Machine learning framework for prediction of plasma-based carbon dioxide conversion: Balancing computational efficiency with experimental efforts

• ML framework integrating literature and local data for CO 2 splitting prediction. • Hybrid model fine-tuned via random search/active learning achieves high accuracy. • Required experiments reduces by up to 38% using only 45–55 local data points. • Optimal experiment-to-literature data ratio (0.52–0.63) balances data efficiency. Plasma-based carbon dioxide (CO 2 ) conversion often involves interacting parameters and remains resource-intensive for experimental research. Machine learning (ML) presents a potential solution, but is limited by the scarcity of datasets. In this work, we develop an ML framework that integrates literature data with targeted local experiments to predict CO 2 conversion and energy efficiency in a dielectric barrier discharge (DBD) reactor. An artificial neural network (ANN) pre-trained on literature data showed good general alignment but poor accuracy for local experimental data. Subsequently, we iteratively refined a hybrid ANN model, by incorporating our local experimental data through via random search (RS) and active learning (AL). Although the RS-based hybrid model only selected 45 experimental data to achieve high predictive accuracy (R 2 > 0.95), thus reducing the planned experiments by 38%, AL-based model demonstrated superior robustness, achieving comparable accuracy with 55 data points and producing unbiased predictions. Such hybrid models also quantify the optimal ratio of adding experiment-to-literature data (0.52 – 0.63) to balance leveraging broad literature patterns and adapting to specific experimental features. This work provides new insights from coordinated datasets for balancing computational efficiency with experimental efforts, advancing ML-driven optimization in plasma-based CO 2 conversion.

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Publication Details

Journal
Energy Conversion and Management
Published
2026-03-05
DOI
https://doi.org/10.1016/j.enconman.2026.121210
Primary Topic
Plasma Applications and Diagnostics
Type
article
Field-Weighted Citation Impact
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article

Machine learning framework for prediction of plasma-based carbon dioxide conversion: Balancing computational efficiency with experimental efforts

Sirui. Li, Jiayin Li, Jiayi Xu, Fausto Gallucci et al.
Energy Conversion and Management
Plasma Applications and Diagnostics
article

Machine learning framework for prediction of plasma-based carbon dioxide conversion: Balancing computational efficiency with experimental efforts

Sirui. Li, Jiayin Li, Jiayi Xu, Fausto Gallucci, Giovanni Palma, A. Bogaerts
article en

Abstract

• ML framework integrating literature and local data for CO 2 splitting prediction. • Hybrid model fine-tuned via random search/active learning achieves high accuracy. • Required experiments reduces by up to 38% using only 45–55 local data points. • Optimal experiment-to-literature data ratio (0.52–0.63) balances data efficiency. Plasma-based carbon dioxide (CO 2 ) conversion often involves interacting parameters and remains resource-intensive for experimental research. Machine learning (ML) presents a potential solution, but is limited by the scarcity of datasets. In this work, we develop an ML framework that integrates literature data with targeted local experiments to predict CO 2 conversion and energy efficiency in a dielectric barrier discharge (DBD) reactor. An artificial neural network (ANN) pre-trained on literature data showed good general alignment but poor accuracy for local experimental data. Subsequently, we iteratively refined a hybrid ANN model, by incorporating our local experimental data through via random search (RS) and active learning (AL). Although the RS-based hybrid model only selected 45 experimental data to achieve high predictive accuracy (R 2 > 0.95), thus reducing the planned experiments by 38%, AL-based model demonstrated superior robustness, achieving comparable accuracy with 55 data points and producing unbiased predictions. Such hybrid models also quantify the optimal ratio of adding experiment-to-literature data (0.52 – 0.63) to balance leveraging broad literature patterns and adapting to specific experimental features. This work provides new insights from coordinated datasets for balancing computational efficiency with experimental efforts, advancing ML-driven optimization in plasma-based CO 2 conversion.

Energy Conversion and ManagementVol. 356
University of Antwerp (BE), Huazhong University of Science and Technology (CN), Eindhoven University of Technology (NL)
Openalex Percentile: Top 35%
Plasma Applications and Diagnostics
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