Multifunctional high-entropy materials
Entropy-related phase stabilization can allow compositionally complex solid solutions of
multiple principal elements. The massive mixing approach was originally introduced for …
multiple principal elements. The massive mixing approach was originally introduced for …
Navigating the Expansive Landscapes of Soft Materials: A User Guide for High-Throughput Workflows
EC Day, SS Chittari, MP Bogen, AS Knight - ACS Polymers Au, 2023 - ACS Publications
Synthetic polymers are highly customizable with tailored structures and functionality, yet this
versatility generates challenges in the design of advanced materials due to the size and …
versatility generates challenges in the design of advanced materials due to the size and …
A physics informed bayesian optimization approach for material design: application to NiTi shape memory alloys
D Khatamsaz, R Neuberger, AM Roy… - npj Computational …, 2023 - nature.com
The design of materials and identification of optimal processing parameters constitute a
complex and challenging task, necessitating efficient utilization of available data. Bayesian …
complex and challenging task, necessitating efficient utilization of available data. Bayesian …
Artificial intelligence (AI) workflow for catalyst design and optimization
NS Lai, YS Tew, X Zhong, J Yin, J Li… - Industrial & …, 2023 - ACS Publications
In the pursuit of novel catalyst development to address pressing environmental concerns
and energy demand, conventional design and optimization methods often fall short due to …
and energy demand, conventional design and optimization methods often fall short due to …
Multi-objective, multi-constraint high-throughput design, synthesis, and characterization of tungsten-containing refractory multi-principal element alloys
Refractory multi-principal element alloys (RMPEAs) have gained interest recently due to
their superior properties at elevated temperatures, including outstanding yield and ultimate …
their superior properties at elevated temperatures, including outstanding yield and ultimate …
Alloying effects on the transport properties of refractory high-entropy alloys
Additive Manufacturing (AM) has opened new frontiers for the design of refractory high-
entropy alloys (HEAs) for high-temperature applications. The thermal conductivity of the AM …
entropy alloys (HEAs) for high-temperature applications. The thermal conductivity of the AM …
Evolution-guided Bayesian optimization for constrained multi-objective optimization in self-driving labs
The development of automated high-throughput experimental platforms has enabled fast
sampling of high-dimensional decision spaces. To reach target properties efficiently, these …
sampling of high-dimensional decision spaces. To reach target properties efficiently, these …
Bayesian blacksmithing: discovering thermomechanical properties and deformation mechanisms in high-entropy refractory alloys
Finding alloys with specific design properties is challenging due to the large number of
possible compositions and the complex interactions between elements. This study …
possible compositions and the complex interactions between elements. This study …
Multi-principal element alloy discovery using directed energy deposition and machine learning
Multi-principal element alloys open large composition spaces for alloy development. The
large compositional space necessitates rapid synthesis and characterization to identify …
large compositional space necessitates rapid synthesis and characterization to identify …
MLMD: a programming-free AI platform to predict and design materials
J Ma, B Cao, S Dong, Y Tian, M Wang… - npj Computational …, 2024 - nature.com
Accelerating the discovery of advanced materials is crucial for modern industries,
aerospace, biomedicine, and energy. Nevertheless, only a small fraction of materials are …
aerospace, biomedicine, and energy. Nevertheless, only a small fraction of materials are …