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The adsorption and dissociation of isolated water molecule on Zr(0001) surface are theoretically investigated for the first time by using density-functional theory calculations. Two kinds of adsorption configurations with almost the same…

Materials Science · Physics 2015-05-27 Shuang-Xi Wang , Ping Zhang , Peng Zhang , Jian Zhao , Shu-Shen Li

In this study used is an approach based on measurements of the total energy distribution (TED) of field emitted electrons in order to examine the properties of Pd (133) from the aspect of both hydrogen adsorption and surface hydrides…

Other Condensed Matter · Physics 2009-11-13 A. Tomaszewska , Z. M. Stepien

The success of density functional theory for the description of the adsorption of atoms on surfaces is well established, and based on recent calculations using gradient corrections, it has been shown that it also describes well the…

mtrl-th · Physics 2008-02-03 Catherine Stampfl

The efficiency of soft particles to stabilize emulsions is examined by measuring their desorption free energy, i.e., the mechanical work required to detach the particle from a fluid interface. Here, we consider rubber-like elastic as well…

Soft Condensed Matter · Physics 2020-08-20 Hadi Mehrabian , Jacco H. Snoeijer , Jens Harting

A systematic fieldtheoretic description of critical adsorption on curved objects such as spherical or rodlike colloidal particles immersed in a fluid near criticality is presented. The temperature dependence of the corresponding order…

Statistical Mechanics · Physics 2009-10-31 A. Hanke , S. Dietrich

We construct the complete structural phase diagram of polymer adsorption at substrates with attractive stripe-like patterns in the parameter space spanned by the adsorption affinity of the stripes and temperature. Results were obtained by…

Statistical Mechanics · Physics 2014-04-14 Monika Möddel , Wolfhard Janke , Michael Bachmann

The mechanism of fluid slip on a solid surface has been linked to surface diffusion, by which mobile adsorbed fluid molecules perform hops between adsorption sites. However, slip velocity arising from this surface hopping mechanism has been…

Soft Condensed Matter · Physics 2018-11-02 Jian-Jun Shu , Ji Bin Melvin Teo , Weng Kong Chan

Random arrangements of points in the plane, interacting only through a simple hard core exclusion, are considered. An intensity parameter controls the average density of arrangements, in analogy with the Poisson point process. It is proved…

Mathematical Physics · Physics 2014-08-18 David Aristoff

We study universal critical adsorption on a solid sphere and a solid cylinder in a fluid at bulk criticality, where preferential adsorption occurs. We use a local functional theory proposed by Fisher, de Gennes, and Au-Yang ($[$C. R. Acad.…

Soft Condensed Matter · Physics 2017-09-27 Shunsuke Yabunaka , Akira Onuki

We study the adsorption behavior of Ga on (0001) GaN surfaces combining experimental specular reflection high-energy electron diffraction with theoretical investigations in the framework of a kinetic model for adsorption and ab initio…

Materials Science · Physics 2009-11-10 C. Adelmann , J. Brault , G. Mula , B. Daudin , L. Lymperakis , J. Neugebauer

The possibility of asymmetric absorption and reflection for flexural waves is demonstrated though analytical and numerical examples. We focus on the 1D case of flexural motion of a beam and consider combinations of point scatterers which…

Classical Physics · Physics 2019-09-04 Andrew N. Norris , Pawel Packo

Atomic oxygen adsorption on the Mo(112) surface has been investigated by means of first-principles total energy calculations. Among the variety of possible adsorption sites it was found that the bridge sites between two Mo atoms of the…

Materials Science · Physics 2007-05-23 Adam Kiejna , R. M. Nieminen

A rather simple random walk model on a one-dimensional lattice is put forward. The lattice as a whole switches randomly between two possible states which are spatially symmetric. Both lattice states are identical, but translated by one site…

Statistical Mechanics · Physics 2016-08-16 Jesús Casado-Pascual

Density-functional calculations on the polar TiX(111) (X = C, N) surfaces show (i) for clean surfaces, strong Ti3d-derived surface resonances (SR's) at the Fermi level and X2p-derived SR's deep in the upper valence band and (ii) for adatoms…

Materials Science · Physics 2009-11-11 Carlo Ruberto , Aleksandra Vojvodic , Bengt I. Lundqvist

Random sequential adsorption with diffusional relaxation, of two by two square objects on the two-dimensional square lattice is studied by Monte Carlo computer simulation. Asymptotically for large lattice sizes, diffusional relaxation…

Condensed Matter · Physics 2010-10-12 Jian-Sheng Wang , Peter Nielaba , Vladimir Privman

In the context of electromagnetic absorption, it is obvious that for an infinite planar periodic structure illuminated by a plane wave, the maximum attainable absorptance, i.e., perfect absorption, is theoretically limited to 100% of the…

Applied Physics · Physics 2024-02-20 Yongming Li , Xikui Ma , Xuchen Wang , Sergei A. Tretyakov

In this work, we study the perception problem for sampled surfaces (possibly with boundary) using tools from computational topology, specifically, how to identify their underlying topology starting from point-cloud samples in space, such as…

Computational Geometry · Computer Science 2024-10-17 Franco Coltraro , Jaume Amorós , Maria Alberich-Carramiñana , Carme Torras

Non-equilibrium cluster-cluster aggregation of particles diffusing in or at the cell membrane has been hypothesized to lead to domains of finite size in different biological contexts such as lipid rafts, cell adhesion complexes, or…

Soft Condensed Matter · Physics 2023-08-30 Renaud Baillou , Jonas Ranft

We introduce a new and general continuum thermodynamic framework for the mathematical analysis and computation of adsorption on dynamic interfaces. To the best of our knowledge, there is no formulation available that accounts for the…

Fluid Dynamics · Physics 2013-07-31 Markus Schmuck , Serafim Kalliadasis

An infinite hierarchy of layering transitions exists for model polymers in solution under poor solvent or low temperatures and near an attractive surface. A flat histogram stochastic growth algorithm known as FlatPERM has been used on a…

Statistical Mechanics · Physics 2009-11-10 J. Krawczyk , A. L. Owczarek , T. Prellberg , A. Rechnitzer