Considerations for Electromagnetic Simulations for a Quantitative Correlation of Optical Spectroscopy and Electron Tomography of Plasmonic Nanoparticles

Fuente: arXiv
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Autori principali: Dieperink, Mees, Skorikov, Alexander, Claes, Nathalie, Bals, Sara, Albrecht, Wiebke
Natura: Preprint
Pubblicazione: 2024
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author Dieperink, Mees
Skorikov, Alexander
Claes, Nathalie
Bals, Sara
Albrecht, Wiebke
author_facet Dieperink, Mees
Skorikov, Alexander
Claes, Nathalie
Bals, Sara
Albrecht, Wiebke
contents The optical cross sections of plasmonic nanoparticles are intricately linked to the morphology of the particle. If this connection can be made accurately enough, it would become possible to determine a particles shape solely from its measured optical cross sections. For that, electromagnetic simulations can be used to bridge the morphology and optical properties assuming that they can be performed in an accurate manner. In this paper, we study key factors that influence the accuracy of electromagnetic simulations. First, we compare several standard electromagnetic simulation methods and discuss in detail the effects of the meshing accuracy, choice of dielectric function and inclusion of a substrate for the boundary element method. To help the boundary element methods complex parametrization, we develop a workflow including reconstruction, meshing and mesh simplification steps to be able to use electron tomography data as input for these simulations. In particular, we analyze how the choice of reconstruction algorithm and the intricacies of image segmentation influence the simulated optical cross sections and correlate it to induced shape errors, which can be minimized in the data processing pipeline. In our case, optimal results could be obtained by using the Total Variation Minimization (TVM) reconstruction method in combination with Otsu thresholding and slight smoothing, which was important to create a reliable and watertight surface mesh using the marching cubes algorithm, especially for more complex shapes.
format Preprint
id arxiv_https___arxiv_org_abs_2410_08093
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Considerations for Electromagnetic Simulations for a Quantitative Correlation of Optical Spectroscopy and Electron Tomography of Plasmonic Nanoparticles
Dieperink, Mees
Skorikov, Alexander
Claes, Nathalie
Bals, Sara
Albrecht, Wiebke
Optics
Mesoscale and Nanoscale Physics
Materials Science
The optical cross sections of plasmonic nanoparticles are intricately linked to the morphology of the particle. If this connection can be made accurately enough, it would become possible to determine a particles shape solely from its measured optical cross sections. For that, electromagnetic simulations can be used to bridge the morphology and optical properties assuming that they can be performed in an accurate manner. In this paper, we study key factors that influence the accuracy of electromagnetic simulations. First, we compare several standard electromagnetic simulation methods and discuss in detail the effects of the meshing accuracy, choice of dielectric function and inclusion of a substrate for the boundary element method. To help the boundary element methods complex parametrization, we develop a workflow including reconstruction, meshing and mesh simplification steps to be able to use electron tomography data as input for these simulations. In particular, we analyze how the choice of reconstruction algorithm and the intricacies of image segmentation influence the simulated optical cross sections and correlate it to induced shape errors, which can be minimized in the data processing pipeline. In our case, optimal results could be obtained by using the Total Variation Minimization (TVM) reconstruction method in combination with Otsu thresholding and slight smoothing, which was important to create a reliable and watertight surface mesh using the marching cubes algorithm, especially for more complex shapes.
title Considerations for Electromagnetic Simulations for a Quantitative Correlation of Optical Spectroscopy and Electron Tomography of Plasmonic Nanoparticles
topic Optics
Mesoscale and Nanoscale Physics
Materials Science
url https://arxiv.org/abs/2410.08093