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DISCO: learning to DISCover an evolution Operator for multi-physics-agnostic prediction

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arxiv 2504.19496 v1 pith:XHFYBNWE submitted 2025-04-28 cs.LG cs.AIstat.ML

classification cs.LGcs.AIstat.ML
keywords operatorstateevolutionshorttrajectorydiscomodelnext
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We address the problem of predicting the next state of a dynamical system governed by unknown temporal partial differential equations (PDEs) using only a short trajectory. While standard transformers provide a natural black-box solution to this task, the presence of a well-structured evolution operator in the data suggests a more tailored and efficient approach. Specifically, when the PDE is fully known, classical numerical solvers can evolve the state accurately with only a few parameters. Building on this observation, we introduce DISCO, a model that uses a large hypernetwork to process a short trajectory and generate the parameters of a much smaller operator network, which then predicts the next state through time integration. Our framework decouples dynamics estimation (i.e., DISCovering an evolution operator from a short trajectory) from state prediction (i.e., evolving this operator). Experiments show that pretraining our model on diverse physics datasets achieves state-of-the-art performance while requiring significantly fewer epochs. Moreover, it generalizes well and remains competitive when fine-tuned on downstream tasks.

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    physics.comp-ph 2025-08 conditional novelty 5.0 of 10

    A latent diffusion model conditioned on the current electron density state can generate future density fields for liquid lithium at 800 K with distributional and structural similarity to AIMD reference data.

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