arXiv:2501.06933cs.LGphysics.comp-ph2025-01被引 10

用神经网络学习物理系统平衡态,提升长期预测精度与稳定性。

Neural equilibria for long-term prediction of nonlinear conservation laws

  • 将神经网络嵌入动能求解器,仅学习局部平衡态闭合关系。
  • 在6个守恒系统上超越现有方法,包括超音速激波等难题。
  • 模型小巧却优于大型基础模型和原始数值方法,适合物理仿真场景。

非线性守恒律描述了科学与工业中广泛存在的重要物理系统,是科学机器学习(SciML)的核心。通用大模型虽速度快,但取代求解器的数值与物理结构常导致稳定性、准确性和物理一致性下降。本文提出一种兼顾守恒性归纳偏置与神经网络灵活性的守恒感知型SciML骨干——神经离散平衡(NeurDE)。NeurDE通过学习玻尔兹曼形式中的局部平衡闭合关系,将机器学习嵌入动能求解器中。求解器仍执行输运、松弛、矩恢复和守恒操作,神经网络仅负责提供非线性平衡目标。我们在6个守恒系统上测试,包括亚音速、跨音速及超音速激波等高难度案例。结果表明,NeurDE优于当前最先进SciML方法,包括规模分别为10^4和10^6倍大的神经算子与预训练基础模型。尤为突出的是,其性能超越了原始数值方法。因此,NeurDE为保守模拟中的科学机器学习提供了一个紧凑范式:学习系统趋向的平衡律,而非演化律本身。

原文摘要 · Abstract (English)

Nonlinear conservation laws govern a broad class of important physical systems in science and industry and are central to scientific machine learning (SciML). Large general-purpose models offer speed, but replacing the numerical and physical structure of solvers often compromises stability, accuracy, and physical faithfulness. Here, we aim to balance the general inductive bias of conservation with the flexibility and speed of neural networks through a conservation-aware SciML backbone, which we call Neural Discrete Equilibrium (NeurDE). NeurDE places machine learning inside a kinetic solver by learning the local equilibrium closure of a Boltzmann formulation. The kinetic solver still performs transport, relaxation, moment recovery, and conservation; the neural network provides only the nonlinear equilibrium target. We test NeurDE on $6$ conserved systems, including three very challenging subsonic, transonic, and supersonic shock systems. NeurDE outperforms state-of-the-art SciML methods, including neural operators and pretrained SciML foundation models that are $10^4$ and $10^6$ times larger, respectively. Most notably, NeurDE improves upon the numerical method from which it is derived. NeurDE therefore provides a compact target for scientific machine learning in conservative simulation: learn the equilibrium law toward which the system relaxes, not the evolution law itself.

科学机器学习守恒律神经网络物理仿真

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