4.8 Article

Positive Tolman Length in a Lattice Gas with Three-Body Interactions

Journal

PHYSICAL REVIEW LETTERS
Volume 107, Issue 26, Pages -

Publisher

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevLett.107.265701

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Funding

  1. Austrian Science Fund (FWF) [P22087-N16]
  2. Austrian Science Fund (FWF) [P22087] Funding Source: Austrian Science Fund (FWF)
  3. Austrian Science Fund (FWF) [P 22087] Funding Source: researchfish

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We present a new method to determine the curvature dependence of the interface tension between coexisting phases in a finite volume from free energies obtained by Monte Carlo simulations. For the example of a lattice gas on a 3D fcc lattice with nearest neighbor three-body interactions, we demonstrate how to calculate the equimolar radius R(e) as well as the radius R(s) of the surface of tension and thus the Tolman length delta(R(s)) = R(e) - R(s). Within the physically relevant range of radii, delta(R(s)) shows a pronounced R(s) dependence, such that the simple Tolman parametrization for the interface tension is refutable. For the present model, extrapolation of delta(R(s)) to R(s) -> infinity by various methods clearly indicates a positive limiting value.

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