This project will enable predictive large-scale atomistic materials simulations that approach quantum-level accuracy by developing an automated framework for discovering and generating optimal fitted potentials with rigorous error bounds that do not require experimental input. The outcome will be a broad capability for predicting the complex physical and chemical responses of materials under a wide Continue Reading »
Month: August 2022
Dr. Lindsey and collaborators win DOE Chemical and Materials Sciences to Advance Clean Energy Technologies and Low-Carbon Manufacturing grant
For proposal entitled “Membrane-Catalyst Co-Design for Transformative Manufacturing.”