Engineering-Oriented Symbolic Regression: LLMs as Physics Agents for Discovery of Simulation-Ready Constitutive Laws

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Main Authors: Wu, Yue, Su, Tianhao, Zhao, Mingchuan, Hu, Shunbo, Pan, Deng
Format: Preprint
Published: 2026
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author Wu, Yue
Su, Tianhao
Zhao, Mingchuan
Hu, Shunbo
Pan, Deng
author_facet Wu, Yue
Su, Tianhao
Zhao, Mingchuan
Hu, Shunbo
Pan, Deng
contents The discovery of constitutive laws for complex materials has historically faced a dichotomy between high-fidelity data-driven approaches, which demand prohibitive full-field experimental data, and traditional engineering fitting, which often yields numerically unstable models outside calibration regimes. In this work, we propose an Engineering-Oriented Symbolic Regression (EO-SR) framework that bridges this gap by leveraging Large Language Models (LLMs) as "Physics-Informed Agents." Unlike unconstrained symbolic regression, our framework utilizes an LLM Agent to zero-shot synthesize executable physical constraints -- specifically thermodynamic consistency and frame indifference -- transforming the search process from mathematical curve-fitting into a physics-governed discovery engine. We validate this approach on the hyperelastic modeling of rubber-like materials using standard Treloar datasets. The framework autonomously identifies a novel hybrid constitutive law that combines a Mooney-Rivlin linear base with a rational locking term. This discovered model not only achieves high predictive accuracy across multi-axial deformation modes (including zero-shot prediction of pure shear) but also guarantees unconditional convexity. Finite element validation demonstrates that while industry-standard models (e.g., Ogden N=3) fail due to numerical singularities under severe transverse compression, the EO-SR-discovered model maintains robust convergence. This study establishes a generalized, low-barrier pathway for discovering simulation-ready constitutive closures that satisfy both data accuracy and rigorous physical laws.
format Preprint
id arxiv_https___arxiv_org_abs_2603_19241
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Engineering-Oriented Symbolic Regression: LLMs as Physics Agents for Discovery of Simulation-Ready Constitutive Laws
Wu, Yue
Su, Tianhao
Zhao, Mingchuan
Hu, Shunbo
Pan, Deng
Computational Engineering, Finance, and Science
Symbolic Computation
Applied Physics
Computational Physics
The discovery of constitutive laws for complex materials has historically faced a dichotomy between high-fidelity data-driven approaches, which demand prohibitive full-field experimental data, and traditional engineering fitting, which often yields numerically unstable models outside calibration regimes. In this work, we propose an Engineering-Oriented Symbolic Regression (EO-SR) framework that bridges this gap by leveraging Large Language Models (LLMs) as "Physics-Informed Agents." Unlike unconstrained symbolic regression, our framework utilizes an LLM Agent to zero-shot synthesize executable physical constraints -- specifically thermodynamic consistency and frame indifference -- transforming the search process from mathematical curve-fitting into a physics-governed discovery engine. We validate this approach on the hyperelastic modeling of rubber-like materials using standard Treloar datasets. The framework autonomously identifies a novel hybrid constitutive law that combines a Mooney-Rivlin linear base with a rational locking term. This discovered model not only achieves high predictive accuracy across multi-axial deformation modes (including zero-shot prediction of pure shear) but also guarantees unconditional convexity. Finite element validation demonstrates that while industry-standard models (e.g., Ogden N=3) fail due to numerical singularities under severe transverse compression, the EO-SR-discovered model maintains robust convergence. This study establishes a generalized, low-barrier pathway for discovering simulation-ready constitutive closures that satisfy both data accuracy and rigorous physical laws.
title Engineering-Oriented Symbolic Regression: LLMs as Physics Agents for Discovery of Simulation-Ready Constitutive Laws
topic Computational Engineering, Finance, and Science
Symbolic Computation
Applied Physics
Computational Physics
url https://arxiv.org/abs/2603.19241