From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks

<p>Greywater, a valuable resource in water-scarce regions, contains organic micropollutants (OMPs) from household chemicals, pharmaceuticals and personal care products. Ozonation is a promising technology for removing these OMPs, enabling the safe reuse of treated greywater (TGW) for irrigatio...

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Main Author: Jasir Jawad (17191468) (author)
Other Authors: Simjo Simson (17191471) (author), Mohammad Wasim Aktar (22803959) (author), Tricia Alcantara Gomez (22303372) (author), Jayaprakash Saththasivam (14151669) (author)
Published: 2025
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_version_ 1864513532022751232
author Jasir Jawad (17191468)
author2 Simjo Simson (17191471)
Mohammad Wasim Aktar (22803959)
Tricia Alcantara Gomez (22303372)
Jayaprakash Saththasivam (14151669)
author2_role author
author
author
author
author_facet Jasir Jawad (17191468)
Simjo Simson (17191471)
Mohammad Wasim Aktar (22803959)
Tricia Alcantara Gomez (22303372)
Jayaprakash Saththasivam (14151669)
author_role author
dc.creator.none.fl_str_mv Jasir Jawad (17191468)
Simjo Simson (17191471)
Mohammad Wasim Aktar (22803959)
Tricia Alcantara Gomez (22303372)
Jayaprakash Saththasivam (14151669)
dc.date.none.fl_str_mv 2025-09-18T15:00:00Z
dc.identifier.none.fl_str_mv 10.1016/j.cep.2025.110542
dc.relation.none.fl_str_mv https://figshare.com/articles/journal_contribution/From_lab_to_pilot_Predicting_and_validating_caffeine_and_DEET_removal_from_treated_greywater_using_response_surface_methodology_and_artificial_neural_networks/30819947
dc.rights.none.fl_str_mv CC BY 4.0
info:eu-repo/semantics/openAccess
dc.subject.none.fl_str_mv Engineering
Environmental engineering
Environmental sciences
Environmental management
Ozonation
Greywater
Artificial neural network
Caffeine
DEET
dc.title.none.fl_str_mv From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
dc.type.none.fl_str_mv Text
Journal contribution
info:eu-repo/semantics/publishedVersion
text
contribution to journal
description <p>Greywater, a valuable resource in water-scarce regions, contains organic micropollutants (OMPs) from household chemicals, pharmaceuticals and personal care products. Ozonation is a promising technology for removing these OMPs, enabling the safe reuse of treated greywater (TGW) for irrigation. In this study, TGW was analyzed and found to contain high levels of caffeine and N, N‑diethyl‑meta-toluamide (DEET). Laboratory-scale ozonation experiments were conducted using the Box-Behnken design, varying ozone dosage, dissolved organic carbon (DOC), and pollutant concentrations. Response surface methodology (RSM) and artificial neural network (ANN) models were developed to examine the effects of these variables and to compare the prediction of removal efficiency (RE) for these compounds. The models were validated with pilot-scale ozonation experiments using treated greywater. The ANN model was more effective than RSM in predicting caffeine RE, while both models showed comparable performance for DEET, with RSM yielding lower relative errors. Sensitivity analysis revealed that caffeine RE was most influenced by its initial concentration, whereas DEET RE was primarily affected by DOC levels, followed by ozone dosage. The pilot study results indicated an effective removal efficiency of caffeine (80 %) and DEET (91 %) at an ozone dosage of 2 mg/L. The ANN model demonstrated better prediction and trend capturing than the RSM model when subjected to pilot-scale data. The study demonstrated that models developed from lab-scale data, particularly ANN, can be effectively applied to design, optimize, and control pilot-scale ozonation experiments.</p><h2>Other Information</h2> <p> Published in: Chemical Engineering and Processing - Process Intensification<br> License: <a href="http://creativecommons.org/licenses/by/4.0/" target="_blank">http://creativecommons.org/licenses/by/4.0/</a><br>See article on publisher's website: <a href="https://dx.doi.org/10.1016/j.cep.2025.110542" target="_blank">https://dx.doi.org/10.1016/j.cep.2025.110542</a></p>
