Recent advances and applications of deep learning methods in materials science

K Choudhary, B DeCost, C Chen, A Jain… - npj Computational …, 2022 - nature.com
Deep learning (DL) is one of the fastest-growing topics in materials data science, with
rapidly emerging applications spanning atomistic, image-based, spectral, and textual data …

Machine learning for electrocatalyst and photocatalyst design and discovery

H Mai, TC Le, D Chen, DA Winkler… - Chemical …, 2022 - ACS Publications
Electrocatalysts and photocatalysts are key to a sustainable future, generating clean fuels,
reducing the impact of global warming, and providing solutions to environmental pollution …

Data-driven probabilistic machine learning in sustainable smart energy/smart energy systems: Key developments, challenges, and future research opportunities in the …

T Ahmad, R Madonski, D Zhang, C Huang… - … and Sustainable Energy …, 2022 - Elsevier
The current trend indicates that energy demand and supply will eventually be controlled by
autonomous software that optimizes decision-making and energy distribution operations …

Open catalyst 2020 (OC20) dataset and community challenges

L Chanussot, A Das, S Goyal, T Lavril, M Shuaibi… - Acs …, 2021 - ACS Publications
Catalyst discovery and optimization is key to solving many societal and energy challenges
including solar fuel synthesis, long-term energy storage, and renewable fertilizer production …

Artificial intelligence applied to battery research: hype or reality?

T Lombardo, M Duquesnoy, H El-Bouysidy… - Chemical …, 2021 - ACS Publications
This is a critical review of artificial intelligence/machine learning (AI/ML) methods applied to
battery research. It aims at providing a comprehensive, authoritative, and critical, yet easily …

Machine learning: an advanced platform for materials development and state prediction in lithium‐ion batteries

C Lv, X Zhou, L Zhong, C Yan, M Srinivasan… - Advanced …, 2022 - Wiley Online Library
Lithium‐ion batteries (LIBs) are vital energy‐storage devices in modern society. However,
the performance and cost are still not satisfactory in terms of energy density, power density …

Adsorption energy in oxygen electrocatalysis

J Zhang, HB Yang, D Zhou, B Liu - Chemical Reviews, 2022 - ACS Publications
Adsorption energy (AE) of reactive intermediate is currently the most important descriptor for
electrochemical reactions (eg, water electrolysis, hydrogen fuel cell, electrochemical …

Advancements in microwave absorption motivated by interdisciplinary research

Z Zhao, Y Qing, L Kong, H Xu, X Fan, J Yun… - Advanced …, 2024 - Wiley Online Library
Microwave absorption materials (MAMs) are originally developed for military purposes, but
have since evolved into versatile materials with promising applications in modern …

Machine learning for high performance organic solar cells: current scenario and future prospects

A Mahmood, JL Wang - Energy & environmental science, 2021 - pubs.rsc.org
Machine learning (ML) is a field of computer science that uses algorithms and techniques for
automating solutions to complex problems that are hard to program using conventional …

Machine learning for perovskite materials design and discovery

Q Tao, P Xu, M Li, W Lu - Npj computational materials, 2021 - nature.com
The development of materials is one of the driving forces to accelerate modern scientific
progress and technological innovation. Machine learning (ML) technology is rapidly …