimento di Fisica and European Theoretical Spectroscopy Facility (ETSF), Universita di Roma Tor Vergata

  • Angel Rubio

    Max Planck Inst Structure & Dynamics of Matter, Theory, Max Planck Inst Structure & Dynamics of Matter, University of the Basque Country, Theory department, Max Planck Institute for the Structure and Dynamics of Matter, Universidad del Pais Vasco, Strc Dyn of Matt, Max Plank Insititute, Theory, Max Planck Institute for the Structure and Dynamics of Matter, Max Planck Institute for the Structure and Dynamics of Matter