Topology optimization for biocatalytic microreactor configurations

Ines Pereira Rosinha; Krist Gernaey; John Woodley; Ulrich Krühne

doi:10.1016/B978-0-444-63577-8.50089-9

Topology optimization for biocatalytic microreactor configurations

Ines Pereira Rosinha, Krist Gernaey, John Woodley, Ulrich Krühne

Department of Chemical and Biochemical Engineering

Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review

Abstract

The aim of this study is to present an innovative strategy for selecting a reactor for a specific process. Instead of adapting the process to a well-known reactor shape, a topology optimization method is used to obtain the best reactor configuration, and is applied to a biocatalyic reaction system as a case study. The Evolutionary Structure Optimization (ESO) method is applied using an interface between Matlab® and the computational fluid dynamic simulation software ANSYS CFX®. In the case study, theESO method is applied to optimize the spatial distribution of immobilized enzyme inside a microreactor. The results allow evaluating which regions in the microreactorhave more importance for the product formation. In fact, it was possible to simulate the improvement of the outlet product concentration per same amount of enzyme by modifying the spatial distribution of the immobilized enzyme.

Original language	English
Title of host publication	Proceedings of the 25th European Symposium on Computer Aided Process Engineering
Editors	Krist V. Gernaey, Jakob K. Huusom, Rafiqul Gani
Volume	37
Publisher	Elsevier
Publication date	2015
Pages	1463-1468
DOIs	https://doi.org/10.1016/B978-0-444-63577-8.50089-9
Publication status	Published - 2015
Event	25th European Symposium on Computer Aided Process Engineering : 12th International Symposium on Process Systems Engineering - Copenhagen, Denmark Duration: 31 May 2015 → 4 Jun 2015 http://www.pse2015escape25.dk/

Conference

Conference	25th European Symposium on Computer Aided Process Engineering
Country/Territory	Denmark
City	Copenhagen
Period	31/05/2015 → 04/06/2015
Internet address	http://www.pse2015escape25.dk/

Series	Computer Aided Chemical Engineering
ISSN	1570-7946

Keywords

Topology optimization
Biocatalysis
Immobilized enzymes
CFD

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10.1016/B978-0-444-63577-8.50089-9

Cite this

Pereira Rosinha, I., Gernaey, K., Woodley, J., & Krühne, U. (2015). Topology optimization for biocatalytic microreactor configurations. In K. V. Gernaey, J. K. Huusom, & R. Gani (Eds.), Proceedings of the 25th European Symposium on Computer Aided Process Engineering (Vol. 37, pp. 1463-1468). Elsevier. Computer Aided Chemical Engineering https://doi.org/10.1016/B978-0-444-63577-8.50089-9

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title = "Topology optimization for biocatalytic microreactor configurations",

abstract = "The aim of this study is to present an innovative strategy for selecting a reactor for a specific process. Instead of adapting the process to a well-known reactor shape, a topology optimization method is used to obtain the best reactor configuration, and is applied to a biocatalyic reaction system as a case study. The Evolutionary Structure Optimization (ESO) method is applied using an interface between Matlab{\textregistered} and the computational fluid dynamic simulation software ANSYS CFX{\textregistered}. In the case study, theESO method is applied to optimize the spatial distribution of immobilized enzyme inside a microreactor. The results allow evaluating which regions in the microreactorhave more importance for the product formation. In fact, it was possible to simulate the improvement of the outlet product concentration per same amount of enzyme by modifying the spatial distribution of the immobilized enzyme.",

keywords = "Topology optimization, Biocatalysis, Immobilized enzymes, CFD",

author = "{Pereira Rosinha}, Ines and Krist Gernaey and John Woodley and Ulrich Kr{\"u}hne",

year = "2015",

doi = "10.1016/B978-0-444-63577-8.50089-9",

language = "English",

volume = "37",

series = "Computer Aided Chemical Engineering",

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booktitle = "Proceedings of the 25th European Symposium on Computer Aided Process Engineering",

address = "United Kingdom",

note = "25th European Symposium on Computer Aided Process Engineering : 12th International Symposium on Process Systems Engineering, PSE2015/ESCAPE25 ; Conference date: 31-05-2015 Through 04-06-2015",

