# MetaOpenFOAM 2.0: Large Language Model Driven Chain of Thought for Automating CFD Simulation and Post-Processing

arXiv: https://arxiv.org/abs/2502.00498 · HTML: https://mlsanity.com/paper/2502.00498/

## Key facts

- Cited by 13 papers in the map (data through 14 Oct 2026).
- Placed in Spatial and embodied reasoning, one of 17 directions in LLM reasoning.
- Builds on 16 of its 23 references that are in the map.
- First posted on arXiv 1 Feb 2025.

## Placed in

- LLM reasoning / [Spatial and embodied reasoning](https://mlsanity.com/lr/spatial-and-embodied-reasoning/)

## Builds on (most cited first, 16 of 16)

- [Chain-of-Thought Prompting Elicits Reasoning in Large Language Models](https://mlsanity.com/paper/2201.11903/) (2022)
- [Evaluating Large Language Models Trained on Code](https://mlsanity.com/paper/2107.03374/) (2021)
- [Scaling Laws for Neural Language Models](https://mlsanity.com/paper/2001.08361/) (2020)
- [Self-Consistency Improves Chain of Thought Reasoning in Language Models](https://mlsanity.com/paper/2203.11171/) (2022)
- [Qwen2.5 Technical Report](https://mlsanity.com/paper/2412.15115/) (2024)
- [A Survey on Large Language Model based Autonomous Agents](https://mlsanity.com/paper/2308.11432/) (2023)
- [MetaGPT: Meta Programming for A Multi-Agent Collaborative Framework](https://mlsanity.com/paper/2308.00352/) (2023)
- [Improving Factuality and Reasoning in Language Models through Multiagent Debate](https://mlsanity.com/paper/2305.14325/) (2023)
- [Least-to-Most Prompting Enables Complex Reasoning in Large Language Models](https://mlsanity.com/paper/2205.10625/) (2022)
- [Self-collaboration Code Generation via ChatGPT](https://mlsanity.com/paper/2304.07590/) (2023)
- [Unleashing the Emergent Cognitive Synergy in Large Language Models: A Task-Solving Agent through Multi-Persona Self-Collaboration](https://mlsanity.com/paper/2307.05300/) (2023)
- [Playing repeated games with Large Language Models](https://mlsanity.com/paper/2305.16867/) (2023)
- [Active Prompting with Chain-of-Thought for Large Language Models](https://mlsanity.com/paper/2302.12246/) (2023)
- [Making Reasoning Matter: Measuring and Improving Faithfulness of Chain-of-Thought Reasoning](https://mlsanity.com/paper/2402.13950/) (2024)
- [Scaling Laws for Precision](https://mlsanity.com/paper/2411.04330/) (2024)
- [MetaOpenFOAM: an LLM-based multi-agent framework for CFD](https://mlsanity.com/paper/2407.21320/) (2024)

## Built on by (most cited first, 13 of 13)

- [LLM-based Agentic Reasoning Frameworks: A Survey from Methods to Scenarios](https://mlsanity.com/paper/2508.17692/) (2025)
- [Fine-tuning a Large Language Model for Automating Computational Fluid Dynamics Simulations](https://mlsanity.com/paper/2504.09602/) (2025)
- [MooseAgent: A LLM Based Multi-agent Framework for Automating Moose Simulation](https://mlsanity.com/paper/2504.08621/) (2025)
- [ChatCFD: An LLM-Driven Agent for End-to-End CFD Automation with Structured Knowledge and Reasoning](https://mlsanity.com/paper/2506.02019/) (2025)
- [OptMetaOpenFOAM: Large Language Model Driven Chain of Thought for Sensitivity Analysis and Parameter Optimization based on CFD](https://mlsanity.com/paper/2503.01273/) (2025)
- [Agentic Scientific Simulation: Execution-Grounded Model Construction and Reconstruction](https://mlsanity.com/paper/2603.00214/) (2026)
- [Towards LLM-enabled autonomous combustion research: A literature-aware agent for self-corrective modeling workflows](https://mlsanity.com/paper/2601.01357/) (2026)
- [SwarmFoam: An OpenFOAM Multi-Agent System Based on Multiple Types of Large Language Models](https://mlsanity.com/paper/2601.07252/) (2026)
- [AI CFD Scientist: Toward Open-Ended Computational Fluid Dynamics Discovery with Physics-Aware AI Agents](https://mlsanity.com/paper/2605.06607/) (2026)
- [CFD-copilot: leveraging domain-adapted large language model and model context protocol to enhance simulation automation](https://mlsanity.com/paper/2512.07917/) (2025)
- [PhyNiKCE: A Neurosymbolic Agentic Framework for Autonomous Computational Fluid Dynamics](https://mlsanity.com/paper/2602.11666/) (2026)
- [Large language models for partial differential equation workflows](https://mlsanity.com/paper/2608.03600/) (2026)
- [A Case-Bundle Operating Model for Coding Agents in OpenFOAM-Based CFD](https://mlsanity.com/paper/2609.11941/) (2026)

## Abstract (arXiv)

Computational Fluid Dynamics (CFD) is widely used in aerospace, energy, and biology to model fluid flow, heat transfer, and chemical reactions. While Large Language Models (LLMs) have transformed various domains, their application in CFD remains limited, particularly for complex tasks like post-processing. To bridge this gap, we introduce MetaOpenFOAM 2.0, which leverages Chain of Thought (COT) decomposition and iterative verification to enhance accessibility for non-expert users through natural language inputs. Tested on a new benchmark covering simulation (fluid flow, heat transfer, combustion) and post-processing (extraction, visualization), MetaOpenFOAM 2.0 achieved an Executability score of 6.3/7 and a pass rate of 86.9%, significantly outperforming MetaOpenFOAM 1.0 (2.1/7, 0%). Additionally, it proved cost-efficient, averaging 0.15 per case. An ablation study confirmed that COT-driven decomposition and iterative refinement substantially improved task performance. Furthermore, scaling laws showed that increasing COT steps enhanced accuracy while raising token usage, aligning with LLM post-training scaling trends. These results highlight the transformative potential of LLMs in automating CFD workflows for industrial and research applications. Code is available at https://github.com/Terry-cyx/MetaOpenFOAM