Computational analysis of the slow invariant manifold for single and multi-route reaction mechanisms

Document Type: Research Note

Authors

1 Department of Mathematics and Statistics, Hazara University, Mansehra 21300, Pakistan

2 b. School of Mathematics and Statistics, Beijing Institute of Technology, Beijing 100081, China. c. Department of Mathematics, Mohi-ud-Din Islamic University, Nerian Sharif, 12010 Azad Jammu & Kashmir, Pakistan

10.24200/sci.2020.53151.3080

Abstract

The complexity behavior lies in many natural phenomena’s, such as our ecosystems, the earth’s climate, the behavior of the animal group, living cells and our brain. Therefore, a new field of “systems chemistry” is emerging, which aims to capture the complexity observed in natural systems within a synthetic chemical framework. To understand the physical behavior of the chemical components in a reaction mechanism (system), we need to understand the overall (complete) reactions network as well as different available reaction-paths. We propose the development of a multi-route reaction mechanism for a complex chemical reaction mechanism which is unsolvable through a common way. Further, invariant manifold approximation has been constructed through the Quasi Equilibrium Manifold. The numerical results have been tabulated along with the graphical view through MATLAB

Keywords

Scientia Iranica

Volume 27, Issue 3
Transactions on Chemistry and Chemical Engineering (C)
Winter and Spring 2020
Pages 1293-1299

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