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Understanding the grain boundary deformation dynamics is very crucial to designing materials with stable microstructures. With this quest, the deformation behavior of coherent twin boundary under cyclic shear loading has been studied in…

材料科学 · 物理学 2022-11-24 J. Veerababu , G. Sainath , A. Nagesh

Grain boundary networks should play a dominant role in determining the mechanical properties of nanocrystalline metals. However, these networks are difficult to characterize and their response to deformation is incompletely understood. In…

材料科学 · 物理学 2020-01-17 David B. Bober , Mukul Kumar , Timothy J. Rupert

Molecular dynamics simulations were used to quantify mechanically-induced structural evolution in nanocrystalline Al with an average grain size of 5 nm. A polycrystalline sample was cyclically strained at different temperatures, while a…

材料科学 · 物理学 2015-06-22 Jason F. Panzarino , Jesus J. Ramos , Timothy J. Rupert

The grain boundary-mediated mechanisms that control plastic deformation of nanocrystalline metals should cause evolution of the grain boundary network, since they directly alter misorientation relationships between crystals. Unfortunately,…

材料科学 · 物理学 2016-07-21 Jason F. Panzarino , Timothy J. Rupert

Grain boundaries are thermodynamically unstable. Hence, their properties should be path-dependent: grain boundaries in nanocrystals prepared using different methods might exhibit different properties. Using molecular dynamics simulations,…

材料科学 · 物理学 2021-04-29 Hao Suna , Laurent Karim Béland

The phase behavior of grain boundaries can have a strong influence on interfacial properties. Little is known about the emergence of grain boundary phases in elemental metal systems and how they transform. Here, we observe the nanoscale…

The wear-driven structural evolution of nanocrystalline Cu was simulated with molecular dynamics under constant normal loads, followed by a quantitative analysis. While the microstructure far away from the sliding contact remains unchanged,…

材料科学 · 物理学 2017-09-06 Zhiliang Pan , Timothy J. Rupert

Nanocrystalline metals with average grain sizes of only a few nanometers have recently been observed to fail through the formation of shear bands. Here, we investigate this phenomenon in nanocrystalline Ni which has had its grain structure…

材料科学 · 物理学 2015-04-06 Amirhossein Khalajhedayati , Timothy J. Rupert

The mechanical behavior of nanotwinned Cu was studied through indentation creep and constant strain rate indentation tests from 25 $^\circ$C to 200 $^\circ$C. The results showed an enhanced strain rate sensitivity of nanotwinned Cu with…

材料科学 · 物理学 2018-06-04 L. W. Yang , C. Y. Wang , M. A. Monclús , L. Lu , J. M. Molina-Aldareguía , J. LLorca

Amorphous grain boundary complexions have been shown to increase the plasticity of nanocrystalline alloys as compared to ordered grain boundaries. Here, the effect of an important structural descriptor, amorphous complexion thickness, on…

High energy x-ray diffraction microscopy was used to image the microstructure of $\alpha$-Fe before and after a 600 $^\circ$C anneal. These data were used to determine the areas, curvatures, energies, and velocities of approximately 40,000…

Amorphous complexions have recently been demonstrated to simultaneously enhance the ductility and stability of certain nanocrystalline alloys. In this study, three quinary alloys (Cu-Zr-Hf-Mo-Nb, Cu-Zr-Hf-Nb-Ti, and Cu-Zr-Hf-Mo-W) are…

材料科学 · 物理学 2022-02-02 Charlette M. Grigorian , Timothy J. Rupert

Molecular dynamics simulations are used to investigate strain localization in a model nanocrystalline metal. The atomic mechanisms of such catastrophic failure are first studied for two grain sizes of interest. Detailed analysis shows that…

材料科学 · 物理学 2014-08-26 Timothy J. Rupert

This paper investigates the statistical behavior of two-dimensional grain microstructures during grain growth under anisotropic grain boundary characters. We employ the threshold-dynamics method, which allows for unparalleled computational…

材料科学 · 物理学 2023-09-19 Jaekwang Kim , Nikhil Chandra Admal

It is now well established, both theoretically and experimentally, that very small changes in the size of isolated nanograins lead to substantial nonmonotonic variations, and sometimes enhancement, of the mean-field spectroscopic gap of…

超导电性 · 物理学 2014-11-04 James Mayoh , Antonio M. García-García

Nanocrystalline materials are defined by their fine grain size, but details of the grain boundary character distribution should also be important. Grain boundary character distributions are reported for ball milled, sputter deposited, and…

材料科学 · 物理学 2016-01-27 David B. Bober , Amirhossein Khalajhedayati , Mukul Kumar , Timothy J. Rupert

Amorphous complexions in nanocrystalline metals have the potential to improve mechanical properties and radiation tolerance, as well as resistance to grain growth. In this study, the stability of amorphous complexions in binary and ternary…

材料科学 · 物理学 2020-12-18 Charlette M. Grigorian , Timothy J. Rupert

Nanocrystalline Cu-3 at.% Zr powders with ~20 nm average grain size were created with mechanical alloying and their thermal stability was studied from 550-950 {\deg}C. Annealing drove Zr segregation to the grain boundaries, which led to the…

材料科学 · 物理学 2015-08-31 Amirhossein Khalajhedayati , Timothy J. Rupert

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…

材料科学 · 物理学 2018-03-28 Vladyslav Turlo , Timothy J. Rupert

In this work the coupled motion of two different phases of {\Sigma}5(210)[001] grain boundaries were investigated by molecular dynamics simulations of fcc Cu. The effect of interfacial structural phase transitions is shown to have a…

材料科学 · 物理学 2015-06-19 Timofey Frolov
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