Yang YangView profile
Assistant Professor
Yang Yang is an Assistant Professor of Chemistry at the University of Wisconsin-Madison , focusing on electronic structure theory and nuclear quantum effects in molecular systems. He leads the Yang Group , a theoretical and computational team specializing in the Constrained Nuclear-Electronic Orbital (CNEO) framework for accurate quantum simulations. B.S. in Chemistry and Physics, Peking University (2011) Ph.D., Duke University (2016) Postdoctoral Associate, University of Illinois at Urbana-Champaign and Yale University (2016–2019) His research spans method development in multicomponent quantum theory , excited states theory , and practical quantum chemistry calculations . Recent work includes landmark papers in Journal of Chemical Theory and Computation on CNEO-based reaction rate calculations and quantum computation applications. The Yang Group has secured NSF funding (2024) for CNEO integration into computational software. Publications emphasize nuclear quantum delocalization effects , vibrational spectra modeling , and nonadiabatic dynamics . NSF Grant (2024) for CNEO software integration Awards at 2024 ACS Fall Meeting Current advisees include graduate students Haoran Chen , Lin Han , Zhe Liu , Yiwen Wang , and Yuzhe Zhang . The group also collaborates with postdoctoral researchers like Zehua Chen and Tanner Culpitt .









