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相关论文: Energy barriers for diffusion on stepped Rh(111) s…

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It is well known that elastic effects can cause surface instability. In this paper, we analyze a one-dimensional discrete system which can reveal pattern formation mechanism resembling the "step-bunching" phenomena for epitaxial growth on…

经典分析与常微分方程 · 数学 2021-04-21 Tao Luo , Yang Xiang , Nung Kwan Yip

We investigate numerically the blocking of two-dimensional bistable reaction diffusion fronts by geometric obstacles. Our goal is to derive quantitative criteria for front propagation in the presence of spatial heterogeneities. Using a…

数学物理 · 物理学 2026-04-21 J. -G. Caputo , G. Cruz-Pacheco , J. Gatlik , B. Sarels

Diffusion of small two dimensional Cu islands (containing up to 10 atoms) on Cu(111) has been studied using the newly developed self-learning Kinetic Monte Carlo SLKMC method. It is based on a database of diffusion processes and their…

Dynamic properties of molecular motors that fuel their motion by actively interacting with underlying molecular tracks are studied theoretically via discrete-state stochastic ``burnt-bridge'' models. The transport of the particles is viewed…

软凝聚态物质 · 物理学 2009-11-13 Maxim N. Artyomov , Alexander Yu. Morozov , Ekaterina Pronina , Anatoly B. Kolomeisky

We studied the step dynamics during crystal sublimation and growth in the limit of fast surface diffusion and slow kinetics of atom attachment-detachment at the steps. For this limit we formulate a model free of the quasi-static…

化学物理 · 物理学 2009-11-13 Bogdan Ranguelov , Stoyan Stoyanov

With a Si(001) vicinal surface in mind, we study step wandering instability on a vicinal surface with an anisotropic surface diffusion whose orientation dependence alternates on each consecutive terrace. In a conserved system step wandering…

材料科学 · 物理学 2013-05-29 M. Sato , M. Uwaha , Y. Saito , Y. Hirose

We develop a simple but rigorous model of protein-protein association kinetics based on diffusional association on free energy landscapes obtained by sampling configurations within and surrounding the native complex binding funnels. Guided…

生物大分子 · 定量生物学 2007-05-23 Maximilian Schlosshauer , David Baker

Motivated by studies of the Greenberg-Hastings cellular automata (GHCA) as a caricature of excitable systems, in this paper we study kink-antikink dynamics in the perhaps simplest PDE model of excitable media given by the scalar reaction…

偏微分方程分析 · 数学 2020-12-02 Antoine Pauthier , Jens D. M. Rademacher , Dennis Ulbrich

We report on density functional total energy calculations of the step formation and interaction energies for vicinal TaC(001) surfaces. Our calculations show that double and triple-height steps are favored over single-height steps for a…

凝聚态物理 · 物理学 2009-11-07 V. B. Shenoy , C. V. Ciobanu

An atomistic study of the order-effect occurring in Li$_{x}$CoO$_{2}$ at $x=0.5$ is presented and an explanation for the computationally and experimentally observed dip in the Li diffusivity is proposed. Configurations where a single…

材料科学 · 物理学 2016-05-04 Teutë Bunjaku , Andreas Pedersen , Mathieu Luisier

When a Brownian particle, initially being in the potential well, overcomes the barrier and moves to the absorptive border, it still has a chance to be scattered back to the well by thermal fluctuations. We study this phenomenon carefully…

核理论 · 物理学 2018-03-21 Maria Chushnyakova , Igor Gontchar

The diffusion of two dimensional adatom islands (up to 100 atoms) on Cu(111) has been studied, using the self-learning Kinetic Monte Carlo (SLKMC) method [1]. A variety of multiple- and single-atom processes are revealed in the simulations,…

材料科学 · 物理学 2015-05-30 Altaf Karim , Abdelkader Kara , Oleg Trushin , Talat S. Rahman

In the framework of SOS models, the dynamics of isolated and pairs of surface steps of monoatomic height is studied, for step--edge diffusion and for evaporation kinetics, using Monte Carlo techniques. In particular, various interesting…

统计力学 · 物理学 2009-10-31 F. Szalma , W. Selke , S. Fischer

Lateral diffusion of molecules on surfaces plays a very important role in various biological processes, including lipid transport across the cell membrane, synaptic transmission and other phenomena such as exo- and endocytosis, signal…

偏微分方程分析 · 数学 2013-11-12 A. B. Duncan , C. M. Elliott , G. A. Pavliotis , A. M. Stuart

The low-temperature driven or thermally activated motion of several condensed matter systems is often modeled by the dynamics of interfaces (co-dimension-1 elastic manifolds) subject to a random potential. Two characteristic quantitative…

无序系统与神经网络 · 物理学 2009-10-31 A. Alan Middleton

The vicinal Si(111) surface, inclined towards the [-1-12] direction, was investigated by scanning tunnelling microscopy and spot profile analysing low energy electron diffraction. It has been established that the surface, consisting of…

材料科学 · 物理学 2019-03-19 S. A. Teys , K. N. Romanyuk , R. A. Zhachuk , B. Z. Olshanetsky

Using density-functional theory with the local-density approximation and the generalized gradient approximation we compute the energy barriers for surface diffusion for Ag on Pt(111), Ag on one monolayer of Ag on Pt(111), and Ag on Ag(111).…

材料科学 · 物理学 2009-10-30 C. Ratsch , A. P. Seitsonen , M. Scheffler

Diffusion of a particle in the N-dimensional external potential which is periodic in one dimension and unbounded in the other N-1 dimensions is investigated. We find an analytical expression for the overdamped diffusion and study…

统计力学 · 物理学 2016-08-31 O. M. Braun

Energetic particle redistribution in the presence of multiple Alfv\'en eigenmodes is analyzed in [PPCF 58, 014019 (2016)] for the ITER 15MA baseline scenario: non-linear hybrid simulations (within their well known limits) point out that…

等离子体物理 · 物理学 2022-11-17 Nakia Carlevaro , Giovanni Montani , Matteo Valerio Falessi , Philipp Lauber

The stationary phase method is applied to diffusion by a potential barrier for an incoming wave packet with energies greater then the barrier height. It is observed that a direct application leads to paradoxical results. The correct…

量子物理 · 物理学 2007-05-23 A. E. Bernardini , S. De Leo , P. Rotelli