eu_rights_str_mv openAccess
id Manara2_c8f4410d0f711139ee69a60e88f17b59
identifier_str_mv 10.1016/j.cep.2025.110542
network_acronym_str Manara2
network_name_str Manara2
oai_identifier_str oai:figshare.com:article/30819947
publishDate 2025
repository.mail.fl_str_mv
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rights_invalid_str_mv CC BY 4.0
spelling From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networksJasir Jawad (17191468)Simjo Simson (17191471)Mohammad Wasim Aktar (22803959)Tricia Alcantara Gomez (22303372)Jayaprakash Saththasivam (14151669)EngineeringEnvironmental engineeringEnvironmental sciencesEnvironmental managementOzonationGreywaterArtificial neural networkCaffeineDEET<p>Greywater, a valuable resource in water-scarce regions, contains organic micropollutants (OMPs) from household chemicals, pharmaceuticals and personal care products. Ozonation is a promising technology for removing these OMPs, enabling the safe reuse of treated greywater (TGW) for irrigation. In this study, TGW was analyzed and found to contain high levels of caffeine and N, N‑diethyl‑meta-toluamide (DEET). Laboratory-scale ozonation experiments were conducted using the Box-Behnken design, varying ozone dosage, dissolved organic carbon (DOC), and pollutant concentrations. Response surface methodology (RSM) and artificial neural network (ANN) models were developed to examine the effects of these variables and to compare the prediction of removal efficiency (RE) for these compounds. The models were validated with pilot-scale ozonation experiments using treated greywater. The ANN model was more effective than RSM in predicting caffeine RE, while both models showed comparable performance for DEET, with RSM yielding lower relative errors. Sensitivity analysis revealed that caffeine RE was most influenced by its initial concentration, whereas DEET RE was primarily affected by DOC levels, followed by ozone dosage. The pilot study results indicated an effective removal efficiency of caffeine (80 %) and DEET (91 %) at an ozone dosage of 2 mg/L. The ANN model demonstrated better prediction and trend capturing than the RSM model when subjected to pilot-scale data. The study demonstrated that models developed from lab-scale data, particularly ANN, can be effectively applied to design, optimize, and control pilot-scale ozonation experiments.</p><h2>Other Information</h2> <p> Published in: Chemical Engineering and Processing - Process Intensification<br> License: <a href="http://creativecommons.org/licenses/by/4.0/" target="_blank">http://creativecommons.org/licenses/by/4.0/</a><br>See article on publisher's website: <a href="https://dx.doi.org/10.1016/j.cep.2025.110542" target="_blank">https://dx.doi.org/10.1016/j.cep.2025.110542</a></p>2025-09-18T15:00:00ZTextJournal contributioninfo:eu-repo/semantics/publishedVersiontextcontribution to journal10.1016/j.cep.2025.110542https://figshare.com/articles/journal_contribution/From_lab_to_pilot_Predicting_and_validating_caffeine_and_DEET_removal_from_treated_greywater_using_response_surface_methodology_and_artificial_neural_networks/30819947CC BY 4.0info:eu-repo/semantics/openAccessoai:figshare.com:article/308199472025-09-18T15:00:00Z
spellingShingle From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
Jasir Jawad (17191468)
Engineering
Environmental engineering
Environmental sciences
Environmental management
Ozonation
Greywater
Artificial neural network
Caffeine
DEET
status_str publishedVersion
title From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
title_full From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
title_fullStr From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
title_full_unstemmed From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
title_short From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
title_sort From lab to pilot: Predicting and validating caffeine and DEET removal from treated greywater using response surface methodology and artificial neural networks
topic Engineering
Environmental engineering
Environmental sciences
Environmental management
Ozonation
Greywater
Artificial neural network
Caffeine
DEET