arXiv:2606.28519cs.LG2026-06

用可分训练框架提升大规模偏微分方程求解的精度与速度

A Trainable-by-Parts Operator Learning Framework: Bridging DeepONet and Karhunen-Loeve Expansions for Large-Scale Applications

论文配图:A Trainable-by-Parts Operator Learning Framework: Bridging DeepONet and Karhunen-Loeve Expansions for Large-Scale Applications
图 1 · 摘自论文原文
  • 基于KL展开与低秩分解构建可分训练的神经网络架构
  • 压力预测误差仅1.1 psi,饱和度误差5%,训练仅20分钟
  • 适合地质碳封存等需要快速模拟的大规模科学计算场景

针对由偏微分方程(PDE)支配的大规模问题,传统算子学习模型面临维度灾难、内存限制和数据不足的挑战。本文提出一种基于卡尔胡宁-洛维展开的深度神经网络(KL-DNN)可扩展算子学习框架,并在地质碳封存(GCS)中验证其性能。模型在包含100个样本、三维域中170万个网格单元、50个时间步的大规模模拟数据集上训练。该方法利用静态属性的低秩奇异值分解构建隐空间,并通过嵌套的卡尔胡宁-洛维展开处理动态压力场,实现无需下采样或空间粗化的全分辨率预测。模型在压力预测上平均均方根误差(RMSE)为1.1 psi(相对误差0.04%),CO2饱和度的RMSE为0.0146(相对误差5%)。训练仅需单卡20分钟,相比DeepONet减少19%压力误差、7%饱和度误差,并实现两个数量级的速度提升。推理时间低于一分钟,适用于快速不确定性量化、历史拟合与实时决策支持。

原文摘要 · Abstract (English)

Training operator-learning models for large-scale problems governed by partial differential equations (PDEs) is challenging due to the curse of dimensionality, memory constraints, and limited training data. These challenges arise in many scientific and engineering applications, including subsurface flow, climate modeling, and geological carbon storage (GCS). In this work, we propose a scalable operator-learning framework based on the Karhunen-Loeve Deep Neural Network (KL-DNN) and demonstrate its performance for modeling GCS. The model is trained on a dataset comprising 100 samples of large-scale simulations in a three-dimensional domain with 1.7 million cells and 50 time steps. The KL-DNN method constructs latent spaces using low-rank singular value decomposition of static properties and a nested Karhunen-Loeve expansion for dynamic pressure fields, enabling full-resolution predictions without subsampling or spatial coarsening. The KL-DNN model achieves an average root mean square error (RMSE) of 1.1 psi for pressure (0.04% relative error with respect to the average pressure in the domain) and RMSE of 0.0146 for CO2 saturation (5% relative error with respect to the average saturation inside the plume). The model requires 20 minutes of training on a single GPU, representing a 19% reduction in the pressure errors, 7% reduction in the saturation error, and a two-order-of-magnitude speedup compared to DeepONet trained on the same dataset. These results, along with inference time of less than one minute, establish the proposed model as a practical and accurate solution for large-scale PDE problems, enabling rapid uncertainty quantification, history matching, and real-time decision support.

算子学习偏微分方程地质碳封存深度神经网络

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