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Molecular dynamics simulations performed on <110> Cu nanopillars revealed significant difference in deformation behavior of nanopillars with and without twin boundary. The plastic deformation in single crystal Cu nanopillar without twin…

Materials Science · Physics 2016-11-07 G. Sainath , B. K. Choudhary

Molecular dynamics simulations were performed to understand the role of twin boundaries on deformation behaviour of body-centred cubic (BCC) iron (Fe) nanopillars. The twin boundaries varying from one to five providing twin boundary spacing…

Materials Science · Physics 2016-11-18 G. Sainath , B. K. Choudhary

In recent years, twinned nanopillars have attracted tremendous attention for research due to their superior mechanical properties. However, most of the studies were focused on nanopillars with twin boundaries (TBs) perpendicular to loading…

Materials Science · Physics 2019-12-03 P. Rohith , G. Sainath , Sunil Goyal , A. Nagesha , V. S. Srinivasan

Size plays an important role on the deformation mechanism of nanopillars. With decreasing size, many FCC nanopillars exhibit dislocation starvation state which is responsible for their high strength. However, many details about the…

Materials Science · Physics 2023-10-04 G. Sainath , Vani Shankar , A. Nagesha

It is well known that the twin boundary (TB) spacing plays an important role in controlling the strength of twinned metallic nanopillars. One of the reasons attributed to this strengthening behaviour is the force exerted by the TBs on…

Materials Science · Physics 2021-11-12 G. Sainath , P. Rohith , A. Nagesha

Mechanical deformation of nanopillars displays features that are distinctly different from the bulk behavior of single crystals: Yield strength increases with decreasing size and plastic deformation comes together with strain bursts or/and…

Materials Science · Physics 2016-06-06 Stefanos Papanikolaou , Hengxu Song , Erik Van der Giessen

Grain boundary complexions have been observed to affect the mechanical behavior of nanocrystalline metals, improving both strength and ductility. While an explanation for the improved ductility exists, the observed effect on strength…

Materials Science · Physics 2018-03-28 Vladyslav Turlo , Timothy J. Rupert

The impact of twin boundaries (TBs) on the microstructure evolution and plastic deformation mechanisms of face-centered cubic (FCC) metals has been extensively studied since the discovery that nanotwinned materials exhibit a favorable…

Materials Science · Physics 2026-01-28 DeAn Wei , Michael Zaiser , Jing Tang , Xu Zhang

There is growing interest in promoting deformation twinning for plasticity in advanced materials, as highly organized twin boundaries are beneficial to better strength-ductility combination in contrast to disordered grain boundaries.…

Materials Science · Physics 2016-04-05 Peng Wang , Shaofeng Xu , Jiabin Liu , Xiaoyan Li , Yujie Wei , Hongtao Wang , Huajian Gao , Wei Yang

By using molecular dynamics simulations, the research examine how copper and silver nanowires respond to tensile loading in order to clarify their nanoscale deformation mechanisms. The results demonstrate that these two metal nanowires…

Materials Science · Physics 2025-05-02 Xiaorui Hu , Jiawei Xiong

Molecular dynamics simulations have been performed to understand the variations in deformation mechanisms of Cu nanowires as a function of orientation and loading mode (tension or compression). Cu nanowires of different crystallographic…

Materials Science · Physics 2018-09-05 P. Rohith , G. Sainath , B. K. Choudhary

Microcrystals deform very differently from their macroscopic counterparts, displaying a size-dependent yield stress and intermittent plastic strain bursts. Here we demonstrate that size effects and strain bursts may be just two different…

Materials Science · Physics 2012-04-04 Valentina Beato , Michael Zaiser , Stefano Zapperi

Molecular dynamics (MD) is employed to investigate the plastic deformation mechanisms of single crystalline yttria-stabilized tetragonal zirconia (YSTZ) nanopillars under uniaxial compression. Simulation results show that the nanoscale…

Materials Science · Physics 2019-05-02 Ning Zhang , Mohsen Asle Zaeem

Molecular dynamics simulations revealed significant difference in deformation behaviour of $<$100$>$ BCC Fe nanowires with and without twist boundary. The plastic deformation in perfect $<$100$>$ BCC Fe nanowire was dominated by twinning…

Materials Science · Physics 2016-11-29 G. Sainath , B. K. Choudhary

The dynamics of dislocation assemblies in deforming crystals indicate the emergence of collective phenomena, intermittent fluctuations and strain avalanches. In polycrystalline materials, the understanding of plastic deformation mechanisms…

Materials Science · Physics 2009-11-13 Paolo Moretti , Lasse Laurson , Mikko J. Alava

We investigate the depinning transition occurring in dislocation assemblies. In particular, we consider the cases of regularly spaced pileups and low angle grain boundaries interacting with a disordered stress landscape provided by solute…

Statistical Mechanics · Physics 2009-11-10 Paolo Moretti , M. -Carmen Miguel , Michael Zaiser , Stefano Zapperi

Interactions between an edge dislocation and a void in copper are investigated by means of molecular dynamics simulation. The depinning stresses of the leading partial and of the trailing partial show qualitatively different behaviors. The…

Materials Science · Physics 2007-05-23 Takahiro Hatano , Hideki Matsui

We use our recently proposed accelerated dynamics algorithm (Tiwary & van de Walle, 2011) to calculate temperature and stress dependence of activation free energy for surface nucleation of dislocations in pristine Gold nanopillars under…

Materials Science · Physics 2013-05-14 Pratyush Tiwary , Axel van de Walle

Dislocation pinning plays a vital role in the plastic behaviour of a crystalline solid. Here we report the first observation of the damped oscillations of a mobile dislocation after it gets pinned at an obstacle in the presence of a…

Materials Science · Physics 2010-12-24 M. Bhattacharya , A. Dutta , P. Mukherjee , N. Gayathri , P. Barat

Coarse-grained, metallic materials undergo microstructure refinement during tribological loading. This in turn results in changing tribological properties, so understanding deformation under tribological load is mandatory when designing…

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