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W Fenz

Publications and source records attributed to W Fenz.

8 recordsLinked to original sources

Integral equation study of an ideal Ising mixture.

We construct an integral equation scheme for magnetic binary mixtures of an ideal soft-core Ising fluid and a soft-sphere fluid by mapping the system onto an equivalent nonmagnetic ternary mixture. We apply the multicomponent Ornstein-Zernike equation together with a closure relation based on the soft mean spherical approximation and a field constraint for the Ising fluid component. Phase coexistence curves are calculated both by directly evaluating the chemical potentials via the bridge function, and by using a Maxwell-like construction which is derived in the text. Our results are compared to Monte Carlo data obtained earlier, and we find that the second method yields a much better agreement with the simulations.

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XY-spin fluids in an external magnetic field: an integral equation approach.

We develop an integral equation approach to study anisotropic fluids with planar spins in the presence of an external field. As a result, the integral equation calculations for these systems appear to be no more difficult than those for ordinary isotropic liquids. The method presented is applied to the investigation of phase coexistence properties of ferromagnetic XY-spin fluids in a magnetic field. The soft mean spherical approximation is used for the closure relation connecting the orientationally dependent two-particle direct and total correlation functions. The Lovett-Mou-Buff-Wertheim and Born-Green-Yvon equations are employed to describe the one-particle orientational distribution. The phase diagrams are obtained in the whole range of varying the external field for a wide class of XY-spin fluid models with various ratios of the strengths of magnetic to nonmagnetic Yukawa-like interactions. The influence of changing the screening radii of the interaction potentials is also considered. Different types of the phase diagram topology are identified. They are characterized by the existence of critical, tricritical, critical end, and triple points related to transitions between gas, liquid, and para- and ferromagnetic states, accompanied by different external field dependencies of critical temperatures and densities corresponding to the gas-liquid and liquid-liquid transitions. As is demonstrated, the integral equation approach leads to accurate predictions of the complicated phase diagram behavior which coincide well with those evaluated by the cumbersome Gibbs ensemble simulation and multiple-histogram reweighting techniques.

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Phase behavior of Ising mixtures.

We present phase diagrams that were calculated both in mean-field theory and via Monte Carlo (MC) simulations for binary mixtures of a ferromagnetic Ising fluid and a nonmagnetic fluid (Ising mixtures) in the absence of an external field. We look at both the simple ideal Ising mixture, consisting of an ideal Ising fluid and a hard-sphere fluid, as well as at the general case with one component being a nonideal Ising fluid and the other a van der Waals fluid. It is shown that the mean-field phase diagram of the ideal Ising mixture in the limit of infinite pressure is identical to that of the Blume-Capel model for 3He-4He mixtures. The MC phase diagrams were obtained using the Gibbs ensemble, the cumulant intersection technique, and the multi-histogram re-weighting method, adapted to the semi-grand ensemble. The results are qualitatively compared with mean-field theory, and both types of tri-critical lines occurring there are verified in the computer simulations.

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XY spin fluid in an external magnetic field.

A method of integral equations is developed to study anisotropic fluids with planar spins in an external field. As a result, the calculations for these systems appear to be no more difficult than those for ordinary homogeneous liquids. The approach proposed is applied to the ferromagnetic XY spin fluid in a magnetic field using a soft mean spherical closure and the Born-Green-Yvon equation. This provides an accurate reproduction of the complicated phase diagram behavior obtained by cumbersome Gibbs ensemble simulation and multiple histogram reweighting techniques.

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Ising fluids in an external magnetic field: an integral equation approach.

The phase behavior of Ising spin fluids is studied in the presence of an external magnetic field with the integral equation method. The calculations are performed on the basis of a soft mean spherical approximation using an efficient algorithm for solving the coupled set of the Ornstein-Zernike equations, the closure relations, and the external field constraint. The phase diagrams are obtained in the whole thermodynamic space including the magnetic field H for a wide class of Ising fluid models with various ratios R of the strengths of magnetic to nonmagnetic Yukawa-like interactions. The influence of varying the inverse screening lengths z(1) and z(2), corresponding to the magnetic and nonmagnetic Yukawa parts of the potential, is investigated too. It is shown that changes in R as well as in z(1) and z(2) can lead to different topologies of the phase diagrams. In particular, depending on the value of R, the critical temperature of the liquid-gas transition either decreases monotonically, behaves nonmonotonically, or increases monotonically with increasing H. The para-ferro magnetic transition is also affected by changes in R and the screening lengths. At H=0, the Ising fluid maps onto a simple model of a symmetric nonmagnetic binary mixture. For H--> infinity, it reduces to a pure nonmagnetic fluid. The results are compared with available simulations and the predictions of other theoretical methods. It is demonstrated that the mean spherical approximation appears to be more accurate compared with mean field theory, especially for systems with short ranged attraction potentials (when z(1) and z(2) are large). In the Kac limit z(1), z(2) -->+0, both approaches tend to nearly the same results.

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Phase diagrams of classical spin fluids: the influence of an external magnetic field on the liquid-gas transition.

The influence of an external magnetic field on the liquid-gas phase transition in Ising, XY, and Heisenberg spin fluid models is studied using a modified mean field theory and Gibbs ensemble Monte Carlo simulations. It is demonstrated that the theory is able to reproduce quantitatively all characteristic features of the field dependence of the critical temperature T(c)(H) for all the three models. These features include a monotonic decrease of T(c) with rising H in the case of the Ising fluid as well as a more complicated nonmonotonic behavior for the XY and Heisenberg models. The nonmonotonicity consists in a decrease of T(c) with increasing H at weak external fields, an increase of T(c) with rising H in the strong field regime, and the existence of a minimum in T(c)(H) at intermediate values of H. Analytical expressions for T(c)(H) in the large field limit are presented as well. The paramagnetic-ferromagnetic phase transition is also considered in simulations and described within the mean field theory.

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Binary mixtures of magnetic fluids.

We study a binary mixture of a van der Waals fluid and a ferromagnetic fluid at zero magnetic field on the basis of the mean field Ising fluid model and the van der Waals theory with quadratic mixing rules. Depending on three reduced parameters, the phase diagram shows a surface of magnetic phase transitions and lines of tricritical points, critical end points, and magnetic consolute points. First-order phase transition surfaces and critical lines are calculated numerically. For the line of tricritical points, which can occur in two different topologies, an analytic expression is derived. All higher-order lines and coexistence surfaces are visualized in three-dimensional x, T, p and xi, T, p diagrams, where xi is a mapping of delta, the conjugated field of the mole fraction x, on the unit interval.

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