从稀疏不规则观测中生成物理动态的完整演化过程
Generating Full-field Evolution of Physical Dynamics from Irregular Sparse Observations
- 用函数型Tucker分解构建潜在空间,表示稀疏观测数据
- 在连续时空上生成高精度动态序列,重建误差显著降低
- 适合处理天文、环境、分子等多尺度物理系统
从稀疏且非网格化的观测中建模与重构多维物理动态是科学研究中的基本挑战。近期基于扩散的生成模型在物理模拟中展现出巨大潜力,但现有方法通常依赖预设时空分辨率的网格数据,难以处理真实世界物理动态的稀疏和连续特性。为此,我们提出SDIFT(Sequential DIffusion in Functional Tucker space),一种从不规则稀疏观测中生成物理动态完整演化的新框架。SDIFT利用具有普适逼近能力的函数型Tucker模型作为潜在空间表示,将观测数据编码为潜在函数和Tucker核心张量序列。我们进一步在函数型Tucker空间中构建带有时间增强的UNet的序列扩散模型,通过从高斯过程采样噪声来生成核心张量序列。在后验采样阶段,提出消息传递后验采样机制,实现仅基于有限时间步观测条件下的完整序列生成。我们在三个跨尺度物理系统上验证:天体(超新星爆发,光年尺度)、环境(海洋声速场,千米尺度)和分子(有机液体,毫米尺度),结果表明其在重建精度和计算效率上均显著优于当前最优方法。
原文摘要 · Abstract (English)
Modeling and reconstructing multidimensional physical dynamics from sparse and off-grid observations presents a fundamental challenge in scientific research. Recently, diffusion-based generative modeling shows promising potential for physical simulation. However, current approaches typically operate on on-grid data with preset spatiotemporal resolution, but struggle with the sparsely observed and continuous nature of real-world physical dynamics. To fill the gaps, we present SDIFT, Sequential DIffusion in Functional Tucker space, a novel framework that generates full-field evolution of physical dynamics from irregular sparse observations. SDIFT leverages the functional Tucker model as the latent space representer with proven universal approximation property, and represents observations as latent functions and Tucker core sequences. We then construct a sequential diffusion model with temporally augmented UNet in the functional Tucker space, denoising noise drawn from a Gaussian process to generate the sequence of core tensors. At the posterior sampling stage, we propose a Message-Passing Posterior Sampling mechanism, enabling conditional generation of the entire sequence guided by observations at limited time steps. We validate SDIFT on three physical systems spanning astronomical (supernova explosions, light-year scale), environmental (ocean sound speed fields, kilometer scale), and molecular (organic liquid, millimeter scale) domains, demonstrating significant improvements in both reconstruction accuracy and computational efficiency compared to state-of-the-art approaches.
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