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arxivcs.LGphysics.comp-ph2026-07-06

A Physics-Regulated Neural Framework for Learning 3D Grain Growth Dynamics

Zhihui Tian, Kang Yang, Michael Tonks, Amanda R. Krause, Joel B. Harley

Grain growth is governed by the reduction in grain boundary energy and exhibits well-established statistical scaling laws. Developing data-driven surrogates that preserve these physical invariants while remaining computationally scalable remains challenging, especially in 3D. We present 3D-PRIMME (Physics-Regulated Interpretable Machine Learning for Microstructure Evolution) for learning three-dimensional grain growth dynamics. The model is trained using only two consecutive time steps yet accurately reproduces the linear coarsening law and preserves topological statistics over extended time scales. Despite being trained on a $100^3$ grid points with 512 grains, the learned evolution operator is applied to domains up to $1024^3$ grid points with 550000 grains without retraining, maintaining consistent kinetics and grain topology across orders-of-magnitude increases in system size. These results demonstrate that 3D-PRIMME learns a scale-independent and temporally stable local evolution rule, enabling efficient and robust large-scale surrogate prediction of 3D microstructure evolution.

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Dynamical and Optimization Trade-offs of Levi--Civita Coordinates for Learned Close-Encounter Dynamics

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Classical regularization removes the binary-collision singularity from the Kepler problem, but its value as a representation for learned Hamiltonian dynamics has not been systematically isolated. We compare Cartesian and planar Levi--Civita formulations of a perturbed Kepler syst…

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CodeJeNN: A simple C++ neural network generator for physics applications

Jay Arcities, Pavel Popov, Eric J Ching, Kamal Viswanath, Ryan F Johnson

Machine learning has shown speedups for numerical methods in physics applications, but integrating Python-based libraries into high-performance C++ solvers creates performance bottlenecks. We present CodeJeNN, which bridges this gap by auto-generating self-contained C++ code from…

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