| Literature DB >> 16712334 |
Jeetain Mittal1, Jeffrey R Errington, Thomas M Truskett.
Abstract
We study how confining the equilibrium hard-sphere fluid to restrictive one- and two-dimensional channels with smooth interacting walls modifies its structure, dynamics, and entropy using molecular dynamics and transition-matrix Monte Carlo simulations. Although confinement strongly affects local structuring, the relationships between self-diffusivity, excess entropy, and average fluid density are, to an excellent approximation, independent of channel width or particle-wall interactions. Thus, thermodynamics can be used to predict how confinement impacts dynamics.Mesh:
Substances:
Year: 2006 PMID: 16712334 DOI: 10.1103/PhysRevLett.96.177804
Source DB: PubMed Journal: Phys Rev Lett ISSN: 0031-9007 Impact factor: 9.161