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We performed classical molecular dynamics simulations to investigate, from an atomistic point of view, the formation of dislocations during the epitaxial growth of Ge on Si. We show that simulations at 900 and 1000 K with deposition rates…

Materials Science · Physics 2025-09-19 Luis Martín-Encinar , Luis A. Marqués , Iván Santos , Lourdes Pelaz

Dynamic heterogeneity, believed to be one of the hallmarks of the dynamics of supercooled liquids, is expected to affect the diffusion of the particles comprising the liquid. We have carried out extensive molecular dynamics simulations of…

Soft Condensed Matter · Physics 2019-12-23 Rajsekhar Das , Chandan Dasgupta , Smarajit Karmakar

The morphology evolution of Si (100) surfaces under 1200 eV Ar+ ion bombardment at normal incidence with and without metal incorporation is presented. The formation of nanodot patterns is observed only when the stationary Fe concentration…

Materials Science · Physics 2015-05-18 Jing Zhou , Stefan Facsko , Ming Lu , Wolfhard Moeller

Nanoscale diffusion at the interfaces in multilayers plays a vital role in controlling their physical properties for a variety of applications. In the present work depth-dependent interdiffusion in a Si/Fe/Si trilayer has been studied with…

Mesoscale and Nanoscale Physics · Physics 2013-05-29 Ajay Gupta , Dileep Kumar , Vaishali Phatak

Amorphous Si (a-Si) nanostructures are ubiquitous in numerous electronic and optoelectronic devices. Amorphous materials are considered to possess the lower limit to the thermal conductivity (k), which is ~1 W/m-K for a-Si. However, recent…

Materials Science · Physics 2017-01-03 Soonshin Kwon , Jianlin Zheng , Matthew C. Wingert , Shuang Cui , Renkun Chen

Atomic diffusion at nanometer length scale may differ significantly from bulk diffusion, and may sometimes even exhibit counterintuitive behavior. In the present work, taking Cu/Ni as a model system, a general phenomenon is reported which…

Materials Science · Physics 2019-05-15 Atul Tiwari , M. K. Tiwari , Mukul Gupta , H. -C. Wille , Ajay Gupta

We analyze the Fick's diffusion of a gas inside porous nanomaterials through the one-dimensional diffusion equation in nanopores for various cases of boundary conditions for homogeneous and non-homogeneous problems. We study the diffusion…

Soft Condensed Matter · Physics 2019-07-25 Leandro N. Acquaroli

The thermal properties of amorphous materials have attracted significant attention due to their technological importance in electronic devices. Additionally, the disorder-induced breakdown of the phonon gas model makes vibrational transport…

Applied Physics · Physics 2024-06-12 Wanyue Peng , Richard Wilson

We have investigated the dynamics of Na ions in amorphous Na2Si2O5, a potential solid electrolyte material for Na-battery. We have employed quasielastic neutron scattering (QENS) technique in the amorphous Na2Si2O5 from 300 to 748 K to…

GaAs/Fe$_{3}$Si core/shell nanowire structures were fabricated by molecular-beam epitaxy on oxidized Si(111) substrates and investigated by synchrotron x-ray diffraction. The surfaces of the Fe$_3$Si shells exhibit nanofacets. These facets…

Materials Science · Physics 2016-05-19 Bernd Jenichen , Michael Hanke , Maria Hilse , Jens Herfort , Achim Trampert , Steven C. Erwin

The amorphous-to-crystalline transition in Al(1.0%wtSi)/Zr and Al(Pure)/Zr multilayers grown by direct-current magnetron sputtering system has been characterized over a range of Al layer thicknesses (1.0-5.0 nm) by using a series of…

Diffusion is a fundamental physical phenomenon with critical applications in fields such as metallurgy, cell biology, and population dynamics. While standard diffusion is well-understood, anomalous diffusion often requires complex non-local…

Statistical Mechanics · Physics 2026-01-16 Gabriel Barreiro , Vladimir Pérez-Veloz

The diffusion of water molecules through mesoporous dust of amorphous carbon (a-C) is a key process in the evolution of prestellar, protostellar, and protoplanetary dust, as well as in that of comets. It also plays a role in the formation…

Instrumentation and Methods for Astrophysics · Physics 2024-03-05 Romain Basalgète , Gaël Rouillé , Cornelia Jäger

Recent studies unveiled the Fickian yet non-Gaussian (FNG) dynamics of many soft matter systems and suggested this phenomenon as a general characteristic of the diffusion in complex fluids. In particular, it was shown that the distribution…

Soft Condensed Matter · Physics 2018-10-24 Alejandro Cuetos , Neftalí Morillo , Alessandro Patti

Amorphous silicon materials and its alloys become extensively used in some technical applications involving large area of the microelectronic and optoelectronic devices. However, the amorphous-crystalline transition, segregation and…

Materials Science · Physics 2009-02-13 A. Csik , G. A. Langer , G. Erdelyi , D. L. Beke , Z. Erdelyi , K. Vad

The fracture toughness of Al/SiC nanolaminates with different layer thicknesses (in the range 10 to 100 nm) was measured by means of micropillar splitting and bending of a notched beam. The crack plane was perpendicular to the layers in the…

Materials Science · Physics 2020-09-09 L. W. Yang , C. R. Mayer , N. Chawla , J. LLorca , J. M. Molina-Aldareguía

We use molecular dynamics simulations to study the diffusion of water inside deformed carbon nanotubes, with different degrees of eccentricity at 300K. We found a water structural transition between tubular-like to single-file for the (7,7)…

The nanoinstability of single crystal Si nanowire under focused electron beam irradiation was in-situ investigated at room temperature by transmission electron microscopy technique. It was observed that the Si nanowire amorphized…

Mesoscale and Nanoscale Physics · Physics 2018-09-24 Jiangbin Su , Xianfang Zhu

It is shown using the method of molecular dynamics that the motion of carbon nanoparticles (rectangular graphene flakes, spherical fullerenes of size $L<10$ nm) on the surface of a thermalized graphene sheet lying on a flat substrate can be…

Mesoscale and Nanoscale Physics · Physics 2022-11-30 Alexander V. Savin

The microscopic theory of atomic diffusion kinetics is used for f.c.c. substitutional solid solutions. Within this approach, the short-range order relaxation is due to the atomic migration. Experimental data on the time dependence of…

Materials Science · Physics 2014-06-12 T. M. Radchenko , V. A. Tatarenko , S. M. Bokoch , M. P. Kulish
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