mlsanityData to 7 Oct 2026

Agentic Exploration of PDE Spaces using Latent Foundation Models for Parameterized Simulations

arXiv 2604.09584 ↗First posted 26 Feb 2026cs.AI cs.CVcited by 1

On the map: LLM agents and tool use → Web, search, and research agents

Abstract (arXiv)

Flow physics and more broadly physical phenomena governed by partial differential equations (PDEs), are inherently continuous, high-dimensional and often chaotic in nature. Traditionally, researchers have explored these rich spatiotemporal PDE solution spaces using laboratory experiments and/or computationally expensive numerical simulations. This severely limits automated and large-scale exploration, unlike domains such as drug discovery or materials science, where discrete, tokenizable representations naturally interface with large language models. We address this by coupling multi-agent LLMs with latent foundation models (LFMs), a generative model over parametrised simulations, that learns explicit, compact and disentangled latent representations of flow fields, enabling continuous exploration across governing PDE parameters and boundary conditions. The LFM serves as an on-demand surrogate simulator, allowing agents to query arbitrary parameter configurations at negligible cost. A hierarchical agent architecture orchestrates exploration through a closed loop of hypothesis, experimentation, analysis and verification, with a tool-modular interface requiring no user support. Applied to flow past tandem cylinders at Re = 500, the framework autonomously evaluates over 1,600 parameter-location pairs and discovers divergent scaling laws: a regime-dependent two-mode structure for minimum displacement thickness and a robust linear scaling for maximum momentum thickness, with both landscapes exhibiting a dual-extrema structure that emerges at the near-wake to co-shedding regime transition. The coupling of the learned physical representations with agentic reasoning establishes a general paradigm for automated scientific discovery in PDE-governed systems.

Key facts. Cited by 1 paper in the map (data through 7 Oct 2026). Placed in Web, search, and research agents, one of 16 directions in LLM agents and tool use. Builds on 9 of its 16 references that are in the map. First posted on arXiv 26 Feb 2026.

Builds on

9 of 16 references.

References · 9

  1. 2022Chain-of-Thought Prompting Elicits Reasoning in Large Language Modelscited by 12,302
  2. 2020Score-Based Generative Modeling through Stochastic Differential Equationscited by 8,964
  3. 2022ReAct: Synergizing Reasoning and Acting in Language Modelscited by 8,355
  4. 2023Toolformer: Language Models Can Teach Themselves to Use Toolscited by 4,072
  5. 2023Reflexion: Language Agents with Verbal Reinforcement Learningcited by 4,064
  6. 2022Elucidating the Design Space of Diffusion-Based Generative Modelscited by 2,994
  7. 2025AlphaEvolve: A coding agent for scientific and algorithmic discoverycited by 763
  8. 2021Enhancing Computational Fluid Dynamics with Machine Learningcited by 137
  9. 2026Explainable AI: Learning from the Learnerscited by 4

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Citing papers per year: 2026: 1.

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  1. 2026EvoPINN: Agentic Discovery of Executable Algorithms for Physics-Informed Neural Networks
  2. 2026Latent Generative Solvers for Generalizable Long-Term Physics Simulation
  3. 2025Foam-Agent: A Large Language Model-Based Multi-Agent Framework for Automating Computational Fluid Dynamics Workflows
  4. 2025Flow marching for a generative PDE foundation model
  5. 2025PDE-Agent: A toolchain-augmented multi-agent framework for PDE solving
  6. 2025Physics-Constrained Fine-Tuning of Flow-Matching Models for Generation and Inverse Problems
  7. 2026Agentic Symbolic Search: Characterizing PDEs Beyond Hand-crafted Expressions, Meshes, and Neural Networks
  8. 2026AutoSurrogate: An LLM-Driven Multi-Agent Framework for Autonomous Construction of Deep Learning Surrogate Models in Subsurface Flow