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

Two New CNEO Landmark Papers from Our Group in JCTC
August 26, 2025
Celebrating Summer and Science by Lake Mendota
July 26, 2025

Congratulations to Dr. James Langford on Earning His PhD!
September 5, 2024

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