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The two-dimensional dislocation dynamics approach has been recently used for analyzing plastic deformation in metals and alloys at elevated temperatures. The two-dimensional approach, however, only accounts for the dislocation climbing…

Materials Science · Physics 2018-01-29 Amirreza Keyhani

Dynamical process where an edge dislocation in fcc copper bypasses an impenetrable precipitate is investigated by means of molecular dynamics simulation. A mechanism which is quite different from the Orowan mechanism is observed, where a…

Materials Science · Physics 2007-05-23 Takahiro Hatano

Precipitation strengthening is one of the most effective methods to design alloys with the desired combination of strength and ductility. The main mechanism of strengthening is generally known to be the interaction between dislocations and…

Materials Science · Physics 2018-09-05 Amirreza Keyhani

We present computational evidence using MD simulations of a size effect for the critical resolved shear stress (CRSS) of edge dislocation motion in nickel superalloys. We model the superalloy as periodically spaced cubic $\gamma'$…

Materials Science · Physics 2025-07-16 Divyeshkumar A. Mistry , Amuthan A. Ramabathiran

The mechanisms of dislocation/precipitate interaction were studied by means of discrete dislocation dynamics within a multiscale approach. Simulations were carried out using the discrete continuous method in combination with a fast Fourier…

The interaction between dislocations and precipitates plays an important role in the mechanical behavior of alloys. To provide more insight into the physics of this interaction, this research analyzes short-range interactions of an edge…

Materials Science · Physics 2024-03-05 Amirreza Keyhani

We present a new framework to quantify the effect of hydrogen on dislocations using large scale three-dimensional (3D) discrete dislocation dynamics (DDD) simulations. In this model, the first order elastic interaction energy associated…

Materials Science · Physics 2018-01-31 Yejun Gu , Jaafar A. El-Awady

Nanoscale precipitates in the microstructure of nickel-based superalloys hinder dislocation motion, which results in an extraordinary strengthening effect at elevated temperatures. We used molecular dynamics (MD) with classical effective…

Materials Science · Physics 2024-03-04 Geraldine Anis , Thomas Hudson , Peter Brommer

The mechanisms of dislocation/precipitate interactions were analyzed in an Al-Cu alloy containing a homogeneous dispersion of $\theta'$ precipitates by means of discrete dislocation dynamics simulations. The simulations were carried out…

Materials Science · Physics 2020-02-28 R. Santos-Güemes , B. Bellón , G. Esteban-Manzanares , J. Segurado , L. Capolungo , J. LLorca

The Ni-base superalloy 718 is the most widely used material for turbomachinery in the aerospace industry and land-based turbines. Although the relationship between processing and the resulting properties is well known, an understanding of…

Materials Science · Physics 2021-07-30 Christopher H. Zenk , Longsheng Feng , Donald McAllister , Yunzhi Wang , Michael J. Mills

The stress-driven motion of dislocations in crystalline solids, and thus the ensuing plastic deformation process, is greatly influenced by the presence or absence of various point-like defects such as precipitates or solute atoms. These…

Materials Science · Physics 2016-02-10 Arttu Lehtinen , Fredric Granberg , Lasse Laurson , Kai Nordlund , Mikko J. Alava

Understanding plastic deformation of crystals in terms of the fundamental physics of dislocations has remained a grand challenge in materials science for decades. To overcome this, the Discrete Dislocation Dynamics (DDD) method has been…

Materials Science · Physics 2024-04-03 Nicolas Bertin , Wei Cai , Sylvie Aubry , Athanasios Arsenlis , Vasily V. Bulatov

The mechanical properties of Mg-Al alloys are greatly influenced by the complex intermetallic phase Mg$_{17}$Al$_{12}$, which is the most dominant precipitate found in this alloy system. The interaction of basal edge and 30$^\text{o}$…

Materials Science · Physics 2019-06-10 Aviral Vaid , Julien Guénolé , Aruna Prakash , Sandra Korte-Kerzel , Erik Bitzek

Creep in single crystal Nickel-based superalloys has been a topic of interest since decades, and nowadays simulations are more and more able to complement experiments. In these alloys, the $\gamma/\gamma'$ phase microstructure co-evolves…

Materials Science · Physics 2017-02-09 Ronghai Wu , Michael Zaiser , Stefan Sandfeld

The interaction between Mg edge basal dislocations and rod-shaped $\beta_1'$-MgZn$_2$ precipitates was studied by atomistic simulations using a new interatomic potential. The atomistic model was carefully built taking into account the…

Materials Science · Physics 2020-05-21 G. Esteban-Manzanares , R. Alizadeh , I. Papadimitriou , D. Dickel , C. D. Barrett , J. LLorca

Dislocations are the carriers of plasticity in crystalline materials. Their collective interaction behavior is dependent on the strain rate and sample size. In small specimens, details of the nucleation process are of particular importance.…

Materials Science · Physics 2020-11-05 Jianqiao Hu , Hengxu Song , Zhanli Liu , Zhuo Zhuang , Xiaoming Liu , Stefan Sandfeld

Alloying metals with other elements is often done to improve the material strength or hardness. A key microscopic mechanism is precipitation hardening, where precipitates impede dislocation motion, but the role of such obstacles in…

Materials Science · Physics 2020-08-19 Henri Salmenjoki , Arttu Lehtinen , Lasse Laurson , Mikko J. Alava

A mesoscale study of a single crystal nickel-base superalloy subjected to an industrially relevant process simulation has revealed the complex interplay between microstructural development and the micromechanical behaviour. As sample gauge…

The critical resolved shear stress of an Al 4 wt. \% Cu alloy containing a homogeneous distribution of $\theta''$ precipitates was determined by means of dislocation dynamics simulations. The size distribution, shape, orientation and volume…

Materials Science · Physics 2021-04-07 R. Santos-Güemes , L. Capolungo , J. Segurado , J. LLorca

Frictional instabilities in fluid saturated granular materials underlie natural hazards, including submarine landslides and earthquake initiation. Experiments show distinct failure behaviors under subaerial and subaqueous conditions due to…

Soft Condensed Matter · Physics 2025-12-25 Bimal Chhushyabaga , Behrooz Ferdowsi
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