Related papers: Thermodynamic, Dynamic and Structural Anomalies fo…
Pair potentials that are bounded at the origin provide an accurate description of the effective interaction for many systems of dissolved soft macromolecules (e.g., flexible dendrimers). Using numerical free-energy calculations, we…
We study an anti-symmetric (square) well and barrier potential of depth/height $(V_0)$ placed between two rigid walls. Unlike the usual double-well, here the closely lying sub-barrier doublets need not be the lowest ones in the spectrum.…
{We study in some details the statistical properties of the turbulent 2-phase interstellar atomic gas.{We present high resolution bidimensional numerical simulations of the interstellar atomic hydrogen which describe it over 3 to 4 orders…
We theoretically study thermally activated elementary dynamical processes that precede full structural relaxation in ultra-dense particle liquids interacting via strong short range attractive forces. Our approach is based on a microscopic…
Diffusion of particles through an heterogenous obstacle line is modeled as a two-dimensional diffusion problem with a one--directional nonlinear convective drift and is examined using two-scale asymptotic analysis. At the scale where the…
Direct numerical simulations were performed to characterize fully developed supersonic turbulent channel flows over isothermal rough walls. The effect of roughness was incorporated using a level-set/volume-of-fluid immersed boundary method.…
We use numerical hydrodynamic simulations to investigate prestellar core formation in the dynamic environment of giant molecular clouds, focusing on planar post-shock layers produced by colliding turbulent flows. A key goal is to test how…
Astrophysical fluids under the influence of magnetic fields are often subjected to single-fluid or two-fluid approximations. In the case of weakly ionized plasmas however, this can be inappropriate due to distinct responses from the…
Dipolar fluids are known to exhibit complex self-assembly at low temperatures, yet a compact thermodynamic description of their aggregate statistics has remained elusive. Using molecular dynamics simulations of Stockmayer particles with a…
The fluctuation-induced interaction between two rod-like, rigid inclusions in a fluid vesicle is studied by means of canonical ensemble Monte Carlo simulations. The vesicle membrane is represented by a triangulated network of hard spheres.…
We perform numerical simulations of purely repulsive soft colloidal particles interacting via a generalized elastic potential and constrained to a two-dimensional plane and to the surface of a spherical shell. For the planar case, we…
The folding vs. adsorption behaviour of a coarse-grained off-lattice protein model near an attractive surface is presented within the frame of a Multicanonical Monte Carlo simulations. In the polymer-surface model, the Lennard-Jones…
Supercooled liquids display fascinating properties upon cooling such as the emergence of dynamic length scales. Different models strongly vary with respect to the choice of the elementary subsystems (CRR) as well as their mutual coupling.…
We propose an exactly solvable model to reveal the physics of the interplay between interaction and disorder in bosonic systems. Considering interacting bosons in a double-well potential, in which disorder is mimicked by taking the energy…
A method for taking into account the long-range potential of atoms in the framework of the hard-sphere model is proposed. It is shown that thermodynamic quantities can be represented as a sum of three contribution: that of an ideal gas, the…
We study the effect of confinement in the dynamical behavior of a core-softened fluid. The fluid is modeled as a two length scales potential. This potential in the bulk reproduces the anomalous behavior observed in the density and in the…
We formulate a microscopic, no adjustable parameter, theory of activated relaxation in supercooled liquids directly in terms of the repulsive and attractive forces within the framework of pair correlations. Under isochoric conditions,…
Exactly solvable models are interesting for science and education, since they help in scientific search and in understanding of phenomena. Some exact solutions for simple quantum-mechanical models are considered. The models include two…
Filtered budgets for anelastic turbulence and a general expression of the turbulent sensible heat flux are derived for a multicomponent fluid with an arbitrary equation of state. A family of subgrid-scale closures is then found under the…
Mesoscopic molecular dynamics simulations are used to determine the large scale structure of several binary polymer mixtures of various chemical architecture, concentration, and thermodynamic conditions. By implementing an analytical…