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Finite-inertia effects in Langevin dynamics of a lopsided elastic dumbbell using exponential-time differencing schemes

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arXiv:2605.31078v1 Announce Type: cross Abstract: Inertia effects in the Langevin dynamics of a lopsided elastic dumbbell are investigated using exponential-time-differencing (ETD) integrators for the corresponding stiff stochastic equations at small mass limit. Starting from the bead-level underdamped Langevin model, we formulate the dynamics in modal coordinates, highlighting two distinct friction scales: an additive friction $\zeta_{\rm trans}=\zeta_1+\zeta_2$ controlling translation...

arXiv:2605.31078v1 Announce Type: cross Abstract: Inertia effects in the Langevin dynamics of a lopsided elastic dumbbell are investigated using exponential-time-differencing (ETD) integrators for the corresponding stiff stochastic equations at small mass limit. Starting from the bead-level underdamped Langevin model, we formulate the dynamics in modal coordinates, highlighting two distinct friction scales: an additive friction $\zeta_{\rm trans}=\zeta_1+\zeta_2$ controlling translation ($\zeta_i, i=1,2$ are the friction factor on bead $i$), and an effective internal friction $1/\zeta_{\rm eff}=1/\zeta_1+1/\zeta_2$ controlling configurational relaxation, with relaxation time $\tau_R=\zeta_{\rm eff}/H$ for a Hookean spring of stiffness $H$. We benchmark ETD against Euler--Maruyama and overdamped Brownian dynamics using equilibrium statistics, time-domain autocorrelations, and frequency-domain power spectra of the end-to-end vector. When time is rescaled by $\tau_R$, configurational and orientational relaxation curves collapse across asymmetry ratios, showing that the dominant long-time structural dynamics remains close to the overdamped description. Inertial signatures are instead confined to short-time transients, high-frequency modifications of the configurational spectrum, and a transient coupling between translational and internal modes. This study provides a practical and accurate route for lopsided dumbbells across overdamped and weakly underdamped regimes, and clarify how mass and friction asymmetry affect the translational and internal dynamics.
Langevin (LOCATION) ETD (ORG) Hookean (ORG) Euler (ORG) Brownian (ORG)
Originally published by arXiv Physics Read original →