A mean spherical model for soft potentials: The hard core revealed as a perturbation

The mean spherical approximation for fluids is extended to treat the case of dense systems interacting via soft-potentials. The extension takes the form of a generalized statement concerning the behavior of the direct correlation function c(r) and radial distribution g(r). From a detailed analysis that views the hard core portion of a potential as a perturbation on the whole, a specific model is proposed which possesses analytic solutions for both Coulomb and Yukawa potentials, in addition to certain other remarkable properties. A variational principle for the model leads to a relatively simple method for obtaining numerical solutions

Complementarity and Scientific Rationality

Bohr's interpretation of quantum mechanics has been criticized as incoherent and opportunistic, and based on doubtful philosophical premises. If so Bohr's influence, in the pre-war period of 1927-1939, is the harder to explain, and the acceptance of his approach to quantum mechanics over de Broglie's had no reasonable foundation. But Bohr's interpretation changed little from the time of its first appearance, and stood independent of any philosophical presuppositions. The principle of complementarity is itself best read as a conjecture of unusually wide scope, on the nature and future course of explanations in the sciences (and not only the physical sciences). If it must be judged a failure today, it is not because of any internal inconsistency.Comment: 29 page

Density Functional for Anisotropic Fluids

We propose a density functional for anisotropic fluids of hard body particles. It interpolates between the well-established geometrically based Rosenfeld functional for hard spheres and the Onsager functional for elongated rods. We test the new approach by calculating the location of the the nematic-isotropic transition in systems of hard spherocylinders and hard ellipsoids. The results are compared with existing simulation data. Our functional predicts the location of the transition much more accurately than the Onsager functional, and almost as good as the theory by Parsons and Lee. We argue that it might be suited to study inhomogeneous systems.Comment: To appear in J. Physics: Condensed Matte

Phase behaviour of additive binary mixtures in the limit of infinite asymmetry

We provide an exact mapping between the density functional of a binary mixture and that of the effective one-component fluid in the limit of infinite asymmetry. The fluid of parallel hard cubes is thus mapped onto that of parallel adhesive hard cubes. Its phase behaviour reveals that demixing of a very asymmetric mixture can only occur between a solvent-rich fluid and a permeated large particle solid or between two large particle solids with different packing fractions. Comparing with hard spheres mixtures we conclude that the phase behaviour of very asymmetric hard-particle mixtures can be determined from that of the large component interacting via an adhesive-like potential.Comment: Full rewriting of the paper (also new title). 4 pages, LaTeX, uses revtex, multicol, epsfig, and amstex style files, to appear in Phys. Rev. E (Rapid Comm.

Structure Factor and Electronic Structure of Compressed Liquid Rubidium

We have applied the quantal hypernetted-chain equations in combination with the Rosenfeld bridge-functional to calculate the atomic and the electronic structure of compressed liquid-rubidium under high pressure (0.2, 2.5, 3.9, and 6.1 GPa); the calculated structure factors are in good agreement with experimental results measured by Tsuji et al. along the melting curve. We found that the Rb-pseudoatom remains under these high pressures almost unchanged with respect to the pseudoatom at room pressure; thus, the effective ion-ion interaction is practically the same for all pressure-values. We observe that all structure factors calculated for this pressure-variation coincide almost into a single curve if wavenumbers are scaled in units of the Wigner-Seitz radius $a$ although no corresponding scaling feature is observed in the effective ion-ion interaction.This scaling property of the structure factors signifies that the compression in liquid-rubidium is uniform with increasing pressure; in absolute Q-values this means that the first peak-position ($Q_1$) of the structure factor increases proportionally to $V^{-1/3}$ ($V$ being the specific volume per ion), as was experimentally observed by Tsuji et al.Comment: 18 pages, 11 figure

Quantum Fluctuations of a Coulomb potential

Long-range properties of the two-point correlation function of the electromagnetic field produced by an elementary particle are investigated. Using the Schwinger-Keldysh formalism it is shown that this function is finite in the coincidence limit outside the region of particle localization. In this limit, the leading term in the long-range expansion of the correlation function is calculated explicitly, and its gauge independence is proved. The leading contribution turns out to be of zero order in the Planck constant, and the relative value of the root mean square fluctuation of the Coulomb potential is found to be 1/\sqrt{2}, confirming the result obtained previously within the S-matrix approach. It is shown also that in the case of a macroscopic body, the \hbar^0 part of the correlation function is suppressed by a factor 1/N, where N is the number of particles in the body. Relation of the obtained results to the problem of measurability of the electromagnetic field is mentioned.Comment: 15 pages, 2 figure

