2 papers
cond-mat.mtrl-sci2026
Catalyst Diffusion Transformer: Generative Inverse Design of Heterogeneous Catalysts
Hayoung Doo, Dong Hyeon Mok, Seoin Back +1
The vast chemical design space and complex, interdependent design variables make catalyst discovery for targeted properties highly labor- and resource-intensive. Although generativ…
cs.MA2026
MIND: AI Co-Scientist for Material Research
Geonhee Ahn, Donghyun Lee, Hayoung Doo +3
Large language models (LLMs) have enabled agentic AI systems for scientific discovery, but most approaches remain limited to textbased reasoning without automated experimental veri…