Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion

• Various data-driven models developed and compared for indirect gasification. • Physics-informed machine learning model for predicting the outputs of gasification. • Significant improvement in carbon balance closure with 10 % physics contribution. • Model covers a wide range of feedstocks ranging from biomass-rich to plastics-rich. • Model gives insights into input feature importance for various products. A physics-informed machine learning (ML) model, which incorporates the conservation of carbon mass, was developed to predict the product gas yield and composition for indirect gasification of waste in a fluidized bed. A dataset was compiled from experimental data of an in-house reactor, encompassing a wide range of feedstocks characteristics (biomass to plastics) and process conditions, which served as input for the model. Four data-driven models were trained and evaluated, with the XGBoost model having the best predictive accuracy (RMSE = 1.1 & R 2 = 0.99) and being adapted for the physics-informed model. The optimum physics contribution was 30 % (70 % data contribution) to maintain predictive accuracy (RMSE = 2.7 & R 2 = 0.95) and improve carbon closure. Feedstock properties were shown to have a higher feature importance compared to the operating conditions. The developed physics-informed model demonstrated the potential of ML models for the modelling of gasification of various waste streams. This is a promising first step towards improving data-driven ML models for application to thermochemical systems.

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Publication Details

Journal
Chemical Engineering Journal Advances
Published
2024-12-22
DOI
https://doi.org/10.1016/j.ceja.2024.100699
Citations
6
Primary Topic
Iron and Steelmaking Processes
Type
article
Field-Weighted Citation Impact
1.28
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article

Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion

Surika van Wyk
6 citations
Chemical Engineering Journal Advances
Iron and Steelmaking Processes
1.28
article

Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion

Surika van Wyk
article en
6 citations

Abstract

• Various data-driven models developed and compared for indirect gasification. • Physics-informed machine learning model for predicting the outputs of gasification. • Significant improvement in carbon balance closure with 10 % physics contribution. • Model covers a wide range of feedstocks ranging from biomass-rich to plastics-rich. • Model gives insights into input feature importance for various products. A physics-informed machine learning (ML) model, which incorporates the conservation of carbon mass, was developed to predict the product gas yield and composition for indirect gasification of waste in a fluidized bed. A dataset was compiled from experimental data of an in-house reactor, encompassing a wide range of feedstocks characteristics (biomass to plastics) and process conditions, which served as input for the model. Four data-driven models were trained and evaluated, with the XGBoost model having the best predictive accuracy (RMSE = 1.1 & R 2 = 0.99) and being adapted for the physics-informed model. The optimum physics contribution was 30 % (70 % data contribution) to maintain predictive accuracy (RMSE = 2.7 & R 2 = 0.95) and improve carbon closure. Feedstock properties were shown to have a higher feature importance compared to the operating conditions. The developed physics-informed model demonstrated the potential of ML models for the modelling of gasification of various waste streams. This is a promising first step towards improving data-driven ML models for application to thermochemical systems.

Chemical Engineering Journal AdvancesVol. 21
Netherlands Organisation for Applied Scientific Research (NL)
Openalex Percentile: Top 22%
Iron and Steelmaking Processes
1.28
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