Related papers: Chain conformations in adsorbed layer during polym…
We performed molecular dynamics simulations with a coarse-grained model to investigate the capillary filling dynamics of polymer chains in nanopores. Short chains fill slower than predicted by the Lucas-Washburn equation but long chains…
We study the spatio-temporal dynamics of water uptake by capillary condensation from unsaturated vapor in mesoporous silicon layers (pore radius $r_\mathrm{p} \simeq 2$ nm), taking advantage of the local changes in optical reflectance as a…
Topology of polymer profoundly influences on its behavior. However, its effect on imbibition dynamics remains poorly understood. In the present work, capillary filling (during imbibition and following full imbibition) of star polymer melts…
When a capillary is inserted into a liquid, the liquid will rapidly flow into it. This phenomenon, well studied and understood on the macroscale, is investigated by Molecular Dynamics simulations for coarse-grained models of nanotubes. Both…
Capillary-driven flow of fluids occurs frequently in nature and has a wide range of technological applications in the fields of industry, agriculture, medicine, biotechnology, and microfluidics. By using the Onsager variational principle,…
We present a theoretical study of spontaneous imbibition of liquid 4He in silica aerogels focusing on the effect of porosity on the fluid dynamical behavior. We adopt a coarse-grained three-dimensional lattice-gas description like in…
We revisit the classical problem of liquid imbibition in a single pore with spatially varying wettability. Starting from the Lucas-Washburn equation, we derive analytical solutions for the imbibition time (crossing time) in systems where…
Adsorption on a boundary line confining a monolayer of particles self-assembling into clusters is studied by MC simulations. We focus on a system of particles interacting via competing interaction potential in which effectively short-range…
We investigate the structure and equilibrium linear-response dynamics of suspensions of hard colloidal dumbbells using Brownian Dynamics computer simulations. The focus lies on the dense fluid and plastic crystal states of the colloids with…
Polymer chains undergoing a continuous adsorption-desorption transition are studied through extensive computer simulations. A three-dimensional self-avoiding walk lattice model of a polymer chain grafted onto a surface has been treated for…
When a square tube is brought in contact with bulk liquid, the liquid wets the corners of the tube, and creates finger-like wetted region. The wetting of the liquid then takes place with the growth of two parts, the bulk part where the…
Conformations of a crowded neutral semiflexible polymer under confinement near an attractive wall are studied via coarse-grained simulations. We study the effects of the interplay of the length of the polymer, bending rigidity, and the…
Wetting of surfaces with porous coating is relevant for a wide variety of technical applications, such as printing technologies and heat transfer enhancement. Imbibition and evaporation of liquids on surfaces covered with porous layers are…
We investigate the dynamics of capillary filling using two lattice Boltzmann schemes: a liquid-gas model and a binary model. The simulation results are compared to the well-known Washburn's law, which predicts that the filled length of the…
Capillary imbibition underpins many processes of fundamental and applied relevance in fluid mechanics. A limitation to the flow is the coupling to the confining solid, which induces friction forces. Our work proposes a general theoretical…
A polymer chain tethered to a surface may be compact or extended, adsorbed or desorbed, depending on interactions with the surface and the surrounding solvent. This leads to a rich phase diagram with a variety of transitions. To investigate…
Conformations of partially or fully adsorbed semiflexible polymer chains are studied varying both contour length $L$, chain stiffness, $\kappa$, and the strength of the adsorption potential over a wide range. Molecular Dynamics simulations…
The growing importance of microfluidic and nanofluidic devices to the study of biological processes has highlighted the need to better understand how confinement affects the behavior of polymers in flow. In this paper we explore one aspect…
We study the imbibition of a wetting liquid between flexible sheets that are fixed on both ends. Assuming a narrow gap between the sheets, we solve the lubrication equation coupled with slender body deformation. When the sheets are…
An applied tension force changes the equilibrium conformations of a polymer chain tethered to a planar substrate and thus affects the adsorption transition as well as the coil-globule and crystallization transitions. Conversely, solvent…