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cs.LG2025★ 2 cited
34 Examples of LLM Applications in Materials Science and Chemistry: Towards Automation, Assistants, Agents, and Accelerated Scientific Discovery
Yoel Zimmermann, Adib Bazgir, Alexander Al-Feghali +32
Large Language Models (LLMs) are reshaping many aspects of materials science and chemistry research, enabling advances in molecular property prediction, materials design, scientifi…
cond-mat.mtrl-sci2025
Kernel Learning Assisted Synthesis Condition Exploration for Ternary Spinel
Yutong Liu, Mehrad Ansari, Robert Black +1
Machine learning and high-throughput experimentation have greatly accelerated the discovery of mixed metal oxide catalysts by leveraging their compositional flexibility. However, t…