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We demonstrate how first-principles calculations using density-functional theory (DFT) can be applied to gain insight into the molecular processes that rule the physics of materials processing. Specifically, we study the molecular beam…

材料科学 · 物理学 2009-11-07 P. Kratzer , E. Penev , M. Scheffler

It is experimentally observed that adsorbate atoms and vacancies on (111) surfaces of fcc metals cluster into islands which are approximately hexagonal, but which on closer inspection turn out to have equilibrium facets which alternate in…

凝聚态物理 · 物理学 2009-10-22 G. T. Barkema , M. E. J. Newman , M. Breeman

The equilibrium shapes and energies of coherent strained InP islands grown on GaP have been investigated with a hybrid approach that has been previously applied to InAs islands on GaAs. This combines calculations of the surface energies by…

材料科学 · 物理学 2009-10-31 Q. K. K. Liu , N. Moll , M. Scheffler , E. Pehlke

The transport of collisional particles in stochastic magnetic fields is studied using the decorrelation trajectory method. The nonlinear effect of stochastic generation of magnetic island by magnetic line trapping is considered together…

等离子体物理 · 物理学 2007-05-23 M. Vlad , F. Spineanu , J. H. Misguich , R. Balescu

Clean Si(111)-(7{x7) surfaces, followed by air-exposure, have been investigated by reflection high energy electron diffraction (RHEED) and scanning tunneling microscopy (STM). Fourier transforms (FTs) of STM images show the presence of…

其他凝聚态物理 · 物理学 2016-03-15 Anupam Roy , K. Bhattacharjee , J. Ghatak , B. N. Dev

A quantitative comparison between experimental and Monte Carlo simulation results for the epitaxial growth of Cu/Cu(001) in the submonolayer regime is presented. The simulations take into account a complete set of hopping processes whose…

凝聚态物理 · 物理学 2009-11-07 Itay Furman , Ofer Biham , Jiang-Kai Zuo , Anna K. Swan , John F. Wendelken

Below the roughening transition, crystal surfaces exhibit nanoscale line defects, steps, that move by exchanging atoms with their environment. In homoepitaxy, we analytically show how the motion of a step train in vacuum under strong…

材料科学 · 物理学 2022-03-22 Ian Johnson , Dionisios Margetis

We present an analysis of the electron dynamics during rapid island merging in asymmetric magnetic reconnection. We consider a doubly periodic system with two asymmetric transitions. The upper layer is an asymmetric Harris sheet initially…

We present a theory for the damping of layer-by-layer growth oscillations in molecular beam epitaxy. The surface becomes rough on distances larger than a layer coherence length which is substantially larger than the diffusion length. The…

统计力学 · 物理学 2009-10-30 H. Kallabis , L. Brendel , J. Krug , D. E. Wolf

Calculating by analytical theory the deformation of finite-sized elastic bodies in response to internally applied forces is a challenge. Here, we derive explicit analytical expressions for the amplitudes of modes of surface deformation of a…

软凝聚态物质 · 物理学 2024-07-15 Lukas Fischer , Andreas M. Menzel

Evaporative lithography in cells of arbitrary configuration allows for the creation of diverse particle deposition patterns due to the formation of a specific flow structure in the liquid caused by non-uniform evaporation. The latter in…

软凝聚态物质 · 物理学 2025-12-09 Konstantin S. Kolegov , Viktor M. Fliagin , Natalia A. Ivanova

The coarsening dynamics of three-dimensional islands on a growing film is discussed. It is assumed that the origin of the initial instability of a planar surface is the Ehrlich-Schwoebel step-edge barrier for adatom diffusion. Two…

统计力学 · 物理学 2015-06-25 Lei-Han Tang

We study numerically the ground-state properties of the repulsive Hubbard model for spin-1/2 electrons on two-dimensional lattices with disordered on-site energies. The projector quantum Monte Carlo method is used to obtain very accurate…

凝聚态物理 · 物理学 2009-11-10 Bhargavi Srinivasan , Giuliano Benenti , Dima L. Shepelyansky

In this paper, we have formulated a phase-field model based on the grand-potential functional for the simulation of precipitate growth in the presence of coherency stresses. In particular, we study the development of dendrite-like patterns…

材料科学 · 物理学 2021-01-26 Bhalchandra Bhadak , Tushar Jogi , Saswata Bhattacharya , Abhik Choudhury

The adhesive behaviour of biological attachment structures such as spider web anchorages is usually studied using single or multiple peeling models involving "tapes", i.e. one-dimensional contacts elements. This is an oversimplification for…

计算物理 · 物理学 2020-03-18 Daniele Liprandi , Federico Bosia , Nicola M. Pugno

We develop and implement numerically a phase field model for the growth and detachment of a gas bubble resting on an electrode and being filled with hydrogen produced by water electrolysis. The bubble is surrounded by a viscous liquid, has…

软凝聚态物质 · 物理学 2025-12-19 Carlos Uriarte , Marco A. Fontelos , Manuel Arrayás

Modeling membrane interactions with arbitrarily shaped colloidal particles, such as environmental micro- and nanoplastics, at the cell scale remains particularly challenging, owing to the complexity of particle geometries and the need to…

软凝聚态物质 · 物理学 2025-09-15 Didarul Ahasan Redwan , Justin Reicher , Xin Yong

We have studied the approach to equilibrium of islands and pores in two dimensions. The two-regime scenario observed when islands evolve according to a set of particular rules, namely relaxation by steps at low temperature and smooth at…

材料科学 · 物理学 2009-11-10 Jose L. Iguain , Laurent J. Lewis

We study mutual alignment and interactions between colloidal particles of dissimilar shapes and dimensions when dispersed in a nematic host fluid. Convex pentagonal and concave starfruit-shaped nanoprisms and microspheres induce dipolar or…

软凝聚态物质 · 物理学 2016-12-28 Bohdan Senyuk , Ivan I. Smalyukh

We present Monte Carlo simulations for the size and temperature dependence of the diffusion coefficient of adatom islands on the Cu(100) surface. We show that the scaling exponent for the size dependence is not a constant but a decreasing…

材料科学 · 物理学 2009-10-31 J. Heinonen , I. Koponen , J. Merikoski , T. Ala-Nissila