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Interplay between thermal percolation and jamming upon dimer adsorption on binary alloys.

Ernesto S Loscar1, R A Borzi, Ezequiel V Albano

  • 1Instituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas, (INIFTA), CONICET, UNLP, Sucursal 4, Casilla de Correo 16, (1900) La Plata, Argentina.

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Monte Carlo simulations reveal how surface order affects dimer adsorption. Jamming prevents percolation below a critical temperature, while percolation occurs above it, preserving standard universality classes.

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Area of Science:

  • Surface science
  • Statistical physics
  • Computational materials science

Background:

  • Random sequential adsorption (RSA) is crucial for understanding surface processes.
  • The structural order of substrates significantly influences adsorption phenomena.
  • Binary alloys exhibit order-disorder transitions affecting surface properties.

Purpose of the Study:

  • Investigate jamming and percolation in dimer adsorption on ordered binary alloys.
  • Analyze the impact of substrate structural order on adsorption dynamics.
  • Determine the relationship between annealing temperature and adsorption behavior.

Main Methods:

  • Monte Carlo simulations of dimer adsorption via RSA.
  • Ising model with conserved order parameter to simulate binary alloys.
  • Annealing and quenching protocols to control substrate order.
  • Analysis of density-temperature phase diagrams.

Main Results:

  • Jamming inhibits percolation for T < 1.22Tc; percolation is possible for T > 1.22Tc.
  • Near T* (1.22Tc), jamming and percolation interplay leads to restricted fluctuations.
  • Thermal scaling analysis applied to percolation threshold and fluctuations.
  • Fractal dimension of percolating clusters determined.

Conclusions:

  • The annealing temperature acts as a control parameter for adsorption processes.
  • Despite complex interplay, the universality class of standard percolation is maintained.
  • Findings contribute to understanding adsorption on structured surfaces.