Chain of Unit-Physics: A Primitive-Centric Approach to Scientific Code Synthesis
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arXiv
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| Autori principali: | , |
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| Natura: | Preprint |
| Pubblicazione: |
2025
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| _version_ | 1866914175783010304 |
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| author | Sharma, Vansh Raman, Venkat |
| author_facet | Sharma, Vansh Raman, Venkat |
| contents | Agentic large language models are proposed as autonomous code generators for scientific computing, yet their reliability in high-stakes problems remains unclear. Developing computational scientific software from natural-language queries remains challenging broadly due to (a) sparse representation of domain codes during training and (b) the limited feasibility of RLHF with a small expert community. To address these limitations, this work conceptualizes an inverse approach to code design, embodied in the Chain of Unit-Physics framework: a first-principles (or primitives)-centric, multi-agent system in which human expert knowledge is encoded as unit-physics tests that explicitly constrain code generation. The framework is evaluated on a nontrivial combustion task, used here as a representative benchmark for scientific problem with realistic physical constraints. Closed-weight systems and code-focused agentic variants fail to produce correct end-to-end solvers, despite tool and web access, exhibiting four recurrent error classes: interface (syntax/API) hallucinations, overconfident assumptions, numerical/physical incoherence, and configuration fragility. Open-weight models with chain-of-thought (CoT) decoding reduce interface errors but still yield incorrect solutions. On the benchmark task, the proposed framework converges within 5-6 iterations, matches the human-expert implementation (mean error of $3.1\times10^{-3}$ %), with a $\sim$33.4 % faster runtime and a $\sim$30 % efficient memory usage at a cost comparable to mid-sized commercial APIs, yielding a practical template for physics-grounded scientific code generation. As datasets and models evolve, zero-shot code accuracy will improve; however, the Chain of Unit-Physics framework goes further by embedding first-principles analysis that is foundational to scientific codes. |
| format | Preprint |
| id |
arxiv_https___arxiv_org_abs_2512_01010 |
| institution | arXiv |
| publishDate | 2025 |
| record_format | arxiv |
| spellingShingle | Chain of Unit-Physics: A Primitive-Centric Approach to Scientific Code Synthesis Sharma, Vansh Raman, Venkat Multiagent Systems Artificial Intelligence Machine Learning Software Engineering Computational Physics Fluid Dynamics F.2.2; I.2.2; I.2.6; I.2.7; J.2 Agentic large language models are proposed as autonomous code generators for scientific computing, yet their reliability in high-stakes problems remains unclear. Developing computational scientific software from natural-language queries remains challenging broadly due to (a) sparse representation of domain codes during training and (b) the limited feasibility of RLHF with a small expert community. To address these limitations, this work conceptualizes an inverse approach to code design, embodied in the Chain of Unit-Physics framework: a first-principles (or primitives)-centric, multi-agent system in which human expert knowledge is encoded as unit-physics tests that explicitly constrain code generation. The framework is evaluated on a nontrivial combustion task, used here as a representative benchmark for scientific problem with realistic physical constraints. Closed-weight systems and code-focused agentic variants fail to produce correct end-to-end solvers, despite tool and web access, exhibiting four recurrent error classes: interface (syntax/API) hallucinations, overconfident assumptions, numerical/physical incoherence, and configuration fragility. Open-weight models with chain-of-thought (CoT) decoding reduce interface errors but still yield incorrect solutions. On the benchmark task, the proposed framework converges within 5-6 iterations, matches the human-expert implementation (mean error of $3.1\times10^{-3}$ %), with a $\sim$33.4 % faster runtime and a $\sim$30 % efficient memory usage at a cost comparable to mid-sized commercial APIs, yielding a practical template for physics-grounded scientific code generation. As datasets and models evolve, zero-shot code accuracy will improve; however, the Chain of Unit-Physics framework goes further by embedding first-principles analysis that is foundational to scientific codes. |
| title | Chain of Unit-Physics: A Primitive-Centric Approach to Scientific Code Synthesis |
| topic | Multiagent Systems Artificial Intelligence Machine Learning Software Engineering Computational Physics Fluid Dynamics F.2.2; I.2.2; I.2.6; I.2.7; J.2 |
| url | https://arxiv.org/abs/2512.01010 |