TY - JOUR
T1 - Incorporating first-principles information into hybrid modeling structures
T2 - Comparing hybrid semi-parametric models with Physics-Informed Recurrent Neural Networks
AU - Jul-Rasmussen, Peter
AU - Kumar, Monesh
AU - Pinto, Jóse
AU - Oliveira, Rui
AU - Liang, Xiaodong
AU - Huusom, Jakob Kjøbsted
N1 - info:eu-repo/grantAgreement/FCT/6817 - DCRRNI ID/UIDB%2F04378%2F2020/PT#
Funding Information:
The authors of this work acknowledge the efforts of students and staff at the department of Chemical and Biochemical Engineering, DTU, for making process data available that was generated during courses in experimental unit operations for training of the hybrid models. We would also like to express gratitude to the Novo Nordisk Foundation for funding the digital infrastructure of pilot facilities through grant NNF19SA0035474. This work was supported by the Applied Molecular Biosciences Unit - UCIBIO which is financed by national funds from FCT (UIDB/04378/2020). Rui Oliveira and Monesh Kumar acknowledge funding from the European Union's Horizon 2020 research and innovation program under grant agreement no. 101099487\u2014BioLaMer-HORIZON-EIC-2022-PATHFINDEROPEN-01 (BioLaMer)
Funding Information:
The authors of this work acknowledge the efforts of students and staff at the department of Chemical and Biochemical Engineering, DTU, for making process data available that was generated during courses in experimental unit operations for training of the hybrid models. We would also like to express gratitude to the Novo Nordisk Foundation for funding the digital infrastructure of pilot facilities through grant NNF19SA0035474 .
Funding Information:
This work was supported by the Applied Molecular Biosciences Unit - UCIBIO which is financed by national funds from FCT ( UIDB/04378/2020 ). Rui Oliveira and Monesh Kumar acknowledge funding from the European Union\u2019s Horizon 2020 research and innovation program under grant agreement no. 101099487\u2014BioLaMer-HORIZON-EIC-2022-PATHFINDEROPEN-01 (BioLaMer)
Publisher Copyright:
© 2025 The Authors
PY - 2025/8
Y1 - 2025/8
N2 - With increased data availability in the (bio)chemical processing industries, there is a renewed interest in leveraging data-based methods to improve process operations. While data-based approaches enable the modeling of phenomena that are difficult to model mechanistically, they also have drawbacks, especially when presented with serially correlated process data with low variation typically found in the process industries. The limitations in both mechanistic and data-based modeling can be addressed through hybrid approaches. The combination of mechanistic and data-based models into hybrid semi-parametric models has shown great promise in mitigating such limitations over the last 30 years. More recently, physics-informed learning approaches have been proposed as an alternative method for embedding process knowledge in data-based models. This work provides a comparative study of hybrid semi-parametric modeling and Physics-Informed Recurrent Neural Networks (PIRNNs) applied to a pilot-scale bubble column aeration case study. The developed models are compared based on the ease of training, the models’ adherence to the governing system equations, the prediction accuracy when reducing the measurement frequency, and the model performance when reducing the quantity of training data. For the considered case study, the hybrid semi-parametric modeling approach generally resulted in superior model performance with high prediction accuracy, good adherence to the physics, and good performance when reducing the quantity of training data.
AB - With increased data availability in the (bio)chemical processing industries, there is a renewed interest in leveraging data-based methods to improve process operations. While data-based approaches enable the modeling of phenomena that are difficult to model mechanistically, they also have drawbacks, especially when presented with serially correlated process data with low variation typically found in the process industries. The limitations in both mechanistic and data-based modeling can be addressed through hybrid approaches. The combination of mechanistic and data-based models into hybrid semi-parametric models has shown great promise in mitigating such limitations over the last 30 years. More recently, physics-informed learning approaches have been proposed as an alternative method for embedding process knowledge in data-based models. This work provides a comparative study of hybrid semi-parametric modeling and Physics-Informed Recurrent Neural Networks (PIRNNs) applied to a pilot-scale bubble column aeration case study. The developed models are compared based on the ease of training, the models’ adherence to the governing system equations, the prediction accuracy when reducing the measurement frequency, and the model performance when reducing the quantity of training data. For the considered case study, the hybrid semi-parametric modeling approach generally resulted in superior model performance with high prediction accuracy, good adherence to the physics, and good performance when reducing the quantity of training data.
KW - Adherence to physics
KW - Ease of training
KW - Hybrid modeling
KW - Hybrid semi-parametric modeling
KW - Physics-Informed Recurrent Neural Networks
UR - https://www.scopus.com/pages/publications/105002028929
UR - https://www.webofscience.com/wos/woscc/full-record/WOS:001489764700001
U2 - 10.1016/j.compchemeng.2025.109119
DO - 10.1016/j.compchemeng.2025.109119
M3 - Article
AN - SCOPUS:105002028929
SN - 0098-1354
VL - 199
SP - 1
EP - 14
JO - Computers and Chemical Engineering
JF - Computers and Chemical Engineering
M1 - 109119
ER -