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Title: Tafel Slope Analyses for Homogeneous Catalytic Reactions

Journal Article · · Catalysts

Tafel analysis of electrocatalysts is essential in their characterization. This paper analyzes the application of Tafel-like analysis to the four-electron nonelectrochemical oxidation of water by the stoichiometric homogeneous 1-electron oxidant [Ru(bpy)3]3+ to dioxygen catalyzed by homogeneous catalysts, [Ru4O4(OH)2(H2O)4(γ-SiW10O36)2]10- (Ru4POM) and [Co4(H2O)2(PW9O34)2]10- (Co4POM). These complexes have slow electron exchange rates with electrodes due to the Frumkin effect, which precludes the use of known electrochemical methods to obtain Tafel plots at ionic strengths lower than 0.5 M. The application of an electron transfer catalyst, [Ru(bpy)3]3+/2+, increases the rates between the Ru4POM and electrode, but a traditional Tafel analysis of such a complex system is precluded due to a lack of appropriate theoretical models for 4-electron processes. Here, we develop a theoretical framework and experimental procedures for a Tafel-like analysis of Ru4POM and Co4POM, using a stoichiometric molecular oxidant [Ru(bpy)3]3+. The dependence of turnover frequency (TOF) as a function of electrochemical solution potential created by the [Ru(bpy)3]3+/[Ru(bpy)3]2+ redox couple (an analog of the Tafel plot) was obtained from kinetics data and interpreted based on the suggested reaction mechanism.

Research Organization:
Emory Univ., Atlanta, GA (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
Grant/Contract Number:
FG02-07ER15906
OSTI ID:
1756491
Alternate ID(s):
OSTI ID: 1849732
Journal Information:
Catalysts, Journal Name: Catalysts Vol. 11 Journal Issue: 1; ISSN 2073-4344
Publisher:
MDPI AGCopyright Statement
Country of Publication:
Switzerland
Language:
English

References (22)

Earth-abundant catalysts for electrochemical and photoelectrochemical water splitting journal January 2017
Homogeneous Molecular Catalysis of Electrochemical Reactions: Catalyst Benchmarking and Optimization Strategies journal June 2017
Thermodynamic Study of Ce4+ /Ce3+ Redox Reaction in Aqueous Solutions at Elevated Temperatures: 1. Reduction Potential and Hydrolysis Equilibria of Ce4+ in HCIO4 Solutions journal September 1992
Molecular Catalysis of Electrochemical Reactions. Mechanistic Aspects journal July 2008
Polyoxometalate Multi-Electron-Transfer Catalytic Systems for Water Splitting: POM Multielectron-Transfer Catalytic Systems for Water Splitting journal January 2014
Solar Water Splitting Cells journal November 2010
Tafel analysis in practice journal October 2018
The Phase Stability of Cerium Species in Aqueous Systems journal January 2002
Detailed Electrochemical Studies of the Tetraruthenium Polyoxometalate Water Oxidation Catalyst in Acidic Media: Identification of an Extended Oxidation Series using Fourier Transformed Alternating Current Voltammetry journal October 2012
COPASI--a COmplex PAthway SImulator journal October 2006
Insight on Tafel slopes from a microkinetic analysis of aqueous electrocatalysis for energy conversion journal September 2015
Turnover Numbers, Turnover Frequencies, and Overpotential in Molecular Catalysis of Electrochemical Reactions. Cyclic Voltammetry and Preparative-Scale Electrolysis journal June 2012
Collecting meaningful early-time kinetic data in homogeneous catalytic water oxidation with a sacrificial oxidant journal January 2014
pH-distribution of cerium species in aqueous systems journal June 2012
Structural, Physicochemical, and Reactivity Properties of an All-Inorganic, Highly Active Tetraruthenium Homogeneous Catalyst for Water Oxidation journal December 2009
A Fast Soluble Carbon-Free Molecular Water Oxidation Catalyst Based on Abundant Metals journal March 2010
Polyoxometalate Embedding of a Tetraruthenium(IV)-oxo-core by Template-Directed Metalation of [γ-SiW10O36]8−: A Totally Inorganic Oxygen-Evolving Catalyst
  • Sartorel, Andrea; Carraro, Mauro; Scorrano, Gianfranco
  • Journal of the American Chemical Society, Vol. 130, Issue 15, p. 5006-5007 https://doi.org/10.1021/ja077837f
journal April 2008
The heterogeneous rate constant for the Ru(bpy)33+/2+ couple at a glassy carbon electrode in aqueous solution journal August 1983
Oxygen evolution reaction on IrO2-based DSA® type electrodes: kinetics analysis of Tafel lines and EIS journal July 2004
Hydrogen evolution reaction: Analysis of the Volmer-Heyrovsky-Tafel mechanism with a generalized adsorption model journal July 1994
Precision and correctness in the evaluation of electrocatalytic water splitting: revisiting activity parameters with a critical assessment journal January 2018
Avoid the quasi-equilibrium assumption when evaluating the electrocatalytic oxygen evolution reaction mechanism by Tafel slope analysis journal December 2015