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Mikhail Khenner

Publications and source records attributed to Mikhail Khenner.

At least 19 recordsLinked to original sources

Model-based study of a nanowire heating and dynamic axisymmetric necking by surface electromigration

Axisymmetric solid-state necking of a single-crystal metallic nanowire in a thermal contact with a substrate and subjected to a surface electromigration current is accompanied by a local current crowding and a sharp rise of a resistivity of a wire material in a thinning neck. This results in a temperature spike at the neck, which feedback affects the necking via thermomigration and the temperature-dependent surface diffusivity of the adatoms. A model that incorporates these effects and couples the nonlinear dynamics of a wire temperature and a wire radius for a necking wire is presented. Conditions on the physical parameters are derived that ensure a straight wire is in the solid state prior to an onset of a morphological instability that ultimately breaks a wire via a pinch-off. The impacts of a wire radius and a wire length on the temperature spike at the break junction are studied.

cond-mat.mes-hall

Moir\'e-regulated composition evolution kinetics of bicomponent nanoclusters

A simple model and computation of Moir\'e-regulated composition evolution kinetics of bicomponent nanoclusters is presented. Assuming continuous adsorbate coverage on top of 2D bilayer and Moir\'e potential-driven nanocluster formation at fcc sites of Moir\'e landscape, these sites experience the influx of one component of a bicomponent adsorbate and the outflux of another component. Kinetics of this process is characterized for several combinations of adsorption potentials and their relative strengths.

cond-mat.mtrl-sci

On Nanowire Morphological Instability and Pinch-Off by Surface Electromigration

Surface diffusion and surface electromigration may lead to a morphological instability of thin solid films and nanowires. In this paper two nonlinear analyses of a morphological instability are developed for a single-crystal cylindrical nanowire that is subjected to an axial current. These treatments extend the conventional linear stability analyses without surface electromigration, that manifest a Rayleigh-Plateau instability. A weakly nonlinear analysis is done slightly above the Rayleigh-Plateau (longwave) instability threshold. It results in a one-dimensional Sivashinsky amplitude equation that describes a blow-up of a surface perturbation amplitude in a finite time. This is a signature of a pinching singularity of a cylinder radius, which leads to a wire separation into a disjoint segments. The time- and electric field-dependent dimensions of the focusing self-similar amplitude profile approaching a blow-up are characterized via the scaling analysis. Also, a weakly nonlinear multi-scale analysis is done at the arbitrary distance above a longwave or a shortwave instability threshold. The time- and electric field-dependent Fourier amplitudes of the major instability modes are derived and characterized.

cond-mat.mtrl-sci

Nanowire Breakup via a Morphological Instability Enhanced by Surface Electromigration

Using a recent continuum model of a single-crystal nanowire morphological evolution in the applied axial electric field, an axisymmetric evolution of a microscopically rough nanowire surface is computed. Morphological evolution results in a wire breakup into a cylindrical segments (particles). Breakup time and the number of particles are characterized for various levels of the radial and axial surface roughness. It is shown that electromigration and larger surface roughness lead to a shorter breakup time and the increased number of particles.

cond-mat.mtrl-sci

Effect of Electromigration on Onset of Morphological Instability of a Nanowire

Solid cylindrical nanowires are vulnerable to a Rayleigh-Plateau-type morphological instability. The instability results in a wire breakup, followed by formation of a chain array of spherical nanoparticles. In this paper, a base model of a morphological instability of a nanowire on a substrate in the applied electric field directed along a nanowire axis is considered. Exact analytical solution is obtained for 90 degrees contact angle and, assuming axisymmetric perturbations, for a free-standing wire. The latter solution extends the 1965 result by Nichols and Mullins without electromigration effect (F.A. Nichols and W.W. Mullins, Trans. Metall. Soc. AIME 233, 1840-1848 (1965)). For general contact angles the neutral stability is determined numerically. It is shown that a stronger applied electric field (a stronger current) results in a larger instability growth rate and a decrease of the most dangerous unstable wavelength; in experiment, the latter is expected to yield more dense chain array of nanoparticles. Also it is noted that a wire crystallographic orientation on a substrate has larger impact on stability in a stronger electric field and that a simple switching of the polarity of electrical contacts, i.e. the reversal of the direction of the applied electric field, may suppress the instability development and thus a wire breakup would be prevented. A critical value of the electric field that is required for such wire stabilization is obtained.

cond-mat.mtrl-sci

Kinetic models of Quantum Size Effect-directed nanocluster self-assembly in atomic corrals

Two simple kinetic models of Quantum Size Effect-directed nanocluster self-assembly in circular atomic corrals are discussed. The models correspond to an adsorption (either a physisorption or a chemisorption) and an adsorption-diffusion regimes that are typical at low and high temperatures, respectively. Small magnitudes of a variation of the electronic local density of states is shown to be the prime factor that impedes self-assembly in the latter regime.

