Related papers: Selective nucleation in porous media
We study the conditions under which and how an imposed cluster of fixed colloidal particles at prescribed positions triggers crystal nucleation from a metastable colloidal fluid. Dynamical density functional theory of freezing and Brownian…
The paper presents two-scale numerical algorithms for stress-strain analysis of porous media featured by self-contact at pore level. The porosity is constituted as a periodic lattice generated by a representative cell consisting of elastic…
A coarse-grained simulation method to predict NMR spectra of ions diffusing in porous carbons is proposed. The coarse-grained model uses input from molecular dynamics simulations such as the free-energy profile for ionic adsorption, and…
A new simple method for description of the nucleation process on the wide class of heterogeneous centers is given. The nucleation occurs on the heterogeneous centers with different heights of activation barriers. The distribution of the…
We investigate the atomistic mechanism of homogeneous nucleation during solidification in molybdenum employing transition path sampling. The mechanism is characterized by the formation of a pre-structured region of high bond-orientational…
Stimuli-responsive materials that modify their shape in response to changes in environmental conditions -- such as solute concentration, temperature, pH, and stress -- are widespread in nature and technology. Applications include micro- and…
We consider the homogenization of a model of reactive flows through periodic porous media involving a single solute which can be absorbed and desorbed on the pore boundaries. This is a system of two convection-diffusion equations, one in…
A fundamental variable characterizing immiscible two-phase flow in porous media is the wetting saturation, which is the ratio between the pore volume filled with wetting fluid and the total pore volume. More generally, this variable comes…
We report experiments on the dynamics of vibrated particles constrained in a two-dimensional vertical container, motivated by the following question: how to get the most out of a given external vibration to maximize internal disorder (e.g.…
Recent advances in classical density functional theory are combined with stochastic process theory and rare event techniques to formulate a theoretical description of nucleation, including crystallization, that can predict nonclassical…
We propose very general vortex nucleation mechanisms analogous to a hydrodynamic instability and calculate associated critical velocity in agreement with experiments. The creation of vortices via extrinsic mechanism is driven by a formation…
We present pore-scale simulations of two-phase flows in a reconstructed fibrous porous layer. The three dimensional microstructure of the material, a fuel cell gas diffusion layer, is acquired via X-ray computed tomography and used as input…
For the vast majority of naturally occurring, small, single domain proteins folding is often described as a two-state process that lacks detectable intermediates. This observation has often been rationalized on the basis of a nucleation…
Reactions of nuclear multifragmentation of excited finite nuclei can be interpreted as manifestation of the nuclear liquid-gas phase transition. During this process the matter at subnuclear density clusterizes into hot primary fragments,…
Direct numerical simulations are presented for a porous media model consisting of two immiscible fluids, an invading and defending phase, in a two-dimensional micro-geometry filled with randomly sized and randomly distributed cylinders.…
Slow flow of a single fluid through a porous medium is well understood on a macroscopic level through Darcy's law, a linear relation between flow rate and a combination of pressure differences, viscosity, and gravitational forces. Two-phase…
In the mathematical modelling of compactional flow in porous media, the constitutive relation is typically modelled in terms of a nonlinear relationship between effective pressure and porosity, and compaction is essentially poroelastic.…
A deep understanding of two-phase displacement in porous media with permeability contrast is essential for the design and optimisation of enhanced oil recovery processes. In this paper, we investigate the forced imbibition behaviour in two…
The formation and entrapment of gas bubbles during solidification significantly influence the microstructure and mechanical properties of materials, from metallic alloys to ice. While gas segregation at the solidification front is…
Vapor adsorption experiments are widely used to assess pore size distributions, but the large hysteresis sometimes observed between sorption and desorption isotherms remains difficult to interpret. Such hysteresis is influenced pore network…