Accelerate the discovery of OCM catalysts with machine-learning and machine-synthesis

Oxidative coupling of methane (OCM) reaction is crucial for converting natural gas into value-added chemicals like ethylene. Despite the development of over 2000 catalysts, achieving a C2 (C2H4 + C2H6) yield of 30% necessary for industrial viability remains a great challenge. In recent years, the rapid advancement of artificial intelligence (AI) has brought new opportunities to address this issue: the integration of machine learning (M-L) facilitates the identification and optimization of catalyst compositions, while machine synthesis (M-S) enhances the efficiency of catalyst synthesis. This perspective discusses the recent advancements in OCM using M-L and M-S techniques, aiming to accelerate the discovery and identification the most efficient catalyst in a benchmarking study, and promote the industrial application of OCM reaction.

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Publication Details

Journal
Discover Catalysis.
Published
2025-12-08
DOI
https://doi.org/10.1007/s44344-025-00029-0
Primary Topic
Catalysis and Oxidation Reactions
Type
article
Field-Weighted Citation Impact
0.00

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article

Accelerate the discovery of OCM catalysts with machine-learning and machine-synthesis

Discover Catalysis.
Catalysis and Oxidation Reactions
article

Accelerate the discovery of OCM catalysts with machine-learning and machine-synthesis

article en

Abstract

Oxidative coupling of methane (OCM) reaction is crucial for converting natural gas into value-added chemicals like ethylene. Despite the development of over 2000 catalysts, achieving a C2 (C2H4 + C2H6) yield of 30% necessary for industrial viability remains a great challenge. In recent years, the rapid advancement of artificial intelligence (AI) has brought new opportunities to address this issue: the integration of machine learning (M-L) facilitates the identification and optimization of catalyst compositions, while machine synthesis (M-S) enhances the efficiency of catalyst synthesis. This perspective discusses the recent advancements in OCM using M-L and M-S techniques, aiming to accelerate the discovery and identification the most efficient catalyst in a benchmarking study, and promote the industrial application of OCM reaction.

Discover Catalysis.Vol. 2(1)
Zhejiang University of Technology (CN), Zhejiang University (CN)
National Natural Science Foundation of China, Zhejiang University, University of Science and Technology of China, National Key Research and Development Program of China
Industry, innovation and infrastructure
Openalex Percentile: Top 64%
Catalysis and Oxidation Reactions
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