4 papers
Harnessing X-ray Absorption Spectroscopy Data through Multimodal Mining of Battery Literature
Tanjin He, Aikaterini Vriza, Logan Ward +7
X-ray absorption spectroscopy (XAS) is central to understanding the local electronic and atomic structure of materials, yet most published spectra remain inaccessible to data-drive…
Matter to Mechanism: A Benchmark for AI Co-Scientists in Materials and Battery Research
Shashwat Sourav, Tanjin. He, Maria K. Y. Chan +2
AI co-scientists are increasingly used for scientific discovery, but current evaluations still do not test them on a key task: moving from a concrete scientific or technological pr…
Experiences with Model Context Protocol Servers for Science and High Performance Computing
Haochen Pan, Ryan Chard, Reid Mello +12
Large language model (LLM)-powered agents are increasingly used to plan and execute scientific workflows, yet most research cyberinfrastructure (CI) exposes heterogeneous APIs and…
Advances and Challenges in Foundation Agents: From Brain-Inspired Intelligence to Evolutionary, Collaborative, and Safe Systems
Bang Liu, Xinfeng Li, Jiayi Zhang +45
The advent of large language models (LLMs) has catalyzed a transformative shift in artificial intelligence, paving the way for advanced intelligent agents capable of sophisticated…