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面向复杂工程求解的物理感知神经算子框架

Physics-Aware Neural Operator Framework for Complex Engineering Problem Solving

  • 摘要: 偏微分方程(PDEs)的高效求解和逆向设计是科学计算与工程应用中的核心挑战。传统数值方法计算成本高昂;而现有的神经算子学习方法在灵活性与泛化能力之间存在固有权衡:谱基方法具有强大的泛化能力但缺乏局部适应性,注意力机制方法灵活但在数据有限时易过拟合;此外,三维逆向设计因其指数级增长的设计空间和几何−物理的紧密耦合而极具挑战性。本文提出了一个统一的物理感知神经算子框架,通过3个核心创新解决上述挑战。首先,全息物理混合器,通过可学习的耦合机制自适应地调制谱基函数,兼具谱方法的全局结构先验和注意力机制的点级灵活性。其次,物理状态残差学习方法利用物理系统稳定性,通过学习相似物理轨迹间的残差实现隐式数据增强,显著提升数据效率。最后,物理−几何统一表示与优化框架采用变分自编码器学习紧凑的隐空间,结合梯度引导扩散和拓扑保持优化,实现从零开始的高保真三维设计。在多个PDE基准挑战和气动外形优化任务上的实验表明,该框架在精度、数据效率和计算效率方面均达到了领先水平,并在零样本分辨率泛化上表现出色。

     

    Abstract: Neural operator learning aims to approximate mappings between infinite-dimensional function spaces from data, offering a promising alternative to costly numerical PDE solvers. However, current approaches face inherent trade-offs between flexibility and generalization. Spectral-based methods offer strong generalization but lack local adaptability, whereas attention-based methods are flexible but prone to overfitting with limited data. Furthermore, extending neural operators to three-dimensional (3D) inverse design introduces difficulty, as the design space grows exponentially and geometry is tightly coupled with the induced physical field. This article presents a physics-aware neural operator framework comprising three components. The holistic physics mixer (HPM) constructs an adaptive spectral basis conditioned on local physical states via a learnable coupling function, unifying spectral and attention-based paradigms within a single transform. Physics-state residual learning (PSRL) reformulates the learning target from full input-output mappings to residuals between nearby physical states, leveraging the Lipschitz continuity of stable systems to implicitly augment limited training data without introducing non-physical samples. For 3D inverse design, a physics-geometry variational autoencoder (PG-VAE) jointly encodes geometry and physical fields into a compact latent space, on which a two-stage optimization procedure generates designs from random initialization without geometric templates. Extensive experiments on standard PDE benchmarks and aerodynamic shape optimization tasks show consistent improvements over existing methods in prediction accuracy and data efficiency

     

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