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Lookup NU author(s): Dr Mark Willis
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This work, introduces a method to identify chemical reaction networks through the analysis of process data obtained in a laboratory environment (batch reactors operating away from steady state), assuming no a priori information about reaction stoichiometries or species structures. This is a three stage process achieved through: a) the determination of conservation relations, number of linearly independent reactions b) the partitioning of the matrices of conservation relations, thus reaction stoichiometry to reduce the parameter identification problem c) screening for a unique chemical reaction network. A case study is used to demonstrate the method. © 2009 Published by Elsevier B.V.
Author(s): Burnham S, Willis M
Editor(s): Pierucci, S., Ferraris, G.B.
Publication type: Conference Proceedings (inc. Abstract)
Publication status: Published
Conference Name: Computer Aided Chemical Engineering: 10th International Symposium on Process Systems Engineering: Part A
Year of Conference: 2009
Pages: 561-566
Publisher: Springer
URL: http://dx.doi.org/10.1016/S1570-7946(09)70314-1
DOI: 10.1016/S1570-7946(09)70314-1
Library holdings: Search Newcastle University Library for this item
ISBN: 9780444535696
