Toward autonomous laboratories: Convergence of artificial intelligence and experimental automation
The ever-increasing demand for novel materials with superior properties inspires retrofitting
traditional research paradigms in the era of artificial intelligence and automation. An …
traditional research paradigms in the era of artificial intelligence and automation. An …
Dimensionality reduction in surrogate modeling: A review of combined methods
Surrogate modeling has been popularized as an alternative to full-scale models in complex
engineering processes such as manufacturing and computer-assisted engineering. The …
engineering processes such as manufacturing and computer-assisted engineering. The …
Beyond playing 20 questions with nature: Integrative experiment design in the social and behavioral sciences
The dominant paradigm of experiments in the social and behavioral sciences views an
experiment as a test of a theory, where the theory is assumed to generalize beyond the …
experiment as a test of a theory, where the theory is assumed to generalize beyond the …
Auto-MatRegressor: liberating machine learning alchemists
Y Liu, S Wang, Z Yang, M Avdeev, S Shi - Science Bulletin, 2023 - Elsevier
Abstract Machine learning (ML) is widely used to uncover structure–property relationships of
materials due to its ability to quickly find potential data patterns and make accurate …
materials due to its ability to quickly find potential data patterns and make accurate …
Active learning for prediction of tensile properties for material extrusion additive manufacturing
Abstract Machine learning techniques were used to predict tensile properties of material
extrusion-based additively manufactured parts made with Technomelt PA 6910, a hot melt …
extrusion-based additively manufactured parts made with Technomelt PA 6910, a hot melt …
Benchmarking AutoML for regression tasks on small tabular data in materials design
F Conrad, M Mälzer, M Schwarzenberger, H Wiemer… - Scientific Reports, 2022 - nature.com
Abstract Machine Learning has become more important for materials engineering in the last
decade. Globally, automated machine learning (AutoML) is growing in popularity with the …
decade. Globally, automated machine learning (AutoML) is growing in popularity with the …
[HTML][HTML] Imprecise bayesian optimization
Bayesian optimization (BO) with Gaussian processes (GPs) surrogate models is widely used
to optimize analytically unknown and expensive-to-evaluate functions. In this paper, we …
to optimize analytically unknown and expensive-to-evaluate functions. In this paper, we …
The future of material scientists in an age of artificial intelligence
Material science has historically evolved in tandem with advancements in technologies for
characterization, synthesis, and computation. Another type of technology to add to this mix is …
characterization, synthesis, and computation. Another type of technology to add to this mix is …
The role of machine learning in perovskite solar cell research
Over the last few years there has been an increasing number of papers using machine
learning (ML) as a tool to aid research directed towards perovskite solar cells. This review …
learning (ML) as a tool to aid research directed towards perovskite solar cells. This review …
Explainability and human intervention in autonomous scanning probe microscopy
The broad adoption of machine learning (ML)-based autonomous experiments (AEs) in
material characterization and synthesis requires strategies development for understanding …
material characterization and synthesis requires strategies development for understanding …