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@ARTICLE{Huang:894409,
author = {Huang, Jun and Zhu, Xinwei and Eikerling, Michael},
title = {{T}he {R}ate-{D}etermining {T}erm of {E}lectrocatalytic
{R}eactions with {F}irst-{O}rder {K}inetics},
journal = {Electrochimica acta},
volume = {393},
issn = {0013-4686},
address = {New York, NY [u.a.]},
publisher = {Elsevier},
reportid = {FZJ-2021-03209},
pages = {139019 -},
year = {2021},
abstract = {The quest to find highly active electrocatalysts for
electrochemical energy conversion devices requires
mechanistic concepts to guide activity analysis, the most
commonly employed ones being the rate-determining step (RDS)
and the potential-determining step (PDS). Here we present a
generalized concept, the rate-determining term (RDT). The
RDT concept is not simply a semantic change but a nontrivial
improvement over the RDS and PDS concepts, as it
incorporates the detailed kinetics and thermodynamics of
multistep electrocatalytic reactions. The theoretical basis
of the RDT concept is steady-state microkinetic modelling,
for which we put forward a unified and compact formalism for
electrocatalytic reactions with first-order kinetics. The
new formalism allows us to write the expression for the rate
determining term of the reaction in general and analytical
form. The RDT concept is then used to derive analytical
expressions for the Tafel slope and the volcano plot of
activity that can be used in the studies of multistep
electrocatalytic reactions. Thereafter, the efficacy of the
RDT concept is demonstrated for two important case studies,
the oxygen evolution reaction and the carbon dioxide
reduction reaction. Fundamental insights into the origins of
the potential-dependent Tafel slope are obtained. An
important consequence, gleaned from this analysis, is that
one cannot infer a RDS from measured Tafel slopes. In
addition, kinetic factors are shown to exert a notable
influence on the slopes and apex location in volcano plots
of activity. The present RDT is anticipated to be a powerful
analytical tool for multistep electrocatalytic reactions
with first-order kinetics.},
cin = {IEK-13 / JARA-ENERGY},
ddc = {540},
cid = {I:(DE-Juel1)IEK-13-20190226 / $I:(DE-82)080011_20140620$},
pnm = {1231 - Electrochemistry for Hydrogen (POF4-123)},
pid = {G:(DE-HGF)POF4-1231},
typ = {PUB:(DE-HGF)16},
UT = {WOS:000692096000013},
doi = {10.1016/j.electacta.2021.139019},
url = {https://juser.fz-juelich.de/record/894409},
}