Equation of state of fully ionized electron-ion plasmas

Thermodynamic quantities of Coulomb plasmas consisting of point-like ions immersed in a compressible, polarizable electron background are calculated for ion charges Z=1 to 26 and for a wide domain of plasma parameters ranging from the Debye-Hueckel limit to the crystallization point and from the region of nondegenerate to fully degenerate nonrelativistic or relativistic electrons. The calculations are based on the linear-response theory for the electron-ion interaction, including the local-field corrections in the electronic dielectric function. The thermodynamic quantities are calculated in the framework of the N-body hypernetted-chain equations and fitted by analytic expressions. We present also accurate analytic approximations for the free energy of the ideal electron gas at arbitrary degeneracy and relativity and for the excess free energy of the one-component plasma of ions (OCP) derived from Monte Carlo simulations. The extension to multi-ionic mixtures is discussed within the framework of the linear mixing rule. These formulae provide a completely analytic, accurate description of the thermodynamic quantities of fully ionized electron-ion Coulomb plasmas, a useful tool for various applications from liquid state theory to dense stellar matter.Comment: 13 pages, 2 tables, 7 figures, REVTeX using epsf.sty. To be published in Phys. Rev. E, vol. 58 (1998

Density functional theory for nearest-neighbor exclusion lattice gasses in two and three dimensions

To speak about fundamental measure theory obliges to mention dimensional crossover. This feature, inherent to the systems themselves, was incorporated in the theory almost from the beginning. Although at first it was thought to be a consistency check for the theory, it rapidly became its fundamental pillar, thus becoming the only density functional theory which possesses such a property. It is straightforward that dimensional crossover connects, for instance, the parallel hard cube system (three-dimensional) with that of squares (two-dimensional) and rods (one-dimensional). We show here that there are many more connections which can be established in this way. Through them we deduce from the functional for parallel hard (hyper)cubes in the simple (hyper)cubic lattice the corresponding functionals for the nearest-neighbor exclusion lattice gases in the square, triangular, simple cubic, face-centered cubic, and body-centered cubic lattices. As an application, the bulk phase diagram for all these systems is obtained.Comment: 13 pages, 13 figures; needs revtex

Geometrical aspects and connections of the energy-temperature fluctuation relation

Recently, we have derived a generalization of the known canonical fluctuation relation $k_{B}C=\beta^{2}$ between heat capacity $C$ and energy fluctuations, which can account for the existence of macrostates with negative heat capacities $C<0$. In this work, we presented a panoramic overview of direct implications and connections of this fluctuation theorem with other developments of statistical mechanics, such as the extension of canonical Monte Carlo methods, the geometric formulations of fluctuation theory and the relevance of a geometric extension of the Gibbs canonical ensemble that has been recently proposed in the literature.Comment: Version accepted for publication in J. Phys. A: Math and The

Coupling Classical and Quantum Variables using Continuous Quantum Measurement Theory

We propose a system of equations to describe the interaction of a quasiclassical variable $X$ with a set of quantum variables $x$ that goes beyond the usual mean field approximation. The idea is to regard the quantum system as continuously and imprecisely measured by the classical system. The effective equations of motion for the classical system therefore consist of treating the quantum variable $x$ as a stochastic c-number \x (t) the probability distibution for which is given by the theory of continuous quantum measurements. The resulting theory is similar to the usual mean field equations (in which $x$ is replaced by its quantum expectation value) but with two differences: a noise term, and more importantly, the state of the quantum subsystem evolves according to the stochastic non-linear Schrodinger equation of a continuously measured system. In the case in which the quantum system starts out in a superposition of well-separated localized states, the classical system goes into a statistical mixture of trajectories, one trajectory for each individual localized state.Comment: 11 pages, plain Tex (with revised settings for \vsize and \voffset to accommodate US paper sizes