Time-dependent density functional theory for driven lattice gas systems with interactions

We present a new method to describe the kinetics of driven lattice gases with particle-particle interactions beyond hard-core exclusions. The method is based on the time-dependent density functional theory for lattice systems and allows one to set up closed evolution equations for mean site occupati...

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Bibliographic Details
Published inEurophysics letters Vol. 93; no. 5; pp. 50003 - 50007
Main Authors Dierl, M, Maass, P, Einax, M
Format Journal Article
LanguageEnglish
Published IOP Publishing 01.03.2011
EPS, SIF, EDP Sciences and IOP Publishing
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Summary:We present a new method to describe the kinetics of driven lattice gases with particle-particle interactions beyond hard-core exclusions. The method is based on the time-dependent density functional theory for lattice systems and allows one to set up closed evolution equations for mean site occupation numbers in a systematic manner. Application of the method to a totally asymmetric site exclusion process with nearest-neighbor interactions yields predictions for the current-density relation in the bulk, the phase diagram of non-equilibrium steady states and the time evolution of density profiles that are in good agreement with results from kinetic Monte Carlo simulations.
Bibliography:ark:/67375/80W-TBDVM7RQ-W
istex:A0CB3C8367A39CD9C017654AFFD44E63DC8EEF0F
publisher-ID:epl13337
ISSN:0295-5075
1286-4854
DOI:10.1209/0295-5075/93/50003