Histogram analysis as a method for determining the line tension by Monte-Carlo simulations

A method is proposed for determining the line tension, which is the main physical characteristic of a three-phase contact region, by Monte-Carlo (MC) simulations. The key idea of the proposed method is that if a three-phase equilibrium involves a three-phase contact region, the probability distribution of states of a system as a function of two order parameters depends not only on the surface tension, but also on the line tension. This probability distribution can be obtained as a normalized histogram by appropriate MC simulations, so one can use the combination of histogram analysis and finite-size scaling to study the properties of a three phase contact region. Every histogram and results extracted therefrom will depend on the size of the simulated system. Carrying out MC simulations for a series of system sizes and extrapolating the results, obtained from the corresponding series of histograms, to infinite size, one can determine the line tension of the three phase contact region and the interfacial tensions of all three interfaces (and hence the contact angles) in an infinite system. To illustrate the proposed method, it is applied to the three-dimensional ternary fluid mixture, in which molecular pairs of like species do not interact whereas those of unlike species interact as hard spheres. The simulated results are in agreement with expectations

An Equation of State of Gases at High Temperatures and Densities

State equation of molecular gas at high temperatures and densitie

Formation of capillary bridges in AFM-like geometry

We discuss the phase diagram of fluid confined in AFM-like geometry. It combines the properties of capillary condensation and complete filling of a wedge.Comment: 9 pages, 7 figure

Stability of freely falling granular streams

A freely falling stream of weakly cohesive granular particles is modeled and analysed with help of event driven simulations and continuum hydrodynamics. The former show a breakup of the stream into droplets, whose size is measured as a function of cohesive energy. Extensional flow is an exact solution of the one-dimensional Navier-Stokes equation, corresponding to a strain rate, decaying like 1/t from its initial value, gammaDot0. Expanding around this basic state, we show that the flow is stable for short times (gammaDot0 * t << 1), whereas for long times (gammaDot0 * t >> 1) perturbations of all wavelength grow. The growthrate of a given wavelength depends on the instant of time when the fluctuation occurs, so that the observable patterns can vary considerably.Comment: 4 page, 5 figures. Submitted to PRL. Supplementary material: see http://wwwuser.gwdg.de/~sulrich/research/#Publication

The influence of line tension on the formation of liquid bridges

The formation of liquid bridges between a planar and conical substrates is analyzed macroscopically taking into account the line tension. Depending on the value of the line tension coefficient \tau and geometric parameters of the system one observes two different scenarios of liquid bridge formation upon changing the fluid state along the bulk liquid-vapor coexistence. For \tau > \tau * (\tau * < 0) there is a first-order transition to a state with infinitely thick liquid bridge. For \tau < \tau * the scenario consists of two steps: first there is a first-order transition to a state with liquid bridge of finite thickness which upon further increase of temperature is followed by continuous growth of the thickness of the bridge to infinity. In addition to constructing the relevant phase diagram we examine the dependence of the width of the bridge on thermodynamic and geometric parameters of the system.Comment: 4 pages, 5 figure

Reply to Comment on: "Are stress-free membranes really 'tensionless'?"

This is a reply to a comment on the paper arXiv:1204.2075 "Are stress-free membranes really tensionless ?" (EPL 95,28008 (2011))

Surface tension of electrolytes: Hydrophilic and hydrophobic ions near an interface

We calculate the ion distributions around an interface in fluid mixtures of highly polar and less polar fluids (water and oil) for two and three ion species. We take into account the solvation and image interactions between ions and solvent. We show that hydrophilic and hydrophobic ions tend to undergo a microphase separation at an interface, giving rise to an enlarged electric double layer. We also derive a general expression for the surface tension of electrolyte systems, which contains a negative electrostatic contribution proportional to the square root of the bulk salt density. The amplitude of this square-root term is small for hydrophilic ion pairs, but is much increased for hydrophilic and hydrophobic ion pairs. For three ion species including hydrophilic and hydrophobic ions, we calculate the ion distributions to explain those obtained by x-ray reflectivity measurements.Comment: 8 figure

Sedimentation of a two-dimensional colloidal mixture exhibiting liquid-liquid and gas-liquid phase separation: a dynamical density functional theory study

We present dynamical density functional theory results for the time evolution of the density distribution of a sedimenting model two-dimensional binary mixture of colloids. The interplay between the bulk phase behaviour of the mixture, its interfacial properties at the confining walls, and the gravitational field gives rise to a rich variety of equilibrium and non-equilibrium morphologies. In the fluid state, the system exhibits both liquid-liquid and gas-liquid phase separation. As the system sediments, the phase separation significantly affects the dynamics and we explore situations where the final state is a coexistence of up to three different phases. Solving the dynamical equations in two-dimensions, we find that in certain situations the final density profiles of the two species have a symmetry that is different from that of the external potentials, which is perhaps surprising, given the statistical mechanics origin of the theory. The paper concludes with a discussion on this

Phase separation dynamics in a two-dimensional magnetic mixture

Based on classical density functional theory (DFT), we investigate the demixing phase transition of a two-dimensional, binary Heisenberg fluid mixture. The particles in the mixture are modeled as Gaussian soft spheres, where one component is characterized by an additional classical spin-spin interaction of Heisenberg type. Within the DFT we treat the particle interactions using a mean-field approximation. For certain magnetic coupling strengths we calculate phase diagrams in the density-concentration plane. For sufficiently large coupling strengths and densities, we find a demixing phase transition driven by the ferromagnetic interactions of the magnetic species. We also provide a microscopic description (i.e., density profiles) of the resulting non-magnetic/magnetic fluid-fluid interface. Finally, we investigate the phase separation using dynamical density functional theory (DDFT), considering both nucleation processes and spinodal demixing.Comment: 15 pages, 10 figure

Are stress-free membranes really 'tensionless'?

In recent years it has been argued that the tension parameter driving the fluctuations of fluid membranes, differs from the imposed lateral stress, the 'frame tension'. In particular, stress-free membranes were predicted to have a residual fluctuation tension. In the present paper, this argument is reconsidered and shown to be inherently inconsistent -- in the sense that a linearized theory, the Monge model, is used to predict a nonlinear effect. Furthermore, numerical simulations of one-dimensional stiff membranes are presented which clearly demonstrate, first, that the internal 'intrinsic' stress in membranes indeed differs from the frame tension as conjectured, but second, that the fluctuations are nevertheless driven by the frame tension. With this assumption, the predictions of the Monge model agree excellently with the simulation data for stiffness and tension values spanning several orders of magnitude