Infinite compressibility states in the Hierarchical Reference Theory of fluids. II. Numerical evidence

Continuing our investigation into the Hierarchical Reference Theory of fluids for thermodynamic states of infinite isothermal compressibility kappa[T] we now turn to the available numerical evidence to elucidate the character of the partial differential equation: Of the three scenarios identified previously, only the assumption of the equations turning stiff when building up the divergence of kappa[T] allows for a satisfactory interpretation of the data. In addition to the asymptotic regime where the arguments of part I (cond-mat/0308467) directly apply, a similar mechanism is identified that gives rise to transient stiffness at intermediate cutoff for low enough temperature. Heuristic arguments point to a connection between the form of the Fourier transform of the perturbational part of the interaction potential and the cutoff where finite difference approximations of the differential equation cease to be applicable, and they highlight the rather special standing of the hard-core Yukawa potential as regards the severity of the computational difficulties.Comment: J. Stat. Phys., in press. Minor changes to match published versio

Implementation of the Hierarchical Reference Theory for simple one-component fluids

Combining renormalization group theoretical ideas with the integral equation approach to fluid structure and thermodynamics, the Hierarchical Reference Theory is known to be successful even in the vicinity of the critical point and for sub-critical temperatures. We here present a software package independent of earlier programs for the application of this theory to simple fluids composed of particles interacting via spherically symmetrical pair potentials, restricting ourselves to hard sphere reference systems. Using the hard-core Yukawa potential with z=1.8/sigma for illustration, we discuss our implementation and the results it yields, paying special attention to the core condition and emphasizing the decoupling assumption's role.Comment: RevTeX, 16 pages, 2 figures. Minor changes, published versio

Thermodynamics of Solitonic Matter Waves in a Toroidal Trap

We investigate the thermodynamic properties of a Bose-Einstein condensate with negative scattering length confined in a toroidal trapping potential. By numerically solving the coupled Gross-Pitaevskii and Bogoliubov-de Gennes equations, we study the phase transition from the uniform state to the symmetry-breaking state characterized by a bright-soliton condensate and a localized thermal cloud. In the localized regime three states with a finite condensate fraction are present: the thermodynamically stable localized state, a metastable localized state and also a metastable uniform state. Remarkably, the presence of the stable localized state strongly increases the critical temperature of Bose-Einstein condensation.Comment: 4 pages, 4 figures, to be published in Physical Review A as a Rapid Communication. Related papers can be found at http://www.padova.infm.it/salasnich/tdqg.htm

Phase diagram of symmetric binary mixtures at equimolar and non-equimolar concentrations: a systematic investigation

We consider symmetric binary mixtures consisting of spherical particles with equal diameters interacting via a hard-core plus attractive tail potential with strengths epsilon_{ij}, i,j=1,2, such that epsilon_{11} = epsilon_{22} > epsilon_{12}. The phase diagram of the system at all densities and concentrations is investigated as a function of the unlike-to-like interaction ratio delta = epsilon_{12}/epsilon_{11} by means of the hierarchical reference theory (HRT). The results are related to those of previous investigations performed at equimolar concentration, as well as to the topology of the mean-field critical lines. As delta is increased in the interval 0 < delta < 1, we find first a regime where the phase diagram at equal species concentration displays a tricritical point, then one where both a tricritical and a liquid-vapor critical point are present. We did not find any clear evidence of the critical endpoint topology predicted by mean-field theory as delta approaches 1, at least up to delta=0.8, which is the largest value of delta investigated here. Particular attention was paid to the description of the critical-plus-tricritical point regime in the whole density-concentration plane. In this situation, the phase diagram shows, in a certain temperature interval, a coexistence region that encloses an island of homogeneous, one-phase fluid.Comment: 27 pages + 20 figure

Recent developments of the Hierarchical Reference Theory of Fluids and its relation to the Renormalization Group

The Hierarchical Reference Theory (HRT) of fluids is a general framework for the description of phase transitions in microscopic models of classical and quantum statistical physics. The foundations of HRT are briefly reviewed in a self-consistent formulation which includes both the original sharp cut-off procedure and the smooth cut-off implementation, which has been recently investigated. The critical properties of HRT are summarized, together with the behavior of the theory at first order phase transitions. However, the emphasis of this presentation is on the close relationship between HRT and non perturbative renormalization group methods, as well as on recent generalizations of HRT to microscopic models of interest in soft matter and quantum many body physics.Comment: 17 pages, 5 figures. Review paper to appear in Molecular Physic

Dynamical arrest and replica symmetry breaking in attractive colloids

Within the Replica Symmetry Breaking (RSB) framework developed by M.Mezard and G.Parisi we investigate the occurrence of structural glass transitions in a model of fluid characterized by hard sphere repulsion together with short range attraction. This model is appropriate for the description of a class of colloidal suspensions. The transition line in the density-temperature plane displays a reentrant behavior, in agreement with Mode Coupling Theory (MCT), a dynamical approach based on the Mori-Zwanzig formalism. Quantitative differences are however found, together with the absence of the predicted glass-glass transition at high density. We also perform a systematic study of the pure hard sphere fluid in order to ascertain the accuracy of the adopted method and the convergence of the numerical procedure.Comment: 7 pages, 6 figure

Exact Renormalization Group : A New Method for Blocking the Action

We consider the exact renormalization group for a non-canonical scalar field theory in which the field is coupled to the external source in a special non linear way. The Wilsonian action and the average effective action are then simply related by a Legendre transformation up to a trivial quadratic form. An exact mapping between canonical and non-canonical theories is obtained as well as the relations between their flows. An application to the theory of liquids is sketched

Phase transitions in simple and not so simple binary fluids

Compared to pure fluids, binary mixtures display a very diverse phase behavior, which depends sensitively on the parameters of the microscopic potential. Here we investigate the phase diagrams of simple model mixtures by use of a microscopic implementation of the renormalization group technique. First, we consider a symmetric mixture with attractive interactions, possibly relevant for describing fluids of molecules with internal degrees of freedom. Despite the simplicity of the model, slightly tuning the strength of the interactions between unlike species drastically changes the topology of the phase boundary, forcing or inhibiting demixing, and brings about several interesting features such as double critical points, tricritical points, and coexistence domains enclosing `islands' of homogeneous, mixed fluid. Homogeneous phase separation in mixtures can be driven also by purely repulsive interactions. As an example, we consider a model of soft particles which has been adopted to describe binary polymer solutions. This is shown to display demixing (fluid-fluid) transition at sufficiently high density. The nature and the physical properties of the corresponding phase transition are investigated.Comment: 6 pages + 3 figures, presented at the 5th EPS Liquid Matter Conference, Konstanz, 14-18 September 200

Anisotropic two-dimensional Heisenberg model by Schwinger-boson Gutzwiller projected method

Two-dimensional Heisenberg model with anisotropic couplings in the $x$ and $y$ directions ($J_x \neq J_y$) is considered. The model is first solved in the Schwinger-boson mean-field approximation. Then the solution is Gutzwiller projected to satisfy the local constraint that there is only one boson at each site. The energy and spin-spin correlation of the obtained wavefunction are calculated for systems with up to $20 \times 20$ sites by means of the variational Monte Carlo simulation. It is shown that the antiferromagnetic long-range order remains down to the one-dimensional limit.Comment: 15 pages RevTex3.0, 4 figures, available upon request, GWRVB8-9