Themes
I am working on mathematical and algorithmic questions motivated by applications in computational physics, specifically the computation of kinetic properties in molecular systems. My work has focused on properties of metastable and nonequilibrium stochastic dynamics, using tools from both PDE and probability theory, such as semiclassical analysis, shape optimization for eigenvalue problems and constrained SDEs. I am also very interested in the development of numerical methods addressing the challenges of metastability and transport coefficients.
Journal articles
- Fixing the flux: A dual approach to computing transport coefficients, Noé Blassel & Gabriel Stoltz, 2024, Journal of Statistical Physics , vol. 191, art. no. 17. DOI, arXiv, HAL, Code
- Shape optimization of metastable states, Noé Blassel, Tony Lelièvre & Gabriel Stoltz, 2026, to appear in Mathematical Models and Methods in Applied Sciences. DOI, arXiv, HAL, Code, Data
- Overdamped limits for Langevin dynamics with position-dependent coefficients via $L^2$-hypocoercivity, Noé Blassel, 2026, Stochastic Processes and their Applications, vol. 199, art. no. 104995. DOI, arXiv, HAL
Preprints
- Quantitative low-temperature spectral asymptotics for reversible diffusions in temperature-dependent domains, Noé Blassel, Tony Lelièvre & Gabriel Stoltz, 2025. arXiv, HAL
- Mathematical analysis and numerical methods for the computation of transport coefficients in molecular dynamics, Noé Blassel, Louis Carillo, Shiva Darshan, Raphaël Gastaldello, Alessandra Iacobucci, Elisa Marini, Régis Santet, Xiaocheng Shang, Gabriel Stoltz, Urbain Vaes, 2026. arXiv, HAL, Code
Software
I am one of the main contributors to the POPSRegression.jl package. Research codes for my numerical work are available on my github.
Invited talks and teaching in research schools
- SINEQ Summer School 2023: hands-on session on Parallel Replica dynamics. (09/2023), GitHub, notebook
- SINEQ Summer School 2023: Computing transport coefficients with Molly. (09/2023), slides
- PASC 2024, Zürich: Fixing the flux with Molly.jl (06/2024) slides
- Kinetic Equations, Mathematical Physics and Probability, BCAM, Bilbao: Sharp spectral asymptotics for metastable diffusions trapped in moving domains (06/2024) slides
- Presentation to the Mathematics for Materials Modelling group at EPFL: Shape-optimization of metastable timescales. (04/25) slides
- Workshop “QSD and applications” at CERMICS: Shape-optimization of metastable timescales. (05/25) slides
- “Sampling High-Dimensional Probability Measures with Applications in (Non)Equilibrium Molecular Dynamics and Statistics” CECAM Summer School at University of Birmingham: Fixing the flux, a dual approach to computing transport coefficients. (07/25) slides
- CECAM Summer School in Birmingham: hands-on session on computing transport coefficients with Molly (07/25) repo
- ANR SINEQ final conference, L’Aquila. A Dual Approach to Computing Transport Coefficients. (10/2025) slides
- “Stochastic algorithms” working group at CERMICS, Champs-Sur-Marne. (01/2026) Learning quasistationarity diagnostics for accelerated molecular dynamics. slides
- “New ideas in molecular dynamics” minisymposium, SCICADE 2026, University of Edinburgh. (06/2026) Learning quasistationarity diagnostics for accelerated molecular dynamics. slides
- WCCM ECCOMAS 2026, ECCOMAS PhD Olympiads, Munich. (07/2026) Spectral shape optimization and asymptotic analysis of metastability for accelerated MD. slides
Contributed talks and other scientific outreach
- Workshop: Implementing Dissipative Particle Dynamics in Molly (12/2022, Jupyter notebook)
- Meeting of ANR SINEQ. Presentation on Norton dynamics. (12/2022, slides)
- CECAM Mixed-Gen online meetup on simulation of transport processes. Poster on Norton dynamics. (12/2022, poster)
- GAMM 2023, Dresden 93d annual meeting in Dresden. Talk on Norton dynamics. (05/2023, slides)
- MCM2023, Paris conference on Monte-Carlo methods and applications in Paris. Talk on Norton dynamics. (06/2023), slides
- Spring Long Program at IMSI, 2024, Chicago: How to find good metastable states? (04/2024), slides, video
- Journées de Probabilités 2024, Bordeaux: Sharp spectral asymptotics for metastable diffusions trapped in a temperature-dependent domain (06/2024) slides
- CERMICS Young Researchers Seminar: Sharp spectral asymptotics for metastable diffusions trapped in moving domains (06/2024) slides
- GAMM-MOANSI ANNUAL MEETING 2024: Sharp spectral asymptotics for metastable diffusions in temperature-dependent traps. (11/24) slides
- Todai WINGS program meetup at École des Ponts: Mathematical Questions in Molecular Dynamics. (02/25) slides
- 12th French Biennal of Applied and Industrial Mathematics (SMAI2025): Shape-optimization of metastable timescales for accelerated sampling of trajectories. (06/25) slides
- “New trends and applications around generalized Fokker-Planck operators” program at Bernoulli Center, EPFL, Lausanne: Shape-sensitive spectral asymptotics for metastable timescales. slides
- “Analysis and simulation of quantum and molecular systems” workshop, RWTH, Aachen. (05/2026) Shape-sensitive spectral asymptotics for overdamped Langevin dynamics. slides