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  4. Sequential model identification of reaction systems-The missing path between the incremental and simultaneous approaches
 
research article

Sequential model identification of reaction systems-The missing path between the incremental and simultaneous approaches

Srinivasan, Sriniketh  
•
Billeter, Julien  
•
Bonvin, Dominique  
April 1, 2019
AIChE Journal

Modeling chemical reaction systems is an important but complex task. The identified kinetic model must be able to explain all the underlying rate processes such as chemical reactions and heat and mass transfers. Traditionally, the modeling task is carried out using a simultaneous approach, which, for model prediction, requires having model candidates for all rate processes. The simultaneous approach leads to statistically optimal parameter estimates in the maximum-likelihood sense, but it can be computationally expensive due to its combinatorial nature. The incremental approach, via either rates or extents, was introduced as an alternative to the simultaneous approach. It is characterized by the fact that each rate process can be modeled individually, that is, independently of the other rate processes. Hence, the incremental approach is computationally more attractive, however, at the price of not guaranteeing statistically optimal parameter estimates. This article proposes a novel sequential approach that combines the advantages of the incremental and simultaneous approaches. (c) 2019 American Institute of Chemical Engineers AIChE J, 65: 1211-1221, 2019

  • Details
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Type
research article
DOI
10.1002/aic.16530
Web of Science ID

WOS:000460779500008

Author(s)
Srinivasan, Sriniketh  
Billeter, Julien  
Bonvin, Dominique  
Date Issued

2019-04-01

Published in
AIChE Journal
Volume

65

Issue

4

Start page

1211

End page

1221

Subjects

Engineering, Chemical

•

Engineering

•

reaction kinetics

•

vessel extents

•

incremental model identification

•

parameter estimation

•

estimation bias

•

extents

Editorial or Peer reviewed

REVIEWED

Written at

EPFL

EPFL units
LA  
Available on Infoscience
March 21, 2019
Use this identifier to reference this record
https://infoscience.epfl.ch/handle/20.500.14299/155666
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