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Nonmyopic Bayesian process optimization with a finite budget
Jose Luis Pitarch, Leopoldo Armesto, Antonio Sala
July 11, 2025 (v1)
Subject: Optimization
Optimization under uncertainty is inherent to many PSE applications ranging from process design to RTO. Reaching process true optima often involves learning from experimentation, but actual experiments involve a cost (economic, resources, time) and a budget limit usually exists. Finding the best trade-off on cumulative process performance and experimental cost over a finite budget is a Partially Observable Markov Decision Process (POMDP), known to be computationally intractable. This paper follows the nonmyopic Bayesian optimization (BO) approximation to POMDPs developed by the machine-learning community, that naturally enables the use of hybrid plant surrogate models formed by fundamental laws and Gaussian processes (GP). Although nonmyopic BO using GPs may look more tractable, evaluating multi-step decision trees to find the best first-stage candidate action to apply is still expensive with evolutionary or NLP optimizers. Hence, we propose modelling the value function of the first-st... [more]
A Data-Driven Conceptual Approach to Heat Pump Sizing in Chemical Processes with Fluctuating Heat Supply and Demand
Thorben Hochhaus, Johannes Wloch, Marcus Grünewald, Julia Riese
June 27, 2025 (v1)
Heat pumps play a crucial role in decarbonizing the chemical industry. The integration and sizing of heat pumps in chemical processes is a challenging task in multi-product chemical processes due to the fluctuating waste heat supply and heat demand. Integrating heat pumps may require a retrofit of the utility system. Mathematical optimization is a useful tool to tackle this challenge by enabling the analysis of correlation between relevant system parameters and equipment sizing. This study demonstrates the utilization of mathematical optimization and parameter studies for utility system equipment sizing addressing fluctuating heat supply and demand profiles.
A Data-Driven Conceptual Approach to Heat Pump Sizing in Chemical Processes with Fluctuating Heat Supply and Demand - Supplementary Material
Thorben Hochhaus, Johannes Wloch, Marcus Grünewald, Julia Riese
January 28, 2025 (v1)
This document contains digital supplementary material (detailed model description, parameters for different case studies and figure of exemplary waste heat supply and heat demand) related to the article "A Data-Driven Conceptual Approach to Heat Pump Sizing in Chemical Processes with Fluctuating Heat Supply and Demand" which is submitted to the peer reviewed conference proceeding of the 35th European Symposium on Computer Aided Process Engineering (ESCAPE 35).
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