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Research PaperResearchia:202604.27061

Iterative Model-Learning Scheme via Gaussian Processes for Nonlinear Model Predictive Control of (Semi-)Batch Processes

Tai Xuan Tan

Abstract

Batch processes are inherently transient and typically nonlinear, motivating nonlinear model predictive control (NMPC). However, adopting NMPC is hindered by the cost and unavailability of dynamic models. Thus, we propose to use Gaussian Processes (GP) in a model-learning NMPC scheme (GP-MLMPC) for batch processes. We initialize the GP-MLMPC using data from a single initial trajectory, e.g., from a PI controller. We iteratively apply the NMPC embedded with GPs to run batches and update the GP wi...

Submitted: April 27, 2026Subjects: Machine Learning; Data Science

Description / Details

Batch processes are inherently transient and typically nonlinear, motivating nonlinear model predictive control (NMPC). However, adopting NMPC is hindered by the cost and unavailability of dynamic models. Thus, we propose to use Gaussian Processes (GP) in a model-learning NMPC scheme (GP-MLMPC) for batch processes. We initialize the GP-MLMPC using data from a single initial trajectory, e.g., from a PI controller. We iteratively apply the NMPC embedded with GPs to run batches and update the GP with new observations from each iteration, thereby achieving batch-wise improvements. Using uncertainty quantification from the GPs, we formulate chance constraints to enforce safe operation to the required confidence levels. We demonstrate our approach in \textit{silico} on a semi-batch polymerization reactor for tracking and economic objectives over durations of two hours, and the reactor temperature is constrained in a range of ±2C\pm2^\circ C around its setpoint. After only four batch iterations, tracking error from the GP-MLMPC scheme converged to a reduction of 83%83\%, compared to the initial trajectory. Furthermore, under an economic objective, the GP-MLMPC resulted in a 17-fold increase in final product mass by iteration 8, compared to the initial trajectory. In both cases, the resulting GP-MLMPC performance is on par with the full-model NMPC, which shows that the optimal controller can be learned by the approach. By collecting samples around the optimal trajectory, the GP-MLMPC remains sample-efficient across iterations and achieves quick convergence. Thus, the proposed GP-MLMPC scheme presents a promising data-efficient approach for the control of nonlinear batch processes without mechanistic knowledge.


Source: arXiv:2604.22672v1 - http://arxiv.org/abs/2604.22672v1 PDF: https://arxiv.org/pdf/2604.22672v1 Original Link: http://arxiv.org/abs/2604.22672v1

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Submission Info
Date:
Apr 27, 2026
Topic:
Data Science
Area:
Machine Learning
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