@article{reasoningdrivendesignofsingleatomcatalys, title = {Reasoning-Driven Design of Single Atom Catalysts via a Multi-Agent Large Language Model Framework}, author = {Dong Hyeon Mok and Seoin Back and Victor Fung and Guoxiang Hu}, year = {2026}, eprint = {2602.21533}, archivePrefix = {arXiv}, url = {https://arxiv.org/abs/2602.21533}, }