My group started working on hybrid DFT three years ago when we began our collaboration with the Park group, with whom we were trying to understand the properties of conducting metal-organic frameworks ...

A rotating cylinder with its side cut away to expose the core, showing patches of purple, blue, green, yellow, and orange that are dense in the middle and more diffuse toward the edges. This rotating ...

This research identifies failures in existing SIC methods and paves the way for refining DFT. "Transition metals are essential in our lives, and as we increase the accuracy of modeling through density ...