cond-mat.mes-hall

Vacancy-mediated suppression of phase separation in a model two-dimensional surface alloy by the difference of the atomic jump rates

A vacancy-mediated collective diffusion model is used to compute a thermally-induced (spinodal) phase separation in a typical fcc bi-metallic surface alloy at low median concentration of vacancies, focusing on the effect of the ratio, $Γ=Γ_A/Γ_B$, of the jump rates to the vacant sites of the two types of atoms. The model is formulated for the diffusion of one atomic species and vacancies, employing the kinetic transport coefficients derived by Moleko \emph{et al.} (Phil. Mag. A 59, 141 (1989)). It is demonstrated that for A$_{0.7}$B$_{0.3}$ alloy, $Γ\sim 50$ results in suppression of phase separation, whereas very small $Γ$ values result in mild phase separation (i.e., the suppression is incomplete).

cond-mat.mtrl-sci

A mesoscopic model of nanoclusters self-assembly on a graphene Moiré

A continuum, post-deposition mesoscopic model of a Moiré-regulated self-assembly of metal nanoclusters on a twisted bilayer graphene is presented. Quasi-two-dimensional nanocluster-like steady states at a low adsorbate coverage are analytically determined for Pt, Ni, and Pb adsorbates, pointing that nanoclusters self-assemble at the Moiré cells centers. This is followed by the computations of nanoclusters self-assembly dynamics. Differences in the self-assembly efficiency for three chosen metals are highlighted across three typical values of an initial submonolayer coverage and for three temperature regimes. Accounting for the adsorption potential of metal atoms onto graphene leads to a significantly faster nanoclusters self-assembly and has a transient impact on the nanoclusters morphologies. A model extensions to the cases of nanoclusters self-assembly on a Moiré formed by a monolayer graphene over a metal substrate, and the electromigration-guided self-assembly on such Moiré are proposed.

cond-mat.mes-hall

Directed long-range transport of a nearly pure component atom clusters by the electromigration of a binary surface alloy

Assuming a vacancy-mediated diffusion, a continuum model for electromigration-driven transport of an embedded atom cluster across a surface terrace of a phase-separating A$_x$B$_{1-x}$ surface alloy, such as fcc AgPt(111), is presented. Computations show that the electron wind carries the cluster over hundreds of lattice spacings and in the set direction, while the cluster grows and its purity improves during the drift. Impacts of the current density, the diffusion anisotropy, the magnitude and sign of the ratio of the effective charges $q_A/q_B$, and the jump frequencies ratio $Γ_A/Γ_B$ on the cluster's drift speed, drift direction, purity and shape are demonstrated.

cond-mat.mtrl-sci

Modeling evolution of composition patterns in a binary surface alloy

Evolution of composition patterns in the annealed, single-crystal surface alloy film is considered in the presence of the spinodal decomposition, the compositional stress and the diffusion anisotropy. While the former two effects contribute to overall phase separation, the anisotropy, correlated with the surface crystallographic orientation, guides the in-plane formation and orientation of a pattern. The impacts of the anisotropy parameters on patterns are systematically computed for [110], [100], and [111]-oriented fcc cubic alloy surfaces.

cond-mat.mtrl-sci

Electromigration-guided composition patterns in thin alloy films: a computational study

Via computation of a continuum dynamical model of the diffusion and electromigration, this paper demonstrates the feasibility of guiding the formation of the stripe composition patterns in the thin surface layers of the crystal alloy films. By employing the systematic parametric computational analysis it is revealed how such properties of the pattern as the aerial number density of the stripes and the stripe in-plane orientation are influenced by the major physical factors that are not limited to the electric field strength and its direction angle in the plane, but also include a number of parameters that originate in the anisotropy of diffusion in the particular crystallographically-oriented surface layer. By following the insights from this analysis the real patterns hopefully can be created in a dedicated experiment.

cond-mat.mtrl-sci

Morphologies, metastability and coarsening of quantum nanoislands on the surfaces of the annealed Ag(110) and Pb(111) thin films

Morphological evolution of heteroepitaxial nanoislands toward equilibrium (coarsening) is computed using the detailed continuum model that incorporates the quantum size effect. Results reveal the metastability of the "magic" heights, show the morphological transitions and the surface diffusion routes by which a quantum island reaches its stable height, and provide the coarsening laws for the island density and area, thus clarifying the kinetic morphology pathways in the growth of an ultrathin metal films.

