Multicomponent fluid of hard spheres near a wall

Alexandr Malijevský, Santos B. Yuste, Andrés Santos, and Mariano López de Haro
Phys. Rev. E 75, 061201 – Published 5 June 2007

Abstract

The rational function approximation method, density functional theory, and NVT Monte Carlo simulation are used to obtain the density profiles of multicomponent hard-sphere mixtures near a planar hard wall. Binary mixtures with a size ratio 1:3 in which both components occupy a similar volume are specifically examined. The results indicate that the present version of density functional theory yields an excellent overall performance. A reasonably accurate behavior of the rational function approximation method is also observed, except in the vicinity of the first minimum, where it may even predict unphysical negative values.

  • Figure
  • Figure
  • Figure
  • Figure
  • Figure
  • Received 13 February 2007

DOI:https://doi.org/10.1103/PhysRevE.75.061201

©2007 American Physical Society

Authors & Affiliations

Alexandr Malijevský*

  • E. Hála Laboratory of Thermodynamics, Academy of Science of the Czech Republic, Prague 6, Czech Republic and Institute of Theoretical Physics, Faculty of Mathematics and Physics, Charles University, Prague 8, Czech Republic

Santos B. Yuste and Andrés Santos

  • Departamento de Física, Universidad de Extremadura, E-06071 Badajoz, Spain

Mariano López de Haro§

  • Centro de Investigación en Energía, Universidad Nacional Autónoma de México (UNAM), Temixco, Morelos 62580, Mexico

  • *Electronic address: malijevsky@icpf.cas.cz
  • Electronic address: santos@unex.es; URL:http://www.unex.es/fisteor/santos/
  • Electronic address: andres@unex.es; URL:http://www.unex.es/fisteor/andres/
  • §Electronic address: malopez@servidor.unam.mx; URL: http://xml.cie.unam.mx/xml/tc/ft/mlh/

Article Text (Subscription Required)

Click to Expand

References (Subscription Required)

Click to Expand
Issue

Vol. 75, Iss. 6 — June 2007

Reuse & Permissions
Access Options
Author publication services for translation and copyediting assistance advertisement

Authorization Required


×
×

Images

×

Sign up to receive regular email alerts from Physical Review E

Log In

Cancel
×

Search


Article Lookup

Paste a citation or DOI

Enter a citation
×