Faculty
FLORIDA STATE / PEOPLE / FACULTY
Dr. A. Eugene DePrince III, Professor
Professional Preparation/Appointments
Ph.D. University of Chicago (2009)
Postdoc, Argonne National Laboratory (2010-2011)
Postdoc, Georgia Institute of Technology (2011-2013)
Contact Information
| deprince@chem.fsu.edu | ||
| Office | 3005 CSL | 850.645.1291 |
| Lab | 4806 CSL | |
Programs of Research
Physical
Research Specialties
Computational Chemistry
Research Interest
High-quality electronic structure software is an essential component of modern chemical research, and open-source software is particularly valuable. Our primary research efforts are dedicated to the development of open-source tools for modeling the electronic structure of complex molecules and materials. In particular, we develop computationally affordable methods for the accurate description of strongly correlated electrons and explicitly time-dependent light-matter interactions.
Faculty Interview
Publications
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| S. H. Yuwono and A. E. DePrince III, N-representability violations in truncated equation-of-motion coupled-cluster methods. J. Chem. Phys. 2023 159, 054113. |
| S. H. Yuwono, B. C. Cooper, T. Zhang, X. Li, and A. E. DePrince III, Time-dependent equation-of-motion coupled-cluster theory simulations with a defective Hamiltonian. J. Chem. Phys. 2023, 159, 044113. |
| N. Vu, G. M. McLeod, K. Hanson, and A. E. DePrince III, Enhanced diastereocontrol via strong light-matter interactions in an optical cavity. J. Phys. Chem. A 2022, 126, 9303-9312. |
| R. R. Li, N. C. Rubin, and A. E. DePrince III, Challenges for variational reduced-density-matrix theory: Total angular momentum constraints. J. Chem. Theory Comput. 2022, 18, 5966-5977. |
| M. D. Liebenthal, N. Vu, and A. E. DePrince III, Equation-of-motion cavity quantum electrodynamics coupled-cluster theory for electron attachment. J. Chem. Phys. 2022, 156, 054105. |