Using large language models to probe the limits of atom-centered structural descriptors
physics.chem-ph, cs.LG
Submitted: 2026-07-29
Updated: 2026-10-02
Terminology
Sources
- Bolzano: Case Studies in LLM-Assisted Mathematical Research
- Semi-Autonomous Mathematics Discovery with Gemini: A Case Study on the Erd\H{o}s Problems
- An explicit lower bound for the unit distance problem
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