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I. V. Pylyuk

Publications and source records attributed to I. V. Pylyuk.

At least 19 recordsLinked to original sources

Phase diagram of a double-occupancy cell model of a fluid with Curie-Weiss interaction

A double-occupancy cell model of a fluid with Curie-Weiss interaction is studied. First, we show that the model is isomorphic to the Blume-Capel model on a complete graph through a simple transformation from spin to occupancy variables. We then investigate its phase behavior within the grand-canonical ensemble using a combination of analytical and numerical methods. Despite its simplicity, the model exhibits a remarkably rich thermodynamic behavior depending on the ratio between the local repulsive and global attractive interactions. We identify regimes characterized by a single critical point, two distinct critical points, tricritical behavior, and triple-point formation. For sufficiently strong repulsion, the system possesses three fluid phases of different densities, leading to both gas-liquid and liquid-liquid coexistence. The locations of the critical, tricritical, and triple points are determined, and the corresponding phase diagrams are constructed. These results demonstrate that the competition between double-occupancy repulsion and long-range attraction is sufficient to generate complex phase behavior in a minimal multiple-occupancy lattice-gas model.

cond-mat.stat-mech

The cell fluid model with Curie-Weiss interactions: special cases and analytical results

Inspired by previous extensive numerical studies of a cell fluid model with Curie-Weiss interactions, we concentrate on some analytically tractable special cases in its description. The key ingredient of the model is a competition between global attraction and local repulsion interactions between particles with coupling constants $J_1$ and $J_2$, respectively. We provide analytical results in several limiting cases, including the ideal-gas limit $J_1=J_2=0$ and the strong-repulsion limit $J_2\gg J_1$. For $J_2\gg J_1$, a detailed analytical study is presented. We derive explicit expressions for the critical point parameters, the equation of state, and the binodal and spinodal curves in closed form. The equation of state is found to be in full agreement with that of the van der Waals lattice gas, and the order parameter satisfies the standard Curie-Weiss equation. In a neighborhood of the critical point, a Landau expansion is shown to have the same form and symmetry as that of the classical lattice gas within the mean-field approximation. Moreover, based on the explicit knowledge of a few leading terms in the asymptotic expansion of the deformed exponential function governing the physics of the cell model, we extend its validity range to include the marginal case of thermodynamic stability, $J_1=J_2$. In particular, this extension makes a consideration of the ideal-gas limit $J_1=J_2=0$ formally legitimate. For the generic marginal case $J_1=J_2\ne0$ systematically avoided in previous works, we present numerical data and phase diagrams that augment their findings for $J_2>J_1$.

cond-mat.stat-mech

Thermodynamic response functions in a cell fluid model with Curie-Weiss interaction. I. Supercritical region

Thermodynamic response functions, including the isothermal compressibility, the thermal pressure coefficient, and the thermal expansion coefficient, isochoric and isobaric heat capacities are explicitly derived for a many-particle system interacting through a Curie-Weiss-type potential. These calculations are based on an exact equation of state previously obtained for a cell fluid model in the grand canonical ensemble. The resulting response functions are presented graphically as functions of temperature, density, and chemical potential within the supercritical region.

cond-mat.stat-mech

Triple point in a cell fluid model with effective temperature-dependent attraction

We study a cell fluid model of a many-particle system with Curie-Weiss-type interaction potential. It is considered as an open system in a fixed volume partitioned into a large number of congruent cubic cells. The interaction potential comprises two competing components: a global uniform attraction acting between all particle pairs in the volume and a short-range repulsion between particles occupying the same cell. Previous studies have established that this model admits an exact solution, exhibits multiple critical points, and undergoes a sequence of first-order phase transitions. Despite variations in the interaction strengths, no triple point appears as long as these parameters remain fixed. We demonstrate that incorporating effective {temperature-dependent} attractive interactions fundamentally alters the phase behavior of the cell model. This modification preserves the model's exact solvability while resulting in the emergence of a triple point in the phase diagram.

