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ZENODO
Software . 2021
License: CC BY
Data sources: Datacite
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ZENODO
Software . 2021
License: CC BY
Data sources: ZENODO
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Global fitting approach for time-resolved polycrystalline diffraction data

Authors: Daniela Zahn; Hélène Seiler; Yoav William Windsor; Ralph Ernstorfer;

Global fitting approach for time-resolved polycrystalline diffraction data

Abstract

Fitting routine to analyze time-resolved electron diffraction data of polycrystalline materials (Matlab code). Instead of analyzing individual Debye-Scherrer rings, a fit to the full diffraction pattern is performed in order to extract the changes in atomic mean-squared displacement (MSD) and the expansion following laser excitation. The approach can be applied to monoatomic materials with isotropic MSD. Further information on the global fitting routine is available here: https://arxiv.org/abs/2012.10428 How to use the code: The code is provided as a compressed zip folder. It contains two folders, "example input" and "functions", as well as the matlab script file "mainScript.m". The script "mainScript.m" is used to run the global fitting routine. The folder "functions" contains all necessary functions. After unzipping the folder, running "mainScript.m" should directly perform the global fitting routine with the example inputs stored in the folder "example input". In order to apply the global fitting routine to other data, "mainScript.m" needs to be modified to load the data that should be analyzed and the scattering vectors of the material. In addition, the settings may have to be modified (in particular fit range and/or number of rings, and maybe also starting parameters for the fit). Further details about the necessary inputs are described in "mainScript.m".

Keywords

lattice dynamics, time-resolved diffraction, polycrystalline

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selected citations
These citations are derived from selected sources.
This is an alternative to the "Influence" indicator, which also reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Citations provided by BIP!
popularity
This indicator reflects the "current" impact/attention (the "hype") of an article in the research community at large, based on the underlying citation network.
BIP!Popularity provided by BIP!
influence
This indicator reflects the overall/total impact of an article in the research community at large, based on the underlying citation network (diachronically).
BIP!Influence provided by BIP!
impulse
This indicator reflects the initial momentum of an article directly after its publication, based on the underlying citation network.
BIP!Impulse provided by BIP!
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