[HTML][HTML] 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 …
Chemical-motif characterization of short-range order with E (3)-equivariant graph neural networks
Crystalline materials have atomic-scale fluctuations in their chemical composition that
modulate various mesoscale properties. Establishing chemistry-microstructure relationships …
modulate various mesoscale properties. Establishing chemistry-microstructure relationships …
[HTML][HTML] Medical high-entropy alloy: Outstanding mechanical properties and superb biological compatibility
C Liu, C Yang, J Liu, Y Tang, Z Lin, L Li… - … in Bioengineering and …, 2022 - frontiersin.org
Medical metal implants are required to have excellent mechanical properties and high
biocompatibility to handle the complex human environment, which is a challenge that has …
biocompatibility to handle the complex human environment, which is a challenge that has …
Local lattice distortions, phase stability, and mechanical properties of NbMoTaWHfx alloys: A combined theoretical and experimental study
Refractory high-entropy alloys (RHEAs) are of growing interest due to their potentially
superior mechanical performances at elevated temperatures. Inherent lattice distortions are …
superior mechanical performances at elevated temperatures. Inherent lattice distortions are …
Local order in AgAuCuPdPt high-entropy alloy surfaces
HH Kristoffersen, J Rossmeisl - The Journal of Physical Chemistry …, 2022 - ACS Publications
Synthesis of high-entropy alloys often involves heating precursors to above 1000° C such
that entropy stabilization takes effect. The resulting alloys are characterized by random …
that entropy stabilization takes effect. The resulting alloys are characterized by random …
Characterization of nucleation behavior in temperature-induced BCC-to-HCP phase transformation for high entropy alloy
Phase transformation is one of the essential topics in the studies on high entropy alloys
(HEAs). However, characterization of the nucleation behavior in the phase transformation for …
(HEAs). However, characterization of the nucleation behavior in the phase transformation for …
First-principles approaches and models for crystal defect energetics in metallic alloys
YJ Hu - Computational Materials Science, 2023 - Elsevier
Many physical and mechanical properties of metallic alloys are sensitive to the formation
and migration of crystal defects such as vacancies, dislocations, stacking faults, and grain …
and migration of crystal defects such as vacancies, dislocations, stacking faults, and grain …
Training sets based on uncertainty estimates in the cluster-expansion method
Cluster expansion (CE) has gained an increasing level of popularity in recent years, and its
applications go far beyond its original root in binary alloys, reaching even complex …
applications go far beyond its original root in binary alloys, reaching even complex …
[HTML][HTML] Competition between phase ordering and phase segregation in the TixNbMoTaW and TixVNbMoTaW refractory high-entropy alloys
CD Woodgate, JB Staunton - Journal of Applied Physics, 2024 - pubs.aip.org
Refractory high-entropy alloys are under consideration for applications where materials are
subjected to high temperatures and levels of radiation, such as in the fusion power sector …
subjected to high temperatures and levels of radiation, such as in the fusion power sector …
Investigating the hydroxyl reorientation in hydroxyapatite using machine learning potentials
J Wang, X Wang, H Zhu, D Xu - The Journal of Physical Chemistry …, 2023 - ACS Publications
The chain or network of hydroxyl groups (OH–) is crucial in determining the structure and
function of materials, especially in hydroxyapatite (HAP), a mineral essential for human …
function of materials, especially in hydroxyapatite (HAP), a mineral essential for human …