Leveraging graph neural networks and neural operator techniques for high-fidelity mesh-based physics simulations

Zeqing Jin, Bowen Zheng, Changgon Kim, Grace X. Gu
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Abstract

Developing fast and accurate computational models to simulate intricate physical phenomena has been a persistent research challenge. Recent studies have demonstrated remarkable capabilities in predicting various physical outcomes through machine learning-assisted approaches. However, it remains challenging to generalize current methods, usually crafted for a specific problem, to other more complex or broader scenarios. To address this challenge, we developed graph neural network (GNN) models with enhanced generalizability derived from the distinct GNN architecture and neural operator techniques. As a proof of concept, we employ our GNN models to predict finite element (FE) simulation results for three-dimensional solid mechanics problems with varying boundary conditions. Results show that our GNN model achieves accurate and robust performance in predicting the stress and deformation profiles of structures compared with FE simulations. Furthermore, the neural operator embedded GNN approach enables learning and predicting various solid mechanics problems in a generalizable fashion, making it a promising approach for surrogate modeling.
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利用图神经网络和神经算子技术进行高保真网格物理模拟
开发快速准确的计算模型来模拟错综复杂的物理现象一直是研究领域面临的挑战。最近的研究表明,通过机器学习辅助方法预测各种物理结果的能力非常出色。然而,要将目前通常针对特定问题而设计的方法推广到其他更复杂或更广泛的场景中,仍然具有挑战性。为了应对这一挑战,我们开发了图神经网络(GNN)模型,通过独特的 GNN 架构和神经算子技术增强了通用性。作为概念验证,我们利用 GNN 模型预测了具有不同边界条件的三维固体力学问题的有限元(FE)仿真结果。结果表明,与有限元模拟结果相比,我们的 GNN 模型在预测结构的应力和变形曲线方面具有准确而稳健的性能。此外,嵌入神经算子的 GNN 方法能够以可推广的方式学习和预测各种固体力学问题,因此是一种很有前途的代用建模方法。
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