Related papers: Phase Behavior of Short Range Square Well Model
In a recent study we have reported a new type of trial wave function symmetric under the exchange of particles and which is able to describe a supersolid phase. In this work, we use the diffusion Monte Carlo method and this model wave…
We study the quantum phase transition from a super solid phase to a solid phase of rho = 1/2 for the extended Bose-Hubbard model on the honeycomb lattice using first principles Monte Carlo calculations. The motivation of our study is to…
We conducted replica exchange Monte Carlo simulations to investigate the phase diagram of identical hard rhombi systems in two dimensions. The rhombi shape varies from nearly square-like, as their minor angle a approaches 90 degrees, to…
A careful Monte Carlo investigation of the phase transition very close to the critical point (T -> Tc, H -> 0) in relatively large d = 3, s = 1/2 Ising lattices did produce critical exponents beta = 0.3126(4) =~ 5/16, delta^{-1} = 0.1997(4)…
We use Quantum Monte Carlo method employing stochastic-series-expansion technique to study the ground state properties of the $t_2-V_1$ model on a square lattice. We find that, away from half-fillings, the minimal combination of…
We present an effective method for simulating wall-bounded multiphase flows consisting of $N$ ($N\geqslant 2$) immiscible incompressible fluids with different densities, viscosities and pairwise surface tensions. The N-phase physical…
The J$_1$-J$_2$ Ising model in the square lattice in the presence of an external field is studied by two approaches: the Cluster Variation Method (CVM) and Monte Carlo simulations. The use of the CVM in the square approximation leads to the…
A quantum Monte Carlo simulation method has been developed and applied to study the critical behavior of a single Kondo impurity in a Luttinger liquid. This numerically exact method has no finite-size limitations and allows to simulate the…
We develop a series of molecular dynamics computer simulations of liquid water, performed with a polarizable potential model, to calculate the spinodal line and the curve of maximum density inside the metastable supercooled region. After…
We test the validity of some widely used phenomenological criteria for the localization of the fluid-solid transition thresholds against the phase diagrams of particles interacting through the exp-6, inverse-power-law, and Gaussian…
Using grand-canonical Monte Carlo simulations, we investigate the phase diagram of hard rods of length $L$ with additional contact (sticky) attractions on square and cubic lattices. The phase diagram shows a competition between gas-liquid…
We present a review on the study of metastable silicon, primarily focusing mainly on the aspects of liquid-liquid transition, critical point and phase behaviour, structural and dynamic properties of liquid phase as well as crystal…
We study the phase behavior and the interfacial tension of the screened Coulomb (Yukawa) restricted primitive model (YRPM) of oppositely charged hard spheres with diameter s using Monte Carlo simulations. We determine the gas-liquid and…
In recent years, a second fluid-fluid phase transition has been reported in several materials at pressures far above the usual liquid-gas phase transition. In this paper, we introduce a new model of this behavior based on the Lennard-Jones…
We consider a hybrid Monte Carlo algorithm which is applicable to lattice theories defined on Lefschetz thimbles. In the algorithm, any point (field configuration) on a thimble is parametrized uniquely by the flow-direction and the…
This work presents a new multiphase SPH model that includes the shifting algorithm and a variable smoothing length formalism to simulate multi-phase flows with accuracy and proper interphase management. The implementation was performed in…
In this paper we address the problem of the prohibitively large computational cost of existing Markov chain Monte Carlo methods for large--scale applications with high dimensional parameter spaces, e.g. in uncertainty quantification in…
The phase behavior of the primitive model of electrolytes is studied in the framework of various mean field approximations obtained recently by means of methods pertaining to statistical field theory (CAILLOL, J.-M., 2004, \textit{J. Stat.…
A lattice boson model is used to study ordering phenomena in regular 2D array of superconductive mesoscopic granules, Josephson junctions or pores filled with a superfluid helium. Phase diagram of the system, when quantum fluctuations of…
We describe a simulation method for the accurate study of the equilibrium freezing properties of polydisperse fluids under the experimentally relevant condition of fixed polydispersity. The approach is based on the phase switch Monte Carlo…