Noé Blassel

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20232026

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math.NA2026

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

Noe Blassel, Louis Carillo, Shiva Darshan +7

We review various numerical approaches to compute transport coefficients in molecular dynamics. These approaches can be broadly classified into three groups: (i) nonequilibrium met…

math.PR2026

Overdamped limits for Langevin dynamics with position-dependent coefficients via $L^{2}$ -hypocoercivity

Noé Blassel

This note provides a simple derivation of the overdamped approximation for kinetic (or underdamped) equilibrium Langevin dynamics, in cases where certain coefficients depend on the…

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

Overdamped limits for Langevin dynamics with position-dependent coefficients via L2-hypocoercivity

Overdamped limits for Langevin dynamics with position-dependent coefficients via $L^{2}$ -hypocoercivity