Density-functional approach to phase transitions of submonolayer films. I. The role of the intrinsic and extrinsic ordering forces

L. Mederos, P. Tarazona, and G. Navascués
Phys. Rev. B 35, 3376 – Published 1 March 1987
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Abstract

A density-functional theory for the submonolayer adsorbed film is developed. The adsorbate interactions are restricted to hard repulsions and described with a nonlocal density functional for the free energy, which allows for the presence of intrinsic crystalline order. The competition with the substrate ordering is studied as a function of the temperature and the coverage for different values of the substrate lattice parameter. The phase diagrams obtained include fluid, commensurate, and incommensurate phases.

  • Received 9 June 1986

DOI:https://doi.org/10.1103/PhysRevB.35.3376

©1987 American Physical Society

Authors & Affiliations

L. Mederos, P. Tarazona, and G. Navascués

  • Instituto de Física del Estado Sólido and Departamento de Física del Estado Sólido, Universidad Autónoma de Madrid, Cantoblanco, 28049-Madrid, Spain

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Vol. 35, Iss. 7 — 1 March 1987

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