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Pereira Rosinha, I, Gernaey, K , Woodley, J & Krühne, U 2015, Topology optimization for biocatalytic microreactor configurations. in KV Gernaey, JK Huusom & R Gani (eds), Proceedings of the 25th European Symposium on Computer Aided Process Engineering . vol. 37, Elsevier, Computer Aided Chemical Engineering, pp. 1463-1468, 25th European Symposium on Computer Aided Process Engineering , Copenhagen, Denmark, 31/05/2015. https://doi.org/10.1016/B978-0-444-63577-8.50089-9

Topology optimization for biocatalytic microreactor configurations. / Pereira Rosinha, Ines; Gernaey, Krist ; Woodley, John ; Krühne, Ulrich.

Proceedings of the 25th European Symposium on Computer Aided Process Engineering . ed. / Krist V. Gernaey; Jakob K. Huusom; Rafiqul Gani. Vol. 37 Elsevier, 2015. p. 1463-1468 (Computer Aided Chemical Engineering).

Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review

TY - GEN

T1 - Topology optimization for biocatalytic microreactor configurations

AU - Pereira Rosinha, Ines

AU - Gernaey, Krist

AU - Woodley, John

AU - Krühne, Ulrich

PY - 2015

Y1 - 2015

N2 - The aim of this study is to present an innovative strategy for selecting a reactor for a specific process. Instead of adapting the process to a well-known reactor shape, a topology optimization method is used to obtain the best reactor configuration, and is applied to a biocatalyic reaction system as a case study. The Evolutionary Structure Optimization (ESO) method is applied using an interface between Matlab® and the computational fluid dynamic simulation software ANSYS CFX®. In the case study, theESO method is applied to optimize the spatial distribution of immobilized enzyme inside a microreactor. The results allow evaluating which regions in the microreactorhave more importance for the product formation. In fact, it was possible to simulate the improvement of the outlet product concentration per same amount of enzyme by modifying the spatial distribution of the immobilized enzyme.

AB - The aim of this study is to present an innovative strategy for selecting a reactor for a specific process. Instead of adapting the process to a well-known reactor shape, a topology optimization method is used to obtain the best reactor configuration, and is applied to a biocatalyic reaction system as a case study. The Evolutionary Structure Optimization (ESO) method is applied using an interface between Matlab® and the computational fluid dynamic simulation software ANSYS CFX®. In the case study, theESO method is applied to optimize the spatial distribution of immobilized enzyme inside a microreactor. The results allow evaluating which regions in the microreactorhave more importance for the product formation. In fact, it was possible to simulate the improvement of the outlet product concentration per same amount of enzyme by modifying the spatial distribution of the immobilized enzyme.

KW - Topology optimization

KW - Biocatalysis

KW - Immobilized enzymes

KW - CFD

U2 - 10.1016/B978-0-444-63577-8.50089-9

DO - 10.1016/B978-0-444-63577-8.50089-9

M3 - Article in proceedings

VL - 37

T3 - Computer Aided Chemical Engineering

SP - 1463

EP - 1468

BT - Proceedings of the 25th European Symposium on Computer Aided Process Engineering

A2 - Gernaey, Krist V.

A2 - Huusom, Jakob K.

A2 - Gani, Rafiqul

PB - Elsevier

T2 - 25th European Symposium on Computer Aided Process Engineering

Y2 - 31 May 2015 through 4 June 2015

ER -

Pereira Rosinha I, Gernaey K , Woodley J , Krühne U. Topology optimization for biocatalytic microreactor configurations. In Gernaey KV, Huusom JK, Gani R, editors, Proceedings of the 25th European Symposium on Computer Aided Process Engineering . Vol. 37. Elsevier. 2015. p. 1463-1468. (Computer Aided Chemical Engineering). https://doi.org/10.1016/B978-0-444-63577-8.50089-9

Topology optimization for biocatalytic microreactor configurations

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