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Mathematical simulation of anodic intercalation of graphite in dilute nitric acid
Authors:K. B. Yemel’yanov  A. Ye. Bychkov  V. L. Zelenko  L. I. Heifets
Affiliation:1.Department of Chemical Technology and New Materials,Moscow State University,Moscow,Russia
Abstract:The article suggests a mathematical model for the process of anodic intercalation of the dense graphite suspension in dilute nitric acid, where the spontaneous intercalation is absent. The model is based on the idea of electric neutrality of a graphite particle, due to which the anion current NO3 entering the particle is precisely equal to the quantity of electrons, which are diverted from a particle to a current lead according to the mechanism of electronic conductivity provided by the outer constriction of the suspension. The anodic polarization is conditioned by the mass transfer of anions NO3 inside the equipotential graphite particle. The computational solution of the problem showed that even at a small suspension layer height (2 cm), there is a significant nonuniformity of intercalation, which corresponds to the data provided in the literature. A method for the estimation of an intercalation nonuniformity and a method for its reduction by using a multistep process were suggested. The results of the computation can be used for an estimation of the technical characteristics of the final product.
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