相关论文: Three-phase point in a binary hard-core lattice mo…
The Bell-Lavis model for liquid water is investigated through numerical simulations. The lattice-gas model on a triangular lattice presents orientational states and is known to present a highly bonded low density phase and a loosely bonded…
We study binary mixtures of hard particles, which exclude up to their $k$th nearest neighbors ($k$NN) on the simple cubic lattice and have activities $z_k$. In the first model analyzed, point particles (0NN) are mixed with 1NN ones. The…
We present a comprehensive study of the lattice restricted primitive model, i.e., a lattice gas consisting of an equal number of positively and negatively charged particles interacting via on-site exclusion and a 1/r potential. On the cubic…
A new lattice Boltzmann method for simulating multiphase flows is developed theoretically. The method is adjusted such that its continuum limit is the Navier-Stokes equation, with a driving force derived from the Cahn-Hilliard free energy.…
We introduce a novel mesoscopic computational model based on a multiphase-multicomponent lattice Boltzmann method for the simulation of self-phoretic particles in the presence of liquid-liquid interfaces. Our model features fully resolved…
The three-state Potts model is numerically investigated on three-dimensional simple cubic lattices of up to \(128^3\) volume, concentrating on the neighborhood of the first-order phase transition separating the ordered and disordered…
We study phase transitions of the Potts model on the centered-triangular lattice with two types of couplings, namely $K$ between neighboring triangular sites, and $J$ between the centered and the triangular sites. Results are obtained by…
We investigate the phase diagram and the critical properties of the adsorbate system sulphur/ruthenium(0001) in the coverage region $\frac{1}{4} < \Theta < \frac{1}{3}$ by means of Monte-Carlo simulations of a simple lattice gas model on a…
The antiferromagnetic three-state Potts model on the simple-cubic lattice is studied using Monte Carlo simulations. The ordering in a medium temperature range below the critical point is investigated in detail. Two different regimes have…
We investigate the quenching process in lattice systems with short range interaction and several crystalline states as ground states. We consider in particular the following systems on square lattice: - hard particle (exclusion) model; - q…
The phase diagram of the $S\!=\!1/2$ easy-axis triangular-lattice $J_1\!-\!J_2$ model is investigated using the density-matrix renormalization group and analytical insights. We find a significant spin-liquid region extending from the…
I use the method of classical density-functional theory in the weighted-density approximation of Tarazona to investigate the phase diagram and the interface structure of a two-dimensional lattice-gas model with three phases -- vapour,…
The phase behavior of ionic fluids on simple cubic and tetragonal (anisotropic) lattices has been studied by grand canonical Monte Carlo simulations. Systems with both the true lattice Coulombic potential and continuous-space $1/r$…
Using event driven molecular dynamics simulations, we study a three dimensional one-component system of spherical particles interacting via a discontinuous potential combining a repulsive square soft core and an attractive square well. In…
The Hubbard model and its strong-coupling version, the Heisenberg one, have been widely studied on the triangular lattice to capture the essential low-temperature properties of different materials. One example is given by transition metal…
We study lattice gas systems on the honeycomb lattice where particles exclude neighboring sites up to order $k$ ($k=1\ldots5$) from being occupied by another particle. Monte Carlo simulations were used to obtain phase diagrams and…
We study the thermal phase transitions in a classical (hard-core) lattice gas model with nearest-neighbor three-body interactions on the honeycomb lattice, based on parallel tempering Monte Carlo simulations. This system realizes…
We perform the Monte Carlo simulations of the hard-sphere lattice gas on the simple cubic lattice with nearest neighbour exclusion. The critical activity is estimated, $z_{\rm c} = 1.0588 \pm 0.0003$. Using a relation between the…
We systematically study an extended Bose-Hubbard model with atom hopping and atom-pair hopping in the presence of a three-body constraint on the triangular lattice. By means of large-scale Quantum Monte Carlo simulations, the ground-state…
We use Monte Carlo techniques and analytical methods to study the phase diagram of the M--component Widom-Rowlinson model on the bcc-lattice: there are M species all with the same fugacity z and a nearest neighbor hard core exclusion…