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Machine learning for high-entropy alloys: Progress, challenges and opportunities
High-entropy alloys (HEAs) have attracted extensive interest due to their exceptional
mechanical properties and the vast compositional space for new HEAs. However …
mechanical properties and the vast compositional space for new HEAs. However …
Probing the effects of hydrogen on the materials used for large-scale transport of hydrogen through multi-scale simulations
G Cheng, X Wang, K Chen, Y Zhang… - … and Sustainable Energy …, 2023 - Elsevier
The successful realization of a hydrogen economy is crucially dependent on a
comprehensive understanding of the effects of hydrogen on the hydrogen infrastructure …
comprehensive understanding of the effects of hydrogen on the hydrogen infrastructure …
Electronic descriptors for dislocation deformation behavior and intrinsic ductility in bcc high-entropy alloys
Controlling the balance between strength and damage tolerance in high-entropy alloys
(HEAs) is central to their application as structural materials. Materials discovery efforts for …
(HEAs) is central to their application as structural materials. Materials discovery efforts for …
Unraveling dislocation-based strengthening in refractory multi-principal element alloys
Refractory multi-principal element alloys (RMPEAs) draw great interest with their superior
mechanical properties and extremely high melting points, yet the strengthening mechanism …
mechanical properties and extremely high melting points, yet the strengthening mechanism …
Multiscale modeling of dislocation-mediated plasticity of refractory high entropy alloys
Refractory high entropy alloys (RHEAs) have drawn growing attention due to their
remarkable strength retention at high temperatures. Understanding dislocation mobility is …
remarkable strength retention at high temperatures. Understanding dislocation mobility is …
Atomistic simulations of the local slip resistances in four refractory multi-principal element alloys
The design and development of structural materials that can survive under the extreme
conditions of operation are critical to next generation aerospace and energy technologies …
conditions of operation are critical to next generation aerospace and energy technologies …
Deformation, dislocation evolution and the non-Schmid effect in body-centered-cubic single-and polycrystal tantalum
A physically-informed continuum crystal plasticity model is presented to elucidate
deformation mechanisms, dislocation evolution and the non-Schmid effect in body-centered …
deformation mechanisms, dislocation evolution and the non-Schmid effect in body-centered …
Atomic-scale hidden point-defect complexes induce ultrahigh-irradiation hardening in tungsten
Tungsten displays high strength in extreme temperature and radiation environments and is
considered a promising plasma facing material for fusion nuclear reactors. Unlike other …
considered a promising plasma facing material for fusion nuclear reactors. Unlike other …
[HTML][HTML] Ideal simple shear strengths of two HfNbTaTi-based quinary refractory multi-principal element alloys
Atomistic simulations are employed to investigate chemical short-range ordering in two body-
centered cubic refractory multi-principal element alloys, HfMoNbTaTi and HfNbTaTiZr, and …
centered cubic refractory multi-principal element alloys, HfMoNbTaTi and HfNbTaTiZr, and …
Nanoindentation of tungsten: From interatomic potentials to dislocation plasticity mechanisms
In this study, we employed molecular dynamics simulations, both traditional and machine
learned, to emulate spherical nanoindentation experiments of crystalline W matrices at …
learned, to emulate spherical nanoindentation experiments of crystalline W matrices at …