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[HTML][HTML] Ab initio phase stabilities and mechanical properties of multicomponent alloys: A comprehensive review for high entropy alloys and compositionally complex …
Multicomponent alloys with multiple principal elements including high entropy alloys (HEAs)
and compositionally complex alloys (CCAs) are attracting rapidly growing attention. The …
and compositionally complex alloys (CCAs) are attracting rapidly growing attention. The …
A quinary WTaCrVHf nanocrystalline refractory high-entropy alloy withholding extreme irradiation environments
In the quest of new materials that can withstand severe irradiation and mechanical extremes
for advanced applications (eg. fission & fusion reactors, space applications, etc.), design …
for advanced applications (eg. fission & fusion reactors, space applications, etc.), design …
Outstanding radiation resistance of tungsten-based high-entropy alloys
A body-centered cubic W-based refractory high entropy alloy with outstanding radiation
resistance has been developed. The alloy was grown as thin films showing a bimodal grain …
resistance has been developed. The alloy was grown as thin films showing a bimodal grain …
Cluster expansion method and its application in computational materials science
Q Wu, B He, T Song, J Gao, S Shi - Computational Materials Science, 2016 - Elsevier
As an approximate computation method, cluster expansion is a power series expansion of
the partition function, which was proposed by Mayer in 1941. In computational materials …
the partition function, which was proposed by Mayer in 1941. In computational materials …
Defect energetics of concentrated solid-solution alloys from ab initio calculations: Ni 0.5 Co 0.5, Ni 0.5 Fe 0.5, Ni 0.8 Fe 0.2 and Ni 0.8 Cr 0.2
It has been shown that concentrated solid solution alloys possess unusual electronic,
magnetic, transport, mechanical and radiation-resistant properties that are directly related to …
magnetic, transport, mechanical and radiation-resistant properties that are directly related to …
Short-range order in high entropy alloys: theoretical formulation and application to Mo-Nb-Ta-VW system
A Fernández-Caballero, JS Wróbel… - Journal of Phase …, 2017 - Springer
In high-entropy alloys (HEAs), the local chemical fluctuations from disordered solute solution
state into segregation, precipitation and ordering configurations are complex due to the …
state into segregation, precipitation and ordering configurations are complex due to the …
Multi-scale investigation of short-range order and dislocation glide in MoNbTi and TaNbTi multi-principal element alloys
Refractory multi-principal element alloys (RMPEAs) are promising materials for high-
temperature structural applications. Here, we investigate the role of short-range ordering …
temperature structural applications. Here, we investigate the role of short-range ordering …
Enhanced activity for hydrogen evolution reaction over CoFe catalysts by alloying with small amount of Pt
The hydrogen evolution reaction highly relied on Pt electrocatalysts, with high activity and
stability. In the past few years, a host of efforts have been made in the development of novel …
stability. In the past few years, a host of efforts have been made in the development of novel …
Competition between long-and short-range order in size-mismatched medium-entropy alloys
Chemical short-range order (SRO) is known to alter a wide array of alloy properties. Here,
we investigate the SRO of binary and ternary alloys in the Cr–Mo–W system using density …
we investigate the SRO of binary and ternary alloys in the Cr–Mo–W system using density …
Vacancy formation enthalpies of high-entropy FeCoCrNi alloy via first-principles calculations and possible implications to its superior radiation tolerance
W Chen, X Ding, Y Feng, X Liu, K Liu, ZP Lu… - Journal of Materials …, 2018 - Elsevier
Because atoms in high-entropy alloys (HEAs) coordinate in very different and distorted local
environments in the lattice sites, even for the same type of constituent, their point defects …
environments in the lattice sites, even for the same type of constituent, their point defects …