Computation and Sensitivity Analysis of the Deformation-Gradient Tensor Reconstruction in Dark-Field X-ray Microscopy

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Main Authors: Kanesalingam, Brinthan, Chalise, Darshan, Detlefs, Carsten, Dresselhaus-Marais, Leora
Format: Preprint
Published: 2025
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author Kanesalingam, Brinthan
Chalise, Darshan
Detlefs, Carsten
Dresselhaus-Marais, Leora
author_facet Kanesalingam, Brinthan
Chalise, Darshan
Detlefs, Carsten
Dresselhaus-Marais, Leora
contents Spatially resolved strain measurements are crucial to understanding the properties of engineering materials. Although strain measurements utilizing techniques such as transmission electron microscopy and electron backscatter diffraction offer high spatial resolution, they are limited to surface or thin samples. X-ray diffraction methods, including Bragg Coherent Diffraction Imaging and X-ray topography, enable strain measurements deep inside bulk materials but face challenges in simultaneously achieving both high spatial resolution and large field-of-view. Dark-field X-ray Microscopy (DFXM) offers a promising solution with its ability to image bulk crystals at the nanoscale while offering a field-of-view approaching a few hundred $μ$m. However, an inverse modeling framework to explicitly relate the angular shifts in DFXM to the strain and lattice rotation tensors is lacking. In this paper, we develop such an inverse modeling formalism. Using the oblique diffraction geometry, enabling access to noncoplanar symmetry-equivalent reflections, we demonstrate that the reconstruction of the full deformation gradient tensor ($\mathbf{F^{(g)}}$) is possible. We also develop the computational framework to both forward calculate the anticipated angular shifts and reconstruct the average $\mathbf{F^{(g)}}$ for an individual pixel from DFXM experiments. Finally, utilizing the established formalism and computational framework, we present methods for sensitivity analysis to relate individual components of the rotation or strain tensor to specific angles of DFXM. The developed sensitivity analysis also enables explicit computation of the errors associated with the reconstruction of each component. The formalism, the computational framework, and the sensitivity analysis established in this paper should assist both the interpretation of past DFXM experiments and the design of future DFXM experiments.
format Preprint
id arxiv_https___arxiv_org_abs_2507_17929
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Computation and Sensitivity Analysis of the Deformation-Gradient Tensor Reconstruction in Dark-Field X-ray Microscopy
Kanesalingam, Brinthan
Chalise, Darshan
Detlefs, Carsten
Dresselhaus-Marais, Leora
Materials Science
Spatially resolved strain measurements are crucial to understanding the properties of engineering materials. Although strain measurements utilizing techniques such as transmission electron microscopy and electron backscatter diffraction offer high spatial resolution, they are limited to surface or thin samples. X-ray diffraction methods, including Bragg Coherent Diffraction Imaging and X-ray topography, enable strain measurements deep inside bulk materials but face challenges in simultaneously achieving both high spatial resolution and large field-of-view. Dark-field X-ray Microscopy (DFXM) offers a promising solution with its ability to image bulk crystals at the nanoscale while offering a field-of-view approaching a few hundred $μ$m. However, an inverse modeling framework to explicitly relate the angular shifts in DFXM to the strain and lattice rotation tensors is lacking. In this paper, we develop such an inverse modeling formalism. Using the oblique diffraction geometry, enabling access to noncoplanar symmetry-equivalent reflections, we demonstrate that the reconstruction of the full deformation gradient tensor ($\mathbf{F^{(g)}}$) is possible. We also develop the computational framework to both forward calculate the anticipated angular shifts and reconstruct the average $\mathbf{F^{(g)}}$ for an individual pixel from DFXM experiments. Finally, utilizing the established formalism and computational framework, we present methods for sensitivity analysis to relate individual components of the rotation or strain tensor to specific angles of DFXM. The developed sensitivity analysis also enables explicit computation of the errors associated with the reconstruction of each component. The formalism, the computational framework, and the sensitivity analysis established in this paper should assist both the interpretation of past DFXM experiments and the design of future DFXM experiments.
title Computation and Sensitivity Analysis of the Deformation-Gradient Tensor Reconstruction in Dark-Field X-ray Microscopy
topic Materials Science
url https://arxiv.org/abs/2507.17929