Automation of sample identification for neutron beamlines

Neutron scattering experiments are a critical tool for the investigation of molecular structure in compounds. The HB-2A neutron powder diffractometer at the High Flux Isotope Reactor at ORNL conducts magnetic studies of samples by illuminating them with different energy neutron beams and recording the scattered neutrons. Proper identification and alignment of samples during an experiment is key to ensuring high quality data is collected. At present, this process is performed manually by beamline scientists. RadiaSoft, in collaboration with the beamline scientists and engineers at ORNL, has developed a machine learning-based software automating sample identification. We utilize a fully connected convolutional neural network configured in a U-Net architecture to identify the sample and its center of mass. We then move the sample using a custom Python-based EPICS IOC interfaced with the motors. In this poster, we provide an overview of our machine learning tools and show our results identifying samples at ORNL.

Authors

Publication Details

Journal
JACOW
Published
2026-01-29
DOI
https://doi.org/10.18429/jacow-napac2025-mop013
Primary Topic
Machine Learning in Materials Science
Type
article
Field-Weighted Citation Impact
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article

Automation of sample identification for neutron beamlines

Stuart Calder, Gary Taufer, Boaz Nash, Morgan Henderson et al.
JACOW
Machine Learning in Materials Science
article

Automation of sample identification for neutron beamlines

Stuart Calder, Gary Taufer, Boaz Nash, Morgan Henderson, Bhargavi Krishna, Amelia Chen, Christina Hoffmann, Jonathan Edelen
article en

Abstract

Neutron scattering experiments are a critical tool for the investigation of molecular structure in compounds. The HB-2A neutron powder diffractometer at the High Flux Isotope Reactor at ORNL conducts magnetic studies of samples by illuminating them with different energy neutron beams and recording the scattered neutrons. Proper identification and alignment of samples during an experiment is key to ensuring high quality data is collected. At present, this process is performed manually by beamline scientists. RadiaSoft, in collaboration with the beamline scientists and engineers at ORNL, has developed a machine learning-based software automating sample identification. We utilize a fully connected convolutional neural network configured in a U-Net architecture to identify the sample and its center of mass. We then move the sample using a custom Python-based EPICS IOC interfaced with the motors. In this poster, we provide an overview of our machine learning tools and show our results identifying samples at ORNL.

JACOW
Openalex Percentile: Top 74%
Machine Learning in Materials Science
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Automation of sample identification for neutron beamlines — Stuart Calder, Gary Taufer, et al. · JACOW (2026) | TGRS Research Map | TGRS