cond-mat.stat-mech

Entropy of the cell fluid model with Curie-Weiss interaction

Entropy of the cell fluid model with Curie-Weiss interaction is obtained in analytical form as a function of temperature and chemical potential. A parametric equation is derived representing the entropy as a function of density. Features of both the entropy per particle and the entropy per cell are investigated at the entropy-density and entropy-chemical potential planes. The considered cell model is a multiple-occupancy model and possesses an infinite sequence of first-order phase transitions at sufficiently low temperatures. We find that the entropy exhibits pronounced minima at around integer-valued particle densities, which may be a generic feature of multiple-occupancy models.

cond-mat.stat-mech

A multiple occupancy cell fluid model with competing attraction and repulsion interactions

An analytically solvable cell fluid model with unrestricted cell occupancy, infinite-range Curie-Weiss-type attraction and short-range intra-cell repulsion is studied within the grand-canonical ensemble. Building on an exact single-integral representation of the grand partition function, we apply Laplace's method to obtain asymptotically exact expressions for the pressure, density and equation of state. The model exhibits a hierarchy of first-order transitions, each terminating at a critical point. We determine the coordinates of the first five such points. Recasting the formalism in dimensionless variables highlights the explicit temperature dependence of all thermodynamic functions. This enables us to derive a closed-form expression for the entropy. The results reveal pronounced entropy minima around integer cell occupancies and reproduce density-anomaly isotherm crossings analogous to those in core-softened models.

cond-mat.stat-mech

Influence of attractive parts of interaction potentials on critical point parameters

We investigate how microscopic features of interparticle potentials influence macroscopic critical point parameters. Our analytical calculations are based on the cell model for continuous many-particle systems. We explore two types of pair interactions described by the Morse potential and a Curie-Weiss-type potential. For Morse fluids, we present numerical results obtained with microscopic parameters corresponding to the alkali metals sodium (Na) and potassium (K). The calculated dimensionless critical point parameters for liquid Na and K, expressed in dimensional units, allow for direct comparison with available experimental and simulation data. For the Curie-Weiss cell model with competing interactions, which exhibits a sequence of first-order phase transitions, we examine the critical parameters for the first three critical points. We analyze our results by varying the attractive part of the Morse potential and the Curie-Weiss attraction strength, providing insights into how these microscopic characteristics change critical point coordinates.

cond-mat.stat-mech

Influence of microscopic parameters on phase behavior of a cell model with Curie-Weiss interaction

We investigate how varying two microscopic parameters - cell volume and the ratio between repulsion and attraction intensities - affect the phase behavior of a cell model with a Curie-Weiss-type interaction. The analysis is based on an exact solution previously derived for this model in the grand canonical ensemble. At sufficiently low temperatures, the cell model exhibits multiple first-order phase transitions. By varying the cell volume and the repulsion-to-attraction ratio, we represent a quantitative comparison of the chemical potential and pressure isotherms, along with the pressure-temperature and temperature-density phase diagrams. Our results demonstrate that altering these microscopic parameters induces quantitative changes in the phase diagrams of the cell model.

cond-mat.stat-mech

Microscopic description of the liquid-gas coexistence curve for Morse fluids in the immediate vicinity of the critical point

The present work is aimed at investigating the behavior of Morse fluids in the immediate vicinity of the critical point within the framework of a cell model. This region is of both fundamental and practical importance, yet presents analytical challenges due to the significant influence of order parameter fluctuations. An analytical procedure is developed to construct the upper part of the liquid-gas coexistence curve and calculate its diameter, incorporating the non-Gaussian (quartic) distribution of fluctuations. An explicit expression is derived for the temperature-dependent analytical term appearing in the expression for the rectilinear diameter. The numerical evaluation of the relevant quantities is carried out using Morse potential parameters representative of sodium. The coexistence curve is constructed both with and without the inclusion of the analytical temperature-dependent term in the calculation. A specific condition is identified under which the agreement between the presented binodal branches and Monte Carlo simulation data from other study, extrapolated to the immediate vicinity of the critical point, is improved. It is shown that better agreement is achieved when the analytical term is included in the calculation of the liquid branch and omitted in the gas branch. The proposed analytical approach may provide useful insight for the theoretical study of critical phenomena in more complex fluid systems.

cond-mat.stat-mech

Thermodynamic response functions in a cell fluid model

Thermodynamic response functions, namely the isothermal compressibility, the thermal pressure coefficient, and the thermal expansion coefficient, are calculated for a many-particle system interacting through a modified Morse potential. These calculations are based on an equation of state previously derived for a cell fluid model in the grand canonical ensemble. The calculated quantities are presented graphically as functions of density and the effective chemical potential.

