Eigenstructure Analysis of Bloch Wave and Multislice Formulations for Dynamical Scattering in Transmission Electron Microscopy

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Main Authors: Bangun, Arya, Melnyk, Oleh, März, Benjamin
Format: Preprint
Published: 2024
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author Bangun, Arya
Melnyk, Oleh
März, Benjamin
author_facet Bangun, Arya
Melnyk, Oleh
März, Benjamin
contents We investigate the eigenstructure of matrix formulations used for modeling scattering processes within materials in transmission electron microscopy. Dynamical scattering is crucial for describing the interaction between an electron wave and the material under investigation. Unlike the Bloch wave formulation, which defines the transmission function via the scattering matrix, the traditional multislice method is lacking a pure transmission function due to the entanglement of electron waves with the propagation function. To address this, we reformulate the multislice method into a matrix framework, which we refer to as the transmission matrix. This allows a direct comparison to the scattering matrix derived from Bloch waves in terms of their eigenstructures. Through theory, we demonstrate their equivalence with eigenvectors related by a two-dimensional Fourier matrix, given that the eigenvalue angles differ by modulo $2πn$ (integer $n$). We numerically verify our findings as well as demonstrate the application of the eigenstructure for the estimation of the mean inner potential.
format Preprint
id arxiv_https___arxiv_org_abs_2412_21119
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Eigenstructure Analysis of Bloch Wave and Multislice Formulations for Dynamical Scattering in Transmission Electron Microscopy
Bangun, Arya
Melnyk, Oleh
März, Benjamin
Materials Science
Mesoscale and Nanoscale Physics
Computational Physics
We investigate the eigenstructure of matrix formulations used for modeling scattering processes within materials in transmission electron microscopy. Dynamical scattering is crucial for describing the interaction between an electron wave and the material under investigation. Unlike the Bloch wave formulation, which defines the transmission function via the scattering matrix, the traditional multislice method is lacking a pure transmission function due to the entanglement of electron waves with the propagation function. To address this, we reformulate the multislice method into a matrix framework, which we refer to as the transmission matrix. This allows a direct comparison to the scattering matrix derived from Bloch waves in terms of their eigenstructures. Through theory, we demonstrate their equivalence with eigenvectors related by a two-dimensional Fourier matrix, given that the eigenvalue angles differ by modulo $2πn$ (integer $n$). We numerically verify our findings as well as demonstrate the application of the eigenstructure for the estimation of the mean inner potential.
title Eigenstructure Analysis of Bloch Wave and Multislice Formulations for Dynamical Scattering in Transmission Electron Microscopy
topic Materials Science
Mesoscale and Nanoscale Physics
Computational Physics
url https://arxiv.org/abs/2412.21119