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Related papers: Modes of Kink Motion on Dislocations in Semiconduc…

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Atomic-scale calculations for the dynamics of the 90$^0$ partial glide dislocation in silicon are made using the effective-medium tight-binding theory. Kink formation and migration energies for the reconstructed partial dislocation are…

Materials Science · Physics 2008-02-03 K. Stokbro , L. B. Hansen , B. I. Lundqvist

Theoretical calculations of the structure, formation and migration of kinks on a non-dissociated screw dislocation in silicon have been carried out using density functional theory calculations as well as calculations based on interatomic…

Materials Science · Physics 2008-12-18 Laurent Pizzagalli , Andreas Pedersen , Andri Arnaldsson , Hannes Jónsson , Pierre Beauchamp

Large-scale atomistic calculations, using empirical potentials for modeling semiconductors, have been performed on a stressed system with linear surface defects like steps. Although the elastic limits of systems with surface defects remain…

Materials Science · Physics 2007-09-12 Julien Godet , Laurent Pizzagalli , Sandrine Brochard , Pierre Beauchamp

The ability of a body-centered cubic metal to deform plastically is limited by the thermally activated glide motion of screw dislocations, which are line defects with a mobility exhibiting complex dependence on temperature, stress, and…

Materials Science · Physics 2020-11-25 M. Boleininger , M. Gallauer , S. L. Dudarev , T. D. Swinburne , D. R. Mason , D. Perez

A computer simulation of thermofluctuation nucleation of kinks on dislocations and their dynamics is carried out in the framework of two-dimensional (2D) Frenkel-Kontorova model. It is shown that at relatively low temperatures and applied…

Materials Science · Physics 2009-11-07 Yu. N. Gornostyrev , M. I. Katsnelson , A. V. Kravtsov , A. V. Trefilov

Numerical simulation of the dislocation motion in 2D Frenkel - Kontorova (FK) model in the thermostat shows an unusual dynamical behavior. It appears that ''kink'' regime of dislocation gliding takes place in a certain region of parameters…

Materials Science · Physics 2009-10-31 Yu. N. Gornostyrev , M. I. Katsnelson , A. V. Kravtsov , A. V. Trefilov

The theory of the dislocation motion in the periodic potential relief of the crystal lattice (the Peierls-Nabarro barriers) is reviewed. On the basis of the kink mechanism the temperature dependence of the flow stress is described for a…

Pattern Formation and Solitons · Physics 2007-05-23 B. V. Petukhov

Dislocation velocities and mobilities are studied by Molecular Dynamics simulations for edge and screw dislocations in pure aluminum and nickel, and edge dislocations in Al-2.5%Mg and Al-5.0%Mg random substitutional alloys using EAM…

Materials Science · Physics 2009-11-10 David L. Olmsted , Louis G. Hector , W. A. Curtin , R. J. Clifton

Spin waves that can propagate in normal and superconducting metals are investigated. Unlike normal metals, the velocity of spin waves becomes temperature-dependent in a superconductor. The low frequency spin waves survive within the narrow…

Superconductivity · Physics 2023-03-21 Serguei N. Burmistrov

In the spin energy excitation mode of normal metals and superconductors, spin up and down electrons (or quasiparticles) carry different heat currents. This mode occurs only when spin up and down energy distribution functions are…

Mesoscale and Nanoscale Physics · Physics 2020-01-14 M. Kuzmanović , B. Y. Wu , M. Weideneder , C. H. L. Quay , M. Aprili

Within the framework of McLaughlin-Scott perturbation theory the equation-of-motion of the dislocation kink in the pinning potential is linearized, assuming the simultaneous influence of ac and dc forces. Based on the equations derived, the…

Materials Science · Physics 2009-03-17 A. S. Vardanyan , A. A. Kteyan , R. A. Vardanyan

We consider contribution to the phonon scattering, in the temperature range of 1K, by the dislocation kinks pinned in the random stress fields in a crystal. The effect of electron-kink scattering on the thermal transport in the normal…

Strongly Correlated Electrons · Physics 2018-08-01 J. A. M. van Ostaay , S. I. Mukhin

The properties of condensed matter are determined by single-particle and collective excitations and their interactions. These quantum-mechanical excitations are characterized by an energy E and a momentum \hbar k which are related through…

Strongly Correlated Electrons · Physics 2007-05-23 K. Byczuk , M. Kollar , K. Held , Y. -F. Yang , I. A. Nekrasov , Th. Pruschke , D. Vollhardt

We investigate the physics of the core reconstruction and associated structural excitations (reconstruction defects and kinks) of dislocations in silicon, using a linear-scaling density-matrix technique. The two predominant dislocations…

Materials Science · Physics 2009-10-30 R. W. Nunes , J. Bennetto , David Vanderbilt

The theory of the depinning transition of elastic manifolds in random media provides a framework for the statistical dynamics of dislocation systems at yield. We consider the case of a single flexible dislocation gliding through a random…

Materials Science · Physics 2007-05-23 Stefano Zapperi , Michael Zaiser

Isolated kinks on thermally fluctuating (1/2)<111> screw, <100> edge and (1/2)<111> edge dislocations in bcc iron are simulated under zero stress conditions using molecular dynamics (MD). Kinks are seen to perform stochastic motion in a…

Materials Science · Physics 2013-02-26 T. D. Swinburne , S. L. Dudarev , S. P. Fitzgerald , M. R. Gilbert , A. P. Sutton

Synchro-Shockley dislocations, as zonal dislocation, are the major carrier of plasticity in Laves phases at high temperatures. The motion of synchro-Shockley dislocations is composed of localized transition events, such as kink-pair…

We study the statistical mechanics of double-stranded semi-flexible polymers using both analytical techniques and simulation. We find a transition at some finite temperature, from a type of short range order to a fundamentally different…

Statistical Mechanics · Physics 2009-10-30 T. B. Liverpool , R. Golestanian , K. Kremer

The thermally activated motion of dislocations across fields of obstacles distributed at random and in a correlated manner, in separate models, is studied by means of computer simulations. The strain rate sensitivity and strength are…

Computational Physics · Physics 2018-07-27 Zhijie Xu , Catalin Picu

The interplay of screw dislocations with carbon atoms is investigated in tungsten at high temperature using in situ straining experiments in a transmission electron microscope (TEM) and through ab initio calculations. When the temperature…

Materials Science · Physics 2021-11-24 Guillaume Hachet , Daniel Caillard , Lisa Ventelon , Emmanuel Clouet
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