cond-mat.stat-mech

Analytical calculation of the critical temperature and estimation of the critical region size for a fluid model

An analytical procedure for calculating the critical temperature and estimating the size of critical region for a cell fluid model is developed. Our numerical calculations are illustrated by the case of the Morse potential parameters characterizing the alkali metals (sodium and potassium). The critical temperatures found for liquid sodium and potassium as solutions of the resulting quadratic equation agree with experimental data. The expression for the relative temperature determining the critical region size is obtained proceeding from the condition for the critical regime existence. In the cases of sodium and potassium, the value of this temperature is of the order of a few hundredths.

cond-mat.stat-mech

Morse fluids in the immediate vicinity of the critical point: Calculation of thermodynamic coefficients

The previously proposed approach for the microscopic description of the critical behavior of Morse liquids based on the cell fluid model is applied to the case where the parameters of the Morse interaction potential correspond to alkali metals (sodium and potassium). The critical temperatures, densities, and pressures obtained for sodium and potassium agree with the experimental results. The thermodynamic coefficients (isothermal compressibility, density fluctuations, and thermal expansion) of sodium are investigated in the supercritical temperature region. Numerical calculations of thermodynamic coefficients are performed close to the critical point, where carrying out theoretical and experimental research is challenging. The change in compressibility with increasing density at various temperature values is traced. The behavior of density fluctuations approaching the critical point is shown for different temperatures. The variation in the magnitude of the thermal expansion with increasing temperature for different pressure values is illustrated.

cond-mat.stat-mech

First-order phase transition in the framework of the cell fluid model: Regions of chemical potential variation and the corresponding densities

A microscopic description is given for the behavior of the fluid system in an immediate vicinity of its critical point, where theoretical and experimental researches are difficult to carry out. For the temperatures $T<T_c$, the regions of chemical potential and density variations are singled out and analyzed. The equation of state of the cell fluid model in terms of temperature-chemical potential is written using the Heaviside functions. This equation is also given in terms of the temperature and density variables. As a result of the study of the relationship between the density and the chemical potential, an equation for the binodal curve is obtained in a narrow neighborhood of the critical point.

cond-mat.stat-mech

Equation of state of a cell fluid model with allowance for Gaussian fluctuations of the order parameter

The paper is devoted to the development of a microscopic description of the critical behavior of a cell fluid model with allowance for the contributions from collective variables with nonzero values of the wave vector. The mathematical description is performed in the supercritical temperature range ($T>T_c$) in the case of a modified Morse potential with additional repulsive interaction. The method, developed here for constructing the equation of state of the system by using the Gaussian distribution of the order parameter fluctuations, is valid beyond the immediate vicinity of the critical point for a wide range of density and temperature. The pressure of the system as a function of chemical potential and density is plotted for various fixed values of the relative temperature, both with and without considering the above-mentioned contributions. Compared with the results of the zero-mode approximation, the insignificant role of these contributions is indicated for temperatures $T>T_c$. At $T<T_c$, they are more significant.

cond-mat.stat-mech

The equation of state of a cell fluid model in the supercritical region

The analytic method for deriving the equation of state of a cell fluid model in the region above the critical temperature ($T \geqslant T_\text{c}$) is elaborated using the renormalization group transformation in the collective variables set. Mathematical description with allowance for non-Gaussian fluctuations of the order parameter is performed in the vicinity of the critical point on the basis of the $ρ^4$ model. The proposed method of calculation of the grand partition function allows one to obtain the equation for the critical temperature of the fluid model in addition to universal quantities such as critical exponents of the correlation length. The isothermal compressibility is plotted as a function of density. The line of extrema of the compressibility in the supercritical region is also represented.

cond-mat.stat-mech

Using a fluid cell model for description of a phase transition in simple liquid alkali metals

This article embraces a theoretical description of the first order phase transition in liquid metals with application of a cell fluid model. The results are obtained through calculation of the grand partition function without usage of phenomenological parameters. The Morse potential is used for calculation of the equation of state and the coexistence curve. Specific results for sodium and potassium are obtained. Comparison of outcome of analytical expressions with data of computer simulations is presented.

cond-mat.stat-mech