cond-mat.mtrl-sci

Modeling solid-state dewetting of a single-crystal binary alloy thin films

Dewetting of a binary alloy thin film is studied using a continuum many-parameter model that accounts for the surface and bulk diffusion, the bulk phase separation, the surface segregation and the particles formation. Analytical solution is found for the quasistatic equilibrium concentration of a surface-segregated atomic species. This solution is factored into the nonlinear and coupled evolution PDEs for the bulk composition and surface morphology. Stability of a planar film surface with respect to small perturbations of the shape and composition is analyzed, revealing the dependence of the particles size on major physical parameters. Computations show various scenarios of the particles formation and the redistribution of the alloy components inside the particles and on their surface. In most situations, for the alloy film composed initially of 50% A and 50% B atoms, a core-shell particles are formed, and they are located atop a wetting layer that is modestly rich in the B phase. Then the particles shell is the nanometric segregated layer of the A phase, and the core is the alloy that is modestly rich in the A phase.

cond-mat.mtrl-sci

Height transitions, shape evolution, and coarsening of equilibrating quantum nanoislands

Morphology evolution and coarsening of metal nanoislands is computed within the framework of a surface diffusion-type model that includes the effects of the electron energy confinement within the film, the charge spillage at the film/substrate interface, the energy anisotropy of the film surface and the surface stress. The conditions that result in large islands with flat tops, steep edges, and strongly preferred heights are determined. A strong influence of the film height on the coarsening dynamics and final morphologies is found; the conditions leading to interrupted coarsening are highlighted. The dependence of the geometric parameters of the equilibrium island on the film height and on the island initial volume is computed.

cond-mat.mtrl-sci

Interplay of Quantum Size Effect, Anisotropy and Surface Stress Shapes the Instability of Thin Metal Films

Morphological instability of a planar surface ([111], [011], or [001]) of an ultra-thin metal film is studied in a parameter space formed by three major effects (the quantum size effect, the surface energy anisotropy and the surface stress) that influence a film dewetting. The analysis is based on the extended Mullins equation, where the effects are cast as functions of the film thickness. The formulation of the quantum size effect (Z. Zhang et al., PRL 80, 5381 (1998)) includes the oscillation of the surface energy with thickness caused by electrons confinement. By systematically comparing the effects, their contributions into the overall stability (or instability) is highlighted.

cond-mat.mtrl-sci

Model for computing kinetics of the graphene edge epitaxial growth on copper

A basic kinetic model that incorporates a coupled dynamics of the carbon atoms and dimers on a copper surface is used to compute growth of a single-layer graphene island. The speed of the island's edge advancement on Cu[111] and Cu[100] surfaces is computed as a function of the growth temperature and pressure. Spatially resolved concentration profiles of the atoms and dimers are determined, and the contributions provided by these species to the growth speed are discussed. Island growth in the conditions of a thermal cycling is studied.

cond-mat.mtrl-sci

Electromigration-driven Evolution of the Surface Morphology and Composition for a Bi-Component Solid Film

A two PDEs-based model is developed for studies of a morphological and compositional evolution of a thermodynamically stable alloy surface in a strong electric field, assuming different and anisotropic diffusional mobilities of the two atomic components. The linear stability analysis of a planar surface and the computations of morphology coarsening are performed. It is shown that the conditions for instability and the characteristic wavelength and growth rate differ from their counterparts in a single-component film. Computational parametric analyses reveal the sensitivity of the scaling exponents to the electric field strength and to the magnitude of the anisotropies difference.

cond-mat.mtrl-sci

Step Growth and Meandering in a Precursor-Mediated Epitaxy with Anisotropic Attachment Kinetics and Terrace Diffusion

Step meandering instability in a Burton-Cabrera-Frank (BCF)-type model for the growth of an isolated, atomically high step on a crystal surface is analyzed. It is assumed that the growth is sustained by the molecular precursors deposition on a terrace and their decomposition into atomic constituents; both processes are explicitly modeled. A strongly nonlinear evolution PDE for the shape of the step is derived in the long-wave limit and without assuming smallness of the amplitude; this equation may be transformed into a convective Cahn-Hilliard-type PDE for the step slope. Meandering is studied as a function of the precursors diffusivity and of the desorption rates of the precursors and adatoms. Several important features are identified, such as: the interrupted coarsening, "facet" bunching, and the lateral drift of the step perturbations (a traveling wave) when the terrace diffusion is anisotropic. The nonlinear drift introduces a disorder into the evolution of a step meander, which results in a pronounced oscillation of the step velocity, meander amplitude and lateral length scale in the steady-state that emerged after the coarsening was interrupted. The mean values of these characteristics are also strongly affected by the drift. Keywords: epitaxial crystal growth; step flow; meandering instability; molecular precursors; anisotropic diffusion; nonlinear pde model; convective Cahn-Hilliard equation

cond-mat.mtrl-sci