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EBSD pattern simulations for an interaction volume containing lattice defects.

Chaoyi Zhu1, Marc De Graef1

  • 1Department of Materials Science and Engineering, Carnegie Mellon University, Pittsburgh, PA, USA.

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|August 14, 2020
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Summary
This summary is machine-generated.

Lattice defects significantly impact electron backscatter diffraction (EBSD) patterns. This study couples electron scattering simulations with deformation models to quantify defect effects on EBSD, aiding materials analysis.

Keywords:
EBSD pattern simulationHR-EBSDInteraction volumeThreading dislocation

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Area of Science:

  • Materials Science
  • Crystallography
  • Computational Physics

Background:

  • Electron Backscatter Diffraction (EBSD) is sensitive to crystal lattice defects.
  • Understanding defect-induced EBSD pattern changes is crucial for materials characterization.
  • Near-surface defects require specific modeling of electron-matter interactions and deformation fields.

Purpose of the Study:

  • To quantitatively link lattice defect characteristics to EBSD pattern variations.
  • To develop a computational framework for simulating EBSD patterns from defect-containing materials.
  • To investigate the influence of dislocation density and type on diffraction pattern diffuseness.

Main Methods:

  • Coupling a depth-specific dynamical electron scattering simulation with a crystal deformation model.
  • Utilizing the Yoffe-Shaibani-Hazzeldine dislocation field model for displacement fields.
  • Cross-validation of simulated patterns with High-Resolution EBSD (HR-EBSD) experiments.
  • Employing the virtual beam technique to analyze diffraction contrast.

Main Results:

  • Generated EBSD patterns from simulated defect volumes (edge dislocation, low-angle grain boundary).
  • Quantified pattern diffuseness in the frequency domain as a function of dislocation density.
  • Demonstrated the capability to predict EBSD pattern alterations due to specific lattice defects.

Conclusions:

  • The coupled simulation approach accurately predicts EBSD pattern changes caused by lattice defects.
  • Spatial distribution and density of defects can be quantitatively inferred from EBSD pattern analysis.
  • This method enhances the understanding of electron-matter interactions in the presence of crystal imperfections.