Modeling of solvent viscosity effects on the electroreduction of Pt(II) aquachlorocomplexes

Autor: Michael D. Bronshtein, Dmitrii V. Glukhov, Tamara T. Zinkicheva, Renat R. Nazmutdinov
Rok vydání: 2007
Předmět:
Zdroj: Journal of Solid State Electrochemistry. 12:445-451
ISSN: 1433-0768
1432-8488
Popis: Solvent dynamics effects on the electroreduction of [PtCl3(H2O)]− at a mercury electrode are explored in the framework of Sumi–Marcus model using an efficient computational scheme. According to results of density functional calculations, the second electron transfer step may be regarded as rate controlling. The nonmonotonous influence of solvent viscosity on the reaction rate is predicted and explained in terms of the saddle point avoidance. The results of model calculations are employed to interpret experimental data reported earlier in the literature.
Databáze: OpenAIRE