Unraveling the two-stage precipitation mechanism in a hierarchical-structured fcc/L21 high-entropy alloy: Experiments and analytical modeling

W Li, W Wang, MC Niu, K Yang, JH Luan, HW Zhang… - Acta Materialia, 2024 - Elsevier
Understanding the phase stability and precipitation mechanisms is crucial for engineering
multiphase nanostructured alloys with optimal mechanical properties. In this work, we …

Tune a highly ductile AlCrFe2Ni4 alloy by Ti addition for desired high mechanical strength

G Diao, A He, DY Li, M Wu, Z Xu, W Li, QY Li - Materials Science and …, 2022 - Elsevier
One of advantages of multi-element high-entropy alloys (HEAs) is their flexibility for
microstructure manipulation, not only for the distribution of various phases but also the …

A comparative study on grain boundary segregation and solute clustering in Mg-Al-Zn and Mg-Zn-Ca alloys

HS Jang, D Seol, BJ Lee - Journal of Alloys and Compounds, 2022 - Elsevier
Magnesium, the lightest structural metal, has limited industrial application due to its poor
formability at room temperature. However, the mechanism for the effect of alloying elements …

Microstructural, interfacial, and frictional properties of TixCy/Ni composites

PC Le, TT Do, TH Fang, CI Lee - International Journal of Mechanical …, 2025 - Elsevier
This study examines the variation of Ti x C y/Ni composite properties during the polishing
process using molecular dynamics simulation. Various material parameters and testing …

Modified embedded-atom method interatomic potentials for Al-Cu, Al-Fe and Al-Ni binary alloys: From room temperature to melting point

A Mahata, T Mukhopadhyay, MA Zaeem - Computational materials science, 2022 - Elsevier
Second nearest neighbor modified embedded-atom method (2NN-MEAM) interatomic
potentials are developed for binary aluminum (Al) alloys applicable from room temperature …

Automated determination of grain boundary energy and potential-dependence using the OpenKIM framework

B Waters, DS Karls, I Nikiforov, RS Elliott… - Computational Materials …, 2023 - Elsevier
We present a systematic methodology, built within the Open Knowledgebase of Interatomic
Models (OpenKIM) framework (https://openkim. org), for quantifying properties of grain …

Frank partial dislocation in Ti2AlC-MAX phase induced by matrix-Cu diffusion

W Yu, J Guénolé, J Ghanbaja, M Vallet, A Guitton - Scripta Materialia, 2021 - Elsevier
The control of complex nanostructures is one of the most promising strategy for designing
tailored property materials. Ti 2 AlC, as nanolayered ternary materials combining both …

Modified embedded-atom method potential for high-temperature crystal-melt properties of Ti–Ni alloys and its application to phase field simulation of solidification

S Kavousi, BR Novak, MI Baskes… - … and Simulation in …, 2019 - iopscience.iop.org
We developed new interatomic potentials, based on the second nearest-neighbor modified
embedded-atom method (2NN-MEAM) formalism, for Ti, Ni, and the binary Ti–Ni system …

Oxidation protection of enamel coated Ni based superalloys: Microstructure and interfacial reaction

G Yan, W Yu, S Sheng** - Corrosion Science, 2020 - Elsevier
We study the oxidation of SiO 2-Al 2 O 3-CaO-BaO-MgO based enamel coated Ni based
superalloy at 900° C and find that the enamel coatings are highly capable of protecting the …

Molecular dynamics simulation of NiTi shape memory alloys produced by laser powder bed fusion: laser parameters on phase transformation behavior

G Li, T Yu, P Wu, M Chen - Materials, 2023 - mdpi.com
In this study, the deposition, powder spreading, and laser fusion processes during the laser
powder bed fusion (L-PBF) process were studied using molecular dynamics (MD) …