A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology

In the second part of this study, we present the stochastic weighted particle population balance framework used to solve the twin-screw granulation model detailed in the first part of this study. Each stochastic jump process is presented in detail, including a new nucleation jump event capable of ca...

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Main Authors: McGuire, Andrew D., Mosbach, Sebastian, Lee, Kok Foong, Reynolds, Gavin, Kraft, Markus
Other Authors: School of Chemical and Biomedical Engineering
Format: Journal Article
Language:English
Published: 2019
Subjects:
Online Access:https://hdl.handle.net/10356/86000
http://hdl.handle.net/10220/48319
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author McGuire, Andrew D.
Mosbach, Sebastian
Lee, Kok Foong
Reynolds, Gavin
Kraft, Markus
author2 School of Chemical and Biomedical Engineering
author_facet School of Chemical and Biomedical Engineering
McGuire, Andrew D.
Mosbach, Sebastian
Lee, Kok Foong
Reynolds, Gavin
Kraft, Markus
author_sort McGuire, Andrew D.
collection NTU
description In the second part of this study, we present the stochastic weighted particle population balance framework used to solve the twin-screw granulation model detailed in the first part of this study. Each stochastic jump process is presented in detail, including a new nucleation jump event capable of capturing the immersion nucleation processes in twin-screw granulation. A variable weighted inception algorithm is presented and demonstrated to reduce the computational cost of simulations by up to two orders of magnitude over traditional approaches. The relationship between the performance of the simulation algorithm and key numerical parameters within the nucleation jump process are explored and optimum operating conditions are identified. Finally, convergence studies on the complete simulation algorithm demonstrate that the algorithm is very robust against changes in the number of stochastic particles used, provided that the number of particles exceeds a minimum required for numerical stability.
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spelling ntu-10356/860002023-12-29T06:46:15Z A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology McGuire, Andrew D. Mosbach, Sebastian Lee, Kok Foong Reynolds, Gavin Kraft, Markus School of Chemical and Biomedical Engineering Granulation Twin-screw DRNTU::Engineering::Chemical engineering In the second part of this study, we present the stochastic weighted particle population balance framework used to solve the twin-screw granulation model detailed in the first part of this study. Each stochastic jump process is presented in detail, including a new nucleation jump event capable of capturing the immersion nucleation processes in twin-screw granulation. A variable weighted inception algorithm is presented and demonstrated to reduce the computational cost of simulations by up to two orders of magnitude over traditional approaches. The relationship between the performance of the simulation algorithm and key numerical parameters within the nucleation jump process are explored and optimum operating conditions are identified. Finally, convergence studies on the complete simulation algorithm demonstrate that the algorithm is very robust against changes in the number of stochastic particles used, provided that the number of particles exceeds a minimum required for numerical stability. Accepted version 2019-05-22T07:25:56Z 2019-12-06T16:14:07Z 2019-05-22T07:25:56Z 2019-12-06T16:14:07Z 2018 Journal Article McGuire, A. D., Mosbach, S., Lee, K. F., Reynolds, G., & Kraft, M. (2018). A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology. Chemical Engineering Science, 188, 18-33. doi:10.1016/j.ces.2018.04.077. 0009-2509 https://hdl.handle.net/10356/86000 http://hdl.handle.net/10220/48319 10.1016/j.ces.2018.04.077 en Chemical Engineering Science Chemical Engineering Science © 2018 Elsevier. All rights reserved. This paper was published in Chemical Engineering Science and is made available with permission of Elsevier. 50 p. application/pdf
spellingShingle Granulation
Twin-screw
DRNTU::Engineering::Chemical engineering
McGuire, Andrew D.
Mosbach, Sebastian
Lee, Kok Foong
Reynolds, Gavin
Kraft, Markus
A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title_full A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title_fullStr A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title_full_unstemmed A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title_short A high-dimensional, stochastic model for twin-screw granulation part 2: numerical methodology
title_sort high dimensional stochastic model for twin screw granulation part 2 numerical methodology
topic Granulation
Twin-screw
DRNTU::Engineering::Chemical engineering
url https://hdl.handle.net/10356/86000
http://hdl.handle.net/10220/48319
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