Enhancing the interpretability of spatially variable N2O model predictions with soft sensors during wastewater treatment

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Main Authors: Gahrouei, Mohammad Raeisi, Ramin, Pedram, Riggio, Vincenzo A., Domingo-Felez, Carlos
Format: Preprint
Published: 2026
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author Gahrouei, Mohammad Raeisi
Ramin, Pedram
Riggio, Vincenzo A.
Domingo-Felez, Carlos
author_facet Gahrouei, Mohammad Raeisi
Ramin, Pedram
Riggio, Vincenzo A.
Domingo-Felez, Carlos
contents Model-based solutions for nitrous oxide (N2O) emissions from wastewater treatment plants (WWTP) are informed by operational datasets designed to control nutrient levels in liquid waste, coupled with dedicated campaigns for N2O measurements. We analysed how machine learning (ML) models predict disturbances to WWT operation and spatially variable N2O emissions. A real dataset was investigated to validate the modelling framework from N2O emissions predicted by four ML models (R2 = 0.79 - 0.89). Monitoring campaigns for N2O were simulated with a plant-wide mechanistic model to include additional sensors, site-level N2O datasets, and wastewater disturbances (n = 16). ML models were highly accurate (0.97 +- 0.02, n = 80), but the feature importance depended on the model, the scenario and the N2O measurement scale (reactor vs. WWTP). We argue that N2O soft sensor model predictions are limited to the measuring location and the methodological uncertainty of the dataset, which affect the interpretability of the model. Lastly, the analysis of the mechanistic model structure exposed interactions between autotrophic and heterotrophic pathways over nitric oxide which can overestimate aerobic nitrite production and bias the N2O pathway contributions.
format Preprint
id arxiv_https___arxiv_org_abs_2605_04082
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Enhancing the interpretability of spatially variable N2O model predictions with soft sensors during wastewater treatment
Gahrouei, Mohammad Raeisi
Ramin, Pedram
Riggio, Vincenzo A.
Domingo-Felez, Carlos
Machine Learning
Model-based solutions for nitrous oxide (N2O) emissions from wastewater treatment plants (WWTP) are informed by operational datasets designed to control nutrient levels in liquid waste, coupled with dedicated campaigns for N2O measurements. We analysed how machine learning (ML) models predict disturbances to WWT operation and spatially variable N2O emissions. A real dataset was investigated to validate the modelling framework from N2O emissions predicted by four ML models (R2 = 0.79 - 0.89). Monitoring campaigns for N2O were simulated with a plant-wide mechanistic model to include additional sensors, site-level N2O datasets, and wastewater disturbances (n = 16). ML models were highly accurate (0.97 +- 0.02, n = 80), but the feature importance depended on the model, the scenario and the N2O measurement scale (reactor vs. WWTP). We argue that N2O soft sensor model predictions are limited to the measuring location and the methodological uncertainty of the dataset, which affect the interpretability of the model. Lastly, the analysis of the mechanistic model structure exposed interactions between autotrophic and heterotrophic pathways over nitric oxide which can overestimate aerobic nitrite production and bias the N2O pathway contributions.
title Enhancing the interpretability of spatially variable N2O model predictions with soft sensors during wastewater treatment
topic Machine Learning
url https://arxiv.org/abs/2605.04082