Frontiers in the simulation of dislocations

N Bertin, RB Sills, W Cai - Annual Review of Materials Research, 2020 - annualreviews.org
Dislocations play a vital role in the mechanical behavior of crystalline materials during
deformation. To capture dislocation phenomena across all relevant scales, a multiscale …

Microstructures and properties of high‐entropy materials: modeling, simulation, and experiments

J Li, Q Fang, PK Liaw - Advanced Engineering Materials, 2021 - Wiley Online Library
The performances of high‐entropy materials (HEMs), including high‐entropy alloys, high‐
entropy ceramics, and high‐entropy polymers, with unique characteristics (high mixing …

Dislocation flow turbulence simultaneously enhances strength and ductility

Y Chen, H Feng, J Li, B Liu, C Jiang, Y Liu… - Proceedings of the …, 2024 - pnas.org
Multi-principal element alloys (MPEAs) exhibit outstanding strength attributed to the complex
dislocation dynamics as compared to conventional alloys. Here, we develop an atomic …

Heterogeneous lattice strain strengthening in severely distorted crystalline solids

J Li, Y Chen, Q He, X Xu, H Wang, C Jiang… - Proceedings of the …, 2022 - pnas.org
Multi–principal element alloys (MPEAs) exhibit outstanding mechanical properties because
the core effect of severe atomic lattice distortion is distinctly different from that of traditional …

Enhanced radiation tolerance of the Ni-Co-Cr-Fe high-entropy alloy as revealed from primary damage

Y Lin, T Yang, L Lang, C Shan, H Deng, W Hu, F Gao - Acta Materialia, 2020 - Elsevier
High-entropy alloys (HEAs) have received much attention for the development of nuclear
materials because of their excellent irradiation tolerance. In the present study, the …

[HTML][HTML] Roadmap on multiscale materials modeling

E Van Der Giessen, PA Schultz, N Bertin… - … and Simulation in …, 2020 - iopscience.iop.org
Modeling and simulation is transforming modern materials science, becoming an important
tool for the discovery of new materials and material phenomena, for gaining insight into the …

Atomistic insights into metal hardening

LA Zepeda-Ruiz, A Stukowski, T Oppelstrup, N Bertin… - Nature materials, 2021 - nature.com
For millennia, humans have exploited the natural property of metals to get stronger or
harden when mechanically deformed. Ultimately rooted in the motion of dislocations …

Crystal plasticity model of BCC metals from large-scale MD simulations

N Bertin, R Carson, VV Bulatov, J Lind, M Nelms - Acta Materialia, 2023 - Elsevier
Accurate crystal plasticity models that faithfully capture the behavior of single crystals under
a wide range of loading conditions, such as loading direction, strain rate, and temperature …

Effect of initial dislocation density on the plastic deformation response of 316L stainless steel manufactured by directed energy deposition

SH Li, Y Zhao, P Kumar, U Ramamurty - Materials Science and …, 2022 - Elsevier
The relationship between the microstructural features (such as the solidification cells and
initial dislocation densities) and the tensile properties of alloys additively manufactured (AM) …

A computational mechanical constitutive modeling method based on thermally-activated microstructural evolution and strengthening mechanisms

M Lei, G Sun, G Yang, B Wen - International Journal of Plasticity, 2024 - Elsevier
A mechanical constitutive relationship is the basis for the design and application of structural
materials, and the establishment of a mechanical constitutive relationship generally relies on …