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Dislocation Analysis Tool for Atomistic Simulations

Stukowski, Alexander
Andreoni, Wanda and Yip, Sidney (eds.) (2018):
Dislocation Analysis Tool for Atomistic Simulations.
In: Handbook of Materials Modeling, Springer, pp. 1-14, DOI: 10.1007/978-3-319-42913-7,
[Online-Edition: https://doi.org/10.1007/978-3-319-42913-7],
[Book Section]

Abstract

Precise analysis and meaningful visualization of dislocation structures in molecular dynamics simulations are important steps toward physical insights. This chapter provides an introduction to the dislocation extraction algorithm (DXA), which is a computational method for identifying and quantifying dislocations in atomistic crystal models. It builds a bridge between the atomistic world of crystal defects and the discrete line picture of classical dislocation theory.

Item Type: Book Section
Erschienen: 2018
Editors: Andreoni, Wanda and Yip, Sidney
Creators: Stukowski, Alexander
Title: Dislocation Analysis Tool for Atomistic Simulations
Language: English
Abstract:

Precise analysis and meaningful visualization of dislocation structures in molecular dynamics simulations are important steps toward physical insights. This chapter provides an introduction to the dislocation extraction algorithm (DXA), which is a computational method for identifying and quantifying dislocations in atomistic crystal models. It builds a bridge between the atomistic world of crystal defects and the discrete line picture of classical dislocation theory.

Title of Book: Handbook of Materials Modeling
Publisher: Springer
ISBN: 978-3-319-42913-7
Divisions: 11 Department of Materials and Earth Sciences
11 Department of Materials and Earth Sciences > Material Science
11 Department of Materials and Earth Sciences > Material Science > Materials Modelling
Date Deposited: 27 Sep 2018 10:56
DOI: 10.1007/978-3-319-42913-7
Official URL: https://doi.org/10.1007/978-3-319-42913-7
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