• Open Access

Theory of x-ray absorption spectroscopy: A microscopic Bloch equation approach for two-dimensional solid states

Dominik Christiansen, Malte Selig, Jens Biegert, and Andreas Knorr
Phys. Rev. Research 5, 023002 – Published 3 April 2023

Abstract

We develop a self-consistent Maxwell-Bloch formalism for the interaction of x-rays with two-dimensional crystalline materials by incorporating the Bloch theorem and Coulomb many-body interaction. This formalism is illustrated for graphene, by calculating the polarization-dependent XANES, formulating expressions for the radiative and Meinter-Auger recombination of core holes, and the discussion of microscopic insights into the spectral oscillations of EXAFS beyond point scattering theory. In particular, the correct inclusion of lattice periodicity in our evaluation allows us to assign so far uninterpreted spectral features in the Fourier transformed EXAFS spectrum.

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  • Received 24 October 2022
  • Revised 20 January 2023
  • Accepted 6 February 2023

DOI:https://doi.org/10.1103/PhysRevResearch.5.023002

Published by the American Physical Society under the terms of the Creative Commons Attribution 4.0 International license. Further distribution of this work must maintain attribution to the author(s) and the published article's title, journal citation, and DOI.

Published by the American Physical Society

Physics Subject Headings (PhySH)

Condensed Matter, Materials & Applied Physics

Authors & Affiliations

Dominik Christiansen1, Malte Selig1, Jens Biegert2,3,4, and Andreas Knorr1

  • 1Institut für Theoretische Physik, Nichtlineare Optik und Quantenelektronik, Technische Universität Berlin, 10623 Berlin, Germany
  • 2ICFO-Institut de Ciencies Fotoniques, The Barcelona Institute of Science and Technology, 08860 Castelldefels (Barcelona), Spain
  • 3ICREA-Institució Catalana de Recerca i Estudis Avançats, 08010 Barcelona, Spain
  • 4Fritz-Haber Institute of the Max Planck Society, 14195 Berlin, Germany

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Issue

Vol. 5, Iss. 2 — April - June 2023

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