Accelerating Atomic Fine Structure Determination with Graph Reinforcement Learning

Fuente: arXiv
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Main Authors: Ding, M., Darvariu, V. -A., Ryabtsev, A. N., Hawes, N., Pickering, J. C.
Format: Preprint
Published: 2025
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author Ding, M.
Darvariu, V. -A.
Ryabtsev, A. N.
Hawes, N.
Pickering, J. C.
author_facet Ding, M.
Darvariu, V. -A.
Ryabtsev, A. N.
Hawes, N.
Pickering, J. C.
contents Atomic data determined by analysis of observed atomic spectra are essential for plasma diagnostics. For each low-ionisation open d- and f-subshell atomic species, around $10^3$ fine structure level energies can be determined through years of analysis of $10^4$ observable spectral lines. We propose the automation of this task by casting the analysis procedure as a Markov decision process and solving it by graph reinforcement learning using reward functions learned on historical human decisions. In our evaluations on existing spectral line lists and theoretical calculations for Co II and Nd II-III, hundreds of level energies were computed within hours, agreeing with published values in 95% of cases for Co II and 54-87% for Nd II-III. As the current efficiency in atomic fine structure determination struggles to meet growing atomic data demands from astronomy and fusion science, our new artificial intelligence approach sets the stage for closing this gap.
format Preprint
id arxiv_https___arxiv_org_abs_2509_16184
institution arXiv
publishDate 2025
record_format arxiv
spellingShingle Accelerating Atomic Fine Structure Determination with Graph Reinforcement Learning
Ding, M.
Darvariu, V. -A.
Ryabtsev, A. N.
Hawes, N.
Pickering, J. C.
Atomic Physics
Artificial Intelligence
Machine Learning
Atomic data determined by analysis of observed atomic spectra are essential for plasma diagnostics. For each low-ionisation open d- and f-subshell atomic species, around $10^3$ fine structure level energies can be determined through years of analysis of $10^4$ observable spectral lines. We propose the automation of this task by casting the analysis procedure as a Markov decision process and solving it by graph reinforcement learning using reward functions learned on historical human decisions. In our evaluations on existing spectral line lists and theoretical calculations for Co II and Nd II-III, hundreds of level energies were computed within hours, agreeing with published values in 95% of cases for Co II and 54-87% for Nd II-III. As the current efficiency in atomic fine structure determination struggles to meet growing atomic data demands from astronomy and fusion science, our new artificial intelligence approach sets the stage for closing this gap.
title Accelerating Atomic Fine Structure Determination with Graph Reinforcement Learning
topic Atomic Physics
Artificial Intelligence
Machine Learning
url https://arxiv.org/abs/2509.16184