Influence of crystallographic orientations and nanovoid on the plastic mechanism and damage behavior of single-crystal tungsten under shock

In this work, we investigated the shock response of single-crystal tungsten with pre-existing voids using nonequilibrium molecular dynamics simulations, considering four crystallographic orientations ([100], [110], [111], and [112]). The results reveal that the presence of nanovoids significantly re...

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Bibliographic Details
Main Authors: Ziyi Li, Wensheng Liu, Yunzhu Ma, Chaoping Liang
Format: Article
Language:English
Published: Elsevier 2025-03-01
Series:Journal of Materials Research and Technology
Online Access:http://www.sciencedirect.com/science/article/pii/S2238785425000419
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Summary:In this work, we investigated the shock response of single-crystal tungsten with pre-existing voids using nonequilibrium molecular dynamics simulations, considering four crystallographic orientations ([100], [110], [111], and [112]). The results reveal that the presence of nanovoids significantly reduces the spall strength of tungsten. For perfect single crystals, the spall strength is highest along [111] (47.65 GPa) and [112] (42.89 GPa), while [110] exhibits the lowest value (32.79 GPa). However, with a void radius of 1.644 nm, the spall strength of [111] and [112] decreases sharply to 24.14 GPa and 20.16 GPa, respectively. In contrast, the spall strength reduction is minimal for [100] and [110]. Various plastic deformation mechanisms, such as dislocation emission, twinning, and prismatic loop formation, were observed during shock compression, with distinct differences between perfect and void-containing samples. These mechanisms and the associated microstructural evolution explain the anisotropic spallation behavior and provide insights into the rapid decline in spall strength for specific orientations.
ISSN:2238-7854