Dynamic density functional theory with inertia and background flow
We present dynamic density functional theory (DDFT) incorporating general inhomogeneous, incompressible, time dependent background flows and inertia, describing externally driven passive colloidal systems out of equilibrium. We start by considering the underlying nonequilibrium Langevin dynamics, including the effect of the local velocity of the surrounding liquid bath, to obtain the nonlinear, nonlocal partial differential equations governing the evolution of the (coarse–grained) density and velocity fields describing the dynamics of colloids. Additionally, we show both with heuristic arguments, and by numerical solution, that our equations and solutions agree with existing DDFTs in the overdamped (high friction) limit. We provide numerical solutions that model the flow of hard spheres, in both unbounded and confined domains, and compare to previously–derived DDFTs with and without the background flow.
Funding
Statistical mechanics of soft matter: Derivation, analysis and implementation of dynamic density functional theories
Engineering and Physical Sciences Research Council
Find out more...History
School
- Science
Department
- Mathematical Sciences
Published in
The Journal of Chemical PhysicsVolume
160Issue
17Publisher
AIP PublishingVersion
- VoR (Version of Record)
Rights holder
© Author(s)Publisher statement
All article content, except where otherwise noted, is licensed under a Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).Acceptance date
2024-04-18Publication date
2024-05-06Copyright date
2024ISSN
0021-9606eISSN
1089-7690Publisher version
Language
- en