Microstructures and properties of high-entropy alloys

Y Zhang, TT Zuo, Z Tang, MC Gao, KA Dahmen… - Progress in materials …, 2014 - Elsevier
This paper reviews the recent research and development of high-entropy alloys (HEAs).
HEAs are loosely defined as solid solution alloys that contain more than five principal …

Computational thermodynamics and its applications

ZK Liu - Acta Materialia, 2020 - Elsevier
Thermodynamics is a science concerning the state of a system, whether it is stable,
metastable or unstable, when interacting with the surroundings. In this overview …

Diffusion coefficients of alloying elements in dilute Mg alloys: A comprehensive first-principles study

BC Zhou, SL Shang, Y Wang, ZK Liu - Acta Materialia, 2016 - Elsevier
First-principles calculations based on density functional theory have been used to calculate
the temperature-dependent dilute tracer diffusion coefficients for 47 substitutional alloying …

First-principles analysis of solute diffusion in dilute bcc Fe- alloys

CD Versteylen, NH Van Dijk, MHF Sluiter - Physical review B, 2017 - APS
The diffusivities of substitutional impurity elements in iron have been computed with ab inito
electronic density functional techniques, using exchange-correlation functional PW91 …

A comprehensive first-principles study of solute elements in dilute Ni alloys: Diffusion coefficients and their implications to tailor creep rate

CZ Hargather, SL Shang, ZK Liu - Acta Materialia, 2018 - Elsevier
Diffusion regulates a vast number of materials properties and phenomena such as creep,
the focus of the present work. However, a deep understanding of the effect of how each …

New design aspects of creep-resistant NiAl-strengthened ferritic alloys

Z Sun, CH Liebscher, S Huang, Z Teng, G Song… - Scripta Materialia, 2013 - Elsevier
Ferritic alloys strengthened with NiAl precipitates are being developed for elevated-
temperature applications. Due to the high concentration of Al in these alloys, they feature a …

First-principles study of the effects of solutes on long-range order degree, self-diffusions and antiphase boundary energies in ordered FeCo alloy

Y Li, D Yang, W Qiang - Journal of Magnetism and Magnetic Materials, 2022 - Elsevier
The brittleness of FeCo alloy is generally caused by the B2 ordering behaviors. Alloying
elements V, Nb, Ta, Mo and W were experimentally found to be effective in improving the …

[HTML][HTML] Nano-sized precipitate stability and its controlling factors in a NiAl-strengthened ferritic alloy

Z Sun, G Song, J Ilavsky, G Ghosh, PK Liaw - Scientific reports, 2015 - nature.com
Coherent B2-ordered NiAl-type precipitates have been used to reinforce solid-solution body-
centered-cubic iron for high-temperature application in fossil-energy power plants. In this …

A strategy for designing stable nanocrystalline alloys by thermo-kinetic synergy

HR Peng, BS Liu, F Liu - Journal of Materials Science & Technology, 2020 - Elsevier
Aiming to design stable nanocrystalline (NC) materials, so far, it has been proposed to
construct nanostructure stability maps in terms of thermodynamic parameters, while kinetic …

Diffusion of Co, Ru and Re in Ni-based superalloys: a first-principles study

X Zhang, H Deng, S Xiao, Z Zhang, J Tang… - Journal of alloys and …, 2014 - Elsevier
Self and impurity diffusivities in Ni-based superalloys have been investigated by first-
principles calculations within five-frequency model. The vacancy formation energy, migration …