Huan Lei

Assistant Professor, Department of Computational Mathematics, Science and Engineering
Assistant Professor, Department of Statistics & Probability
Location: 1501 Engineering Bldg
Profile photo of  Huan Lei
Photo of: Huan Lei

Bio

My research focuses on computational mathematics, particularly on developing numerical methods for learning partial differential equation (PDE) and stochastic differential equation (SDE) models arising from multi-scale problems. I am interested in designing structure-preserving algorithms that retain essential mathematical properties, such as conservation laws, variational structures, and physical constraints. A central aspect of my work is integrating scientific machine learning (SciML) with numerical analysis to construct accurate and physically interpretable PDE and SDE models of multi-scale systems directly from first-principle descriptions, where conventional approaches often show limitations.



Research Interests
===
+ Multi-scale modeling
+ Structure-preserving PDE models and numerical schemes
+ Model reduction and stochastic simulations
+ Scientific machine-learning

###Education
Ph. D. 2012, Applied Mathematics, Brown University - Advisor:  George Karniadakis
B.S. 2005, Special Class for the Gifted Young, Univ. of Science & Technology of China

###Professional Appointment
Post-doctoral Associate, Brown University (2012 -2013)
Post-doctoral Associate, Pacific Northwest National Laboratory (2013 -2015)
Scientist, Pacific Northwest National Laboratory (2015 -2019)


###Openings
One Ph.D. position is available starting in Fall 2025 or Spring 2026. While my research is motivated by computational modeling of multi-scale problems, such as molecular, fluid, and kinetic systems, my primary goal is to develop mathematically rigorous and computationally efficient methods for learning and simulating complex dynamical systems. I seek motivated Ph.D. students with a strong background in numerical analysis, applied mathematics, or scientific computing who are interested in developing new numerical methods rather than applying existing techniques to domain-specific applications. If you are interested, please contact me by email.

Selected Publications

  • H. Lei, N. A. Baker, and X. Li. Data-Driven Parameterization of the Generalized Langevin Equation. *Proc. Natl. Acad. Sci.* 113 (50):14183–14188, 2016 View Publication
  • L. Fang , P. Ge, L. Zhang, W. E, and H. Lei. DeePN2: A Deep Learning-Based non-Newtonian Hydrodynamic Model. *Journal of Machine Learning* 1: 114–140, 2022 View Publication
  • L. Lyu and H. Lei. Construction of coarse-grained molecular dynamics with many-body non-Markovian memory. *Phys. Rev. Lett.* 131:177301, 2023 View Publication
  • L. Lyu and H. Lei. On the generalization ability of coarse-grained molecular dynamics models for non-equilibrium processes. *arXiv*:2409.11519, 2024 (under review by SIAM Multiscale Modeling & Simulation) View Publication
  • P. Ge, Z. Zhang, and H. Lei. Data-driven learning of the generalized Langevin equation with state-dependent memory. *Phys. Rev. Lett.* 133:077301, 2024 View Publication
  • W. E, H. Lei, P. Xie, and L. Zhang. Machine learning-assisted multi-scale modeling. *Journal of Mathematical Physics*, 64(7):071101, 2023 View Publication