[HTML][HTML] Fundamental design strategies for advancing the development of high entropy alloys for thermo-mechanical application: A critical review
Nearly three decades since the discovery of high entropy alloys (HEAs), it has greeted a
broad interest in the field of materials research as a better alternative to conventional alloy …
broad interest in the field of materials research as a better alternative to conventional alloy …
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 …
metastable or unstable, when interacting with the surroundings. In this overview …
Thermodynamics and its prediction and CALPHAD modeling: Review, state of the art, and perspectives
ZK Liu - Calphad, 2023 - Elsevier
Thermodynamics is a science concerning the state of a system, whether it is stable,
metastable, or unstable, when interacting with its surroundings. The combined law of …
metastable, or unstable, when interacting with its surroundings. The combined law of …
ESPEI for efficient thermodynamic database development, modification, and uncertainty quantification: application to Cu–Mg
The software package ESPEI has been developed for efficient evaluation of thermodynamic
model parameters within the CALPHAD method. ESPEI uses a linear fitting strategy to …
model parameters within the CALPHAD method. ESPEI uses a linear fitting strategy to …
Genomic materials design: calculation of phase dynamics
GB Olson, ZK Liu - Calphad, 2023 - Elsevier
The CALPHAD system of fundamental phase-level databases, now known as the Materials
Genome, has enabled a mature technology of computational materials design and …
Genome, has enabled a mature technology of computational materials design and …
Uncertainty quantification and propagation in computational materials science and simulation-assisted materials design
P Honarmandi, R Arróyave - Integrating Materials and Manufacturing …, 2020 - Springer
Significant advances in theory, simulation tools, advanced computing infrastructure, and
experimental frameworks have enabled the field of materials science to become …
experimental frameworks have enabled the field of materials science to become …
High-throughput determination of high-quality interdiffusion coefficients in metallic solids: a review
Accurate interdiffusion coefficients of composition and temperature dependence are
significantly important for understanding different materials processes. However, the high …
significantly important for understanding different materials processes. However, the high …
Thermodynamic properties of the Nd-Bi system via emf measurements, DFT calculations, machine learning, and CALPHAD modeling
Thermodynamic properties of the Nd-Bi system were investigated using a combination of
experimental measurements, first-principles calculations based on density functional theory …
experimental measurements, first-principles calculations based on density functional theory …
A novel computational framework for establishment of atomic mobility database directly from composition profiles and its uncertainty quantification
In this work, a novel computational framework for establishment of atomic mobility database
directly from the experimental composition profiles and its uncertainty quantification was …
directly from the experimental composition profiles and its uncertainty quantification was …