Welcome to the Yang Group!
We are a theoretical and computational group specializing in electronic structure theory and dynamics theory.
The research focus of our group is the accurate and efficient descriptions of nuclear quantum effects, especially quantum nuclear delocalization effects, through our Constrained Nuclear-Electronic Orbital (CNEO) framework. For details, please see our Research and Publication page.
Latest News
Congratulations to Dr. James Langford on Earning His PhD!
September 5, 2024Yiwen Selected as MolSSI Software Fellow
July 3, 202454th MWTCC Successfully Hosted at UW-Madison
June 2, 2024- More