Thermodynamic models of the stability of clathrate hydrates are important for different applications such as the storage, separation and transport of gases. The development of improved models relies on a better understanding ...

The adsorption of interacting binary mixtures on triangular lattices is studied by combining theory and Monte Carlo (MC) simulations. Two theoretical approximations are used in the present work: (i) the cluster approximation ...

Using Monte Carlo simulations we investigate some new aspects of the phase diagram and the behavior of the diffusion coefficient in an associating lattice gas (ALG) model on different regions of the phase diagram. The ALG ...

The rigorous statistical thermodynamics of interacting linear adsorbates (k-mers) on a discrete onedimensional space is presented in the lattice gas approximation. The coverage and temperature dependence of the Helmholtz ...

In the present paper, the adsorption thermodynamics of a lattice-gas model which mimics a nanoporous environment is studied by considering nonadditive interactions between the adsorbed particles. It is assumed that the ...

In this paper, a two-dimensional lattice-gas model is applied to study the stability and lattice distortion of sI clathrate hydrates of ethylene. Two levels of approximation are considered for the lateral interactions ...

Usually we observe that Bio-physical systems or Bio-chemical systems are many a time based on nanoscale phenomenon in different host environments, which involve many particles can often not be solved explicitly. Instead a ...

In simulations of fluidized beds using computational fluid dynamics (CFD), the description of gas–solid flow hydrodynamics relies on a drag model to account for the momentum transfer between gas and solid phases. Although ...