Publications

You can also find my articles on my Google Scholar profile.

Published


Optimizing the diffusion coefficient of overdamped Langevin dynamics

T. Lelièvre, G. A. Pavliotis, G. Robin, R. Santet, G. Stoltz

Mathematics of Computation (2025)

Improving sampling by modifying the effective diffusion

T. Lelièvre, R. Santet, G. Stoltz

Journal of Computational Physics (2025)

Unbiasing Hamiltonian Monte Carlo algorithms for a general Hamiltonian function

T. Lelièvre, R. Santet, G. Stoltz

Foundations of Computational Mathematics (2024)

Preprints


Mathematical analysis and numerical methods for the computation of transport coefficients in molecular dynamics

N. Blassel, L. Carillo, S. Darshan, R. Gastaldello, A. Iacobucci, E. Marini, R. Santet, X. Shang, G. Stoltz, U. Vaes

Preprint (2026)