用图神经网络预测复杂地质中二氧化碳迁移,速度快且精度高。
Towards Fast GNN Surrogates for CO2 Migration in Complex Geological Formations

- 构建图结构模拟地质单元间流动,通过几何条件调整消息传递方向。
- 在SPE11A基准上实现长时间预报,气体饱和度和液相密度误差小。
- 适合需要快速模拟碳封存的能源与环境领域研究人员使用。
本文探讨了数据驱动的机器学习方法在复杂数字地质构造中多相流物理行为建模中的应用。提出一种端到端图神经网络代理模型,用于预测地质封存中二氧化碳羽流迁移。该方法在SPE11A基准上进行评估,该基准是工业界常用的测试案例,具有明显的气水界面、强对流输运及快速对流混合与指进现象。将基准问题重构为图结构,节点代表计算单元,边编码基于传导率的相互作用,并融合几何属性。通过各向异性消息传递机制,捕捉由网格几何、渗透率差异和地质非均质性引起的定向传输,交互权重由几何条件引导的边嵌入计算,使信息聚合偏向物理相关方向。时间演化在隐空间中采用自回归残差形式建模,通过多步监督训练。模型在长时间预报中对气体饱和度和液相密度的预测表现优异,累积误差保持在合理水平。
原文摘要 · Abstract (English)
This chapter discusses how a data-driven machine learning approach can reproduce key aspects of the physical behavior of multiphase flows in complex geological formations. We propose an end-to-end graph neural surrogate tailored to CO$_2$ plume migration forecasting in geological storage. The method is evaluated on the SPE11A benchmark, a well-known industry test case designed to assess CO$_2$ storage scenarios and characterized by sharp gas-water interfaces, strong advective transport, and rapid convective mixing with fingering development. The benchmark is reformulated as a graph in which nodes represent computational cells and edges encode transmissibility-based interactions enriched with geometric attributes. Directional transport arising from grid geometry, permeability contrasts, and geological heterogeneity is captured through an anisotropic message-passing mechanism, where interaction weights are computed via geometry-conditioned edge embeddings, biasing message aggregation toward physically relevant transport directions. Temporal evolution is modeled in latent space using an autoregressive residual formulation trained with multi-step supervision. The proposed model produces competitive forecasts of gas saturation and liquid-phase density, which are key indicators for CO$_2$ storage monitoring, with cumulative errors that remain moderate over extended forecasting horizons.
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