Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture

Abstract Addressing climate change challenges by reducing greenhouse gas levels requires innovative adsorbent materials for clean energy applications. Recent progress in machine learning has stimulated technological breakthroughs in the discovery, design, and deployment of materials with potential f...

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Main Authors: Haoxin Mai, Tu C. Le, Dehong Chen, David A. Winkler, Rachel A. Caruso
Format: Article
Language:English
Published: Wiley 2022-12-01
Series:Advanced Science
Subjects:
Online Access:https://doi.org/10.1002/advs.202203899
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author Haoxin Mai
Tu C. Le
Dehong Chen
David A. Winkler
Rachel A. Caruso
author_facet Haoxin Mai
Tu C. Le
Dehong Chen
David A. Winkler
Rachel A. Caruso
author_sort Haoxin Mai
collection DOAJ
description Abstract Addressing climate change challenges by reducing greenhouse gas levels requires innovative adsorbent materials for clean energy applications. Recent progress in machine learning has stimulated technological breakthroughs in the discovery, design, and deployment of materials with potential for high‐performance and low‐cost clean energy applications. This review summarizes basic machine learning methods—data collection, featurization, model generation, and model evaluation—and reviews their use in the development of robust adsorbent materials. Key case studies are provided where these methods are used to accelerate adsorbent materials design and discovery, optimize synthesis conditions, and understand complex feature–property relationships. The review provides a concise resource for researchers wishing to use machine learning methods to rapidly develop effective adsorbent materials with a positive impact on the environment.
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spelling doaj.art-742059f150c04267a58b8e557d8f43ff2022-12-29T14:19:16ZengWileyAdvanced Science2198-38442022-12-01936n/an/a10.1002/advs.202203899Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas CaptureHaoxin Mai0Tu C. Le1Dehong Chen2David A. Winkler3Rachel A. Caruso4Applied Chemistry and Environmental Science School of Science STEM College RMIT University Melbourne Victoria 3001 AustraliaSchool of Engineering STEM College RMIT University GPO Box 2476 Melbourne Victoria 3001 AustraliaApplied Chemistry and Environmental Science School of Science STEM College RMIT University Melbourne Victoria 3001 AustraliaMonash Institute of Pharmaceutical Sciences Monash University Parkville VIC 3052 AustraliaApplied Chemistry and Environmental Science School of Science STEM College RMIT University Melbourne Victoria 3001 AustraliaAbstract Addressing climate change challenges by reducing greenhouse gas levels requires innovative adsorbent materials for clean energy applications. Recent progress in machine learning has stimulated technological breakthroughs in the discovery, design, and deployment of materials with potential for high‐performance and low‐cost clean energy applications. This review summarizes basic machine learning methods—data collection, featurization, model generation, and model evaluation—and reviews their use in the development of robust adsorbent materials. Key case studies are provided where these methods are used to accelerate adsorbent materials design and discovery, optimize synthesis conditions, and understand complex feature–property relationships. The review provides a concise resource for researchers wishing to use machine learning methods to rapidly develop effective adsorbent materials with a positive impact on the environment.https://doi.org/10.1002/advs.202203899covalent–organic frameworkshydrogenintermetallicsmetal–organic frameworksporous carbonsporous polymers networks
spellingShingle Haoxin Mai
Tu C. Le
Dehong Chen
David A. Winkler
Rachel A. Caruso
Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
Advanced Science
covalent–organic frameworks
hydrogen
intermetallics
metal–organic frameworks
porous carbons
porous polymers networks
title Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
title_full Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
title_fullStr Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
title_full_unstemmed Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
title_short Machine Learning in the Development of Adsorbents for Clean Energy Application and Greenhouse Gas Capture
title_sort machine learning in the development of adsorbents for clean energy application and greenhouse gas capture
topic covalent–organic frameworks
hydrogen
intermetallics
metal–organic frameworks
porous carbons
porous polymers networks
url https://doi.org/10.1002/advs.202203899
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