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Lattice Model Results for Pattern Formation in a Mixture with Competing Interactions.

Andres De VirgiliisAriel G MeyraAlina Ciach
Published in: Molecules (Basel, Switzerland) (2024)
A monolayer consisting of two types of particles, with energetically favored alternating stripes of the two components, is studied by Monte Carlo simulations and within a mesoscopic theory. We consider a triangular lattice model and assume short-range attraction and long-range repulsion between particles of the same kind, as well as short-range repulsion and long-range attraction for the cross-interaction. The structural evolution of the model upon increasing temperature is studied for equal chemical potentials of the two species. We determine the structure factor, the chemical potential-density isotherms, the specific heat, and the compressibility, and show how these thermodynamic functions are associated with the spontaneous formation of stripes with varying degrees of order.
Keyphrases
  • monte carlo
  • molecular dynamics
  • risk assessment
  • heat stress