MOSAIC: Multi-agent Orchestration for Task-Intelligent Scientific Coding

Abstract: We present MOSAIC, a multi-agent LLM framework for solving challenging scientific coding tasks. Unlike general-purpose coding, scientific workflows require algorithms that are rigorous, interconnected with deep domain knowledge, and incorporate domain-specific reasoning, as well as algorithm iteration without requiring I/O test cases. Many scientific problems also require a sequence of subproblems to be solved, leading to the final desired result. MOSAIC is designed as a training-free framework with specially designed agents to self-reflect, create the rationale, code, and debug within a student-teacher paradigm to address the challenges of scientific code generation. This design facilitates stepwise problem decomposition, targeted error correction, and, when combined with our Consolidated Context Window (CCW), mitigates LLM hallucinations when solving complex scientific tasks involving chained subproblems. We evaluate MOSAIC on scientific coding benchmarks and demonstrate that our specialized agentic framework outperforms existing approaches in terms of accuracy, robustness, and interpretability.