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

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...

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Main Author: Surika van Wyk
Format: Article
Language:English
Published: Elsevier 2025-03-01
Series:Chemical Engineering Journal Advances
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2666821124001169
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author Surika van Wyk
author_facet Surika van Wyk
author_sort Surika van Wyk
collection DOAJ
description 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 & R2 = 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 & R2 = 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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institution Kabale University
issn 2666-8211
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spelling doaj-art-ec6d46ced3ea4520ad55adb9ce76a8832025-02-03T04:17:03ZengElsevierChemical Engineering Journal Advances2666-82112025-03-0121100699Development of a novel physics-informed machine learning model for advanced thermochemical waste conversionSurika van Wyk0Biobased and Circular Technology Group, Energy & Materials Transition Unit, The Netherlands Organization for Applied Scientific Research (TNO), Petten, the NetherlandsA 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 & R2 = 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 & R2 = 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.http://www.sciencedirect.com/science/article/pii/S2666821124001169Physics-informedMachine learningFluidized bedBiomassPlasticsWaste
spellingShingle Surika van Wyk
Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
Chemical Engineering Journal Advances
Physics-informed
Machine learning
Fluidized bed
Biomass
Plastics
Waste
title Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
title_full Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
title_fullStr Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
title_full_unstemmed Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
title_short Development of a novel physics-informed machine learning model for advanced thermochemical waste conversion
title_sort development of a novel physics informed machine learning model for advanced thermochemical waste conversion
topic Physics-informed
Machine learning
Fluidized bed
Biomass
Plastics
Waste
url http://www.sciencedirect.com/science/article/pii/S2666821124001169
work_keys_str_mv AT surikavanwyk developmentofanovelphysicsinformedmachinelearningmodelforadvancedthermochemicalwasteconversion