2011•Chemical ResearchRequires access
Arrhenius theory-based numerical algorithm for chemical kinetics
Wei Zhong
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Abstract
A numerical simulation method,based on Arrhenius theory,was proposed in relation to calculation of chemical kinetic equations.The simulation method has been found to be consistent of chemical kinetics and can well reflect the process of chemical kinetics.When it was adopted to solve the first-order reaction,parallel reaction and complicated comprehensive reaction,the relative errors between the numerical solutions and exact solutions were less than 0.5%.