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Updated: Jul 19, 2025

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Combining synchrotron X-ray diffraction, mechanistic modeling and machine learning for in situ subsurface temperature

Rachel E Lim1, Tuhin Mukherjee1, Chihpin Chuang2

  • 1Pennsylvania State University, University Park, PA 16802, USA.

Journal of Applied Crystallography
|August 9, 2023
PubMed
Summary

This study introduces a new method using synchrotron X-ray diffraction and machine learning to measure subsurface temperatures during laser melting. This provides crucial data for qualifying additive manufacturing processes and materials.

Keywords:
Gaussian process regressionadditive manufacturingelastic strainsheat-transfer and fluid-flow modelinglaser meltingmachine learningsuperalloyssynchrotron X-ray diffractiontemperature-distribution metricsthermomechanical stress

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Area of Science:

  • Materials Science
  • Manufacturing Engineering
  • Computational Modeling

Background:

  • Laser melting in additive manufacturing creates extreme thermal gradients impacting material microstructure.
  • Accurate characterization of these temperature fields is essential for process and material validation.
  • Directly measuring subsurface temperatures during laser melting remains a significant challenge.

Purpose of the Study:

  • To develop a novel method for extracting subsurface temperature distribution metrics during laser melting.
  • To quantify the uncertainty associated with these temperature measurements.
  • To provide in situ quantitative temperature evolution data for laser melting processes.

Main Methods:

  • Utilized in situ synchrotron X-ray diffraction measurements.
  • Developed Gaussian process regression supervised machine-learning surrogate models.
  • Trained models with mechanistic heat transfer, fluid flow, and X-ray diffraction simulations.

Main Results:

  • Successfully extracted subsurface temperature metrics with uncertainties ranging from 5-15%.
  • Applied models to Inconel 625 alloy, confirming maximum solid-phase temperatures reached the solidus.
  • Observed increased uncertainty during cooling due to thermomechanical stress.

Conclusions:

  • The developed method provides a viable approach for in situ subsurface temperature characterization during laser melting.
  • Machine learning surrogate models offer a powerful tool for analyzing complex thermal processes.
  • Understanding temperature evolution is critical for controlling microstructure and properties in additive manufacturing.