Geometric integrator for Langevin systems with quaternion-based rotational degrees of freedom and hydrodynamic interactions

We introduce new Langevin-type equations describing the rotational and translational motion of rigid bodies interacting through conservative and non-conservative forces, and hydrodynamic coupling. In the absence of non-conservative forces the Langevin-type equations sample from the canonical ensembl...

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Bibliographic Details
Main Authors: Davidchack, R.L., Ouldridge, T.E., Tretyakov, M.V.
Format: Article
Published: American Institute of Physics 2017
Subjects:
Online Access:https://eprints.nottingham.ac.uk/48725/