Yeardley, A.S. orcid.org/0000-0001-7996-0589, Bellinghausen, S., Milton, R. et al. (2 more authors) (2021) Efficient global sensitivity-based model calibration of a high-shear wet granulation process. Chemical Engineering Science, 238. 116569. ISSN 0009-2509
Abstract
Model-driven design requires a well-calibrated model and therefore needs efficient workflows to achieve this. This efficiency can be achieved with the identification of the critical process parameters (CPPs) and the most impactful modelling parameters followed by a targeted experimental campaign to prioritise the calibration of these. To identify these parameters it is essential to perform a global sensitivity analysis (GSA).
Here, an efficient GSA is applied to a wet granulation case study with the Sobol’ indices used to identify the CPPs and impactful modelling parameters. The population balance, mechanistic model that is used requires considerable computational effort for a GSA so a Gaussian Process surrogate is utilised to interrogate the underlying model. These key results reduce the input-space by 80% enabling the proposal of a targeted experimental design and model calibration workflow. This substantially improves the ability to deploy model-based design to determine the impactful parameter values, reducing the experimental effort by 42.1% compared to a conventional experimental design.
Metadata
Item Type: | Article |
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Authors/Creators: |
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Copyright, Publisher and Additional Information: | © 2021 Elsevier. This is an author produced version of a paper subsequently published in Chemical Engineering Science. Uploaded in accordance with the publisher's self-archiving policy. Article available under the terms of the CC-BY-NC-ND licence (https://creativecommons.org/licenses/by-nc-nd/4.0/). |
Keywords: | Gaussian Process; Sobol’ Indices; Global Sensitivity Analysis; Model Calibration; Granulation; Experimental Design |
Dates: |
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Institution: | The University of Sheffield |
Academic Units: | The University of Sheffield > Faculty of Engineering (Sheffield) > Department of Chemical and Biological Engineering (Sheffield) |
Funding Information: | Funder Grant number F. Hoffmann-la Roche Ltd N/A |
Depositing User: | Symplectic Sheffield |
Date Deposited: | 12 Mar 2021 08:30 |
Last Modified: | 11 Mar 2022 01:38 |
Status: | Published |
Publisher: | Elsevier |
Refereed: | Yes |
Identification Number: | 10.1016/j.ces.2021.116569 |
Open Archives Initiative ID (OAI ID): | oai:eprints.whiterose.ac.uk:171834 |
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Filename: Wet Granulation Calibration - Clean Version.pdf
Licence: CC-BY-NC-ND 4.0