4 papers
From Knowledge to Action: Outcomes of the 2025 Large Language Model (LLM) Hackathon for Applications in Materials Science and Chemistry
Aritra Roy, Kevin Shen, Andrew MacBride +350
Large language models (LLMs) are rapidly changing how researchers in materials science and chemistry discover, organize, and act on scientific knowledge. This paper analyzes a broa…
Scaling and Analytical Approximation of Porous Electrode Theory for Reaction-limited Batteries
Shakul Pathak, Martin Z. Bazant
Porous electrode theory (PET) provides essential insights into electrochemical states, but its computational complexity hinders real-time control and obscures scaling relations. To…
Crossover Dynamics of Non-Fickian Ionic Diffusion in Solids
Gangbin Yan, Pierfrancesco Ombrini, Zhichu Tang +14
Ionic diffusion in solids is central to energy storage, electronics, and catalysis, yet its chemical origins are difficult to resolve because conventional diffusion models struggle…
A universal approximation for conductance blockade in thin nanopore membranes
Arjav Shah, Shakul Pathak, Slaven Garaj +3
Nanopore-based sensing platforms have transformed single-molecule detection and analysis. The foundation of nanopore translocation experiments lies in conductance measurements, yet…