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This book explains how the partial differential equations (pdes) in
electroanalytical chemistry can be solved numerically. It guides
the reader through the topic in a very didactic way, by first
introducing and discussing the basic equations along with some
model systems as test cases systematically. Then it outlines basic
numerical approximations for derivatives and techniques for the
numerical solution of ordinary differential equations. Finally,
more complicated methods for approaching the pdes are derived. The
authors describe major implicit methods in detail and show how to
handle homogeneous chemical reactions, even including coupled and
nonlinear cases. On this basis, more advanced techniques are
briefly sketched and some of the commercially available programs
are discussed. In this way the reader is systematically guided and
can learn the tools for approaching his own electrochemical
simulation problems. This new fourth edition has been carefully
revised, updated and extended compared to the previous edition
(Lecture Notes in Physics Vol. 666). It contains new material
describing migration effects, as well as arrays of
ultramicroelectrodes. It is thus the most comprehensive and
didactic introduction to the topic of electrochemical simulation.
This book is an extensive revision of the earlier 2nd Edition with
the same title, of 1988. The book has been rewritten in, I hope, a
much more did- tic manner. Subjects such as discretisations or
methods for solving ordinary di?erential equations are prepared
carefully in early chapters, and assumed in later chapters, so that
there is clearer focus on the methods for partial di?erential
equations. There are many new examples, and all programs are
inFortran90/95, whichallows amuchclearerprogrammingstylethanearlier
Fortran versions. In the years since the 2nd Edition, much has
happened in electrochemical digital simulation. Problems that ten
years ago seemed insurmountable have been solved, such as the thin
reaction layer formed by very fast homogeneous reactions, or sets
of coupled reactions. Two-dimensional simulations are now
commonplace, and with the help of unequal intervals, conformal maps
and sparse matrix methods, these too can be solved within a
reasonable time. Techniques have been developed that make
simulation much more e?cient, so that accurate results can be
achieved in a short computing time. Stable higher-order methods
have been adapted to the electrochemical context. The book is
accompanied (on the webpage www.springerlink.com/
openurl.asp?genre=issue&issn=1616-6361&volume=666) by a
number of - ample procedures and programs, all in Fortran 90/95.
These have all been
veri?edasfaraspossible.Whilesomeerrorsmightremain, theyarehopefully
very few.
This book explains how the partial differential equations (pdes) in
electroanalytical chemistry can be solved numerically. It guides
the reader through the topic in a very didactic way, by first
introducing and discussing the basic equations along with some
model systems as test cases systematically. Then it outlines basic
numerical approximations for derivatives and techniques for the
numerical solution of ordinary differential equations. Finally,
more complicated methods for approaching the pdes are derived. The
authors describe major implicit methods in detail and show how to
handle homogeneous chemical reactions, even including coupled and
nonlinear cases. On this basis, more advanced techniques are
briefly sketched and some of the commercially available programs
are discussed. In this way the reader is systematically guided and
can learn the tools for approaching his own electrochemical
simulation problems. This new fourth edition has been carefully
revised, updated and extended compared to the previous edition
(Lecture Notes in Physics Vol. 666). It contains new material
describing migration effects, as well as arrays of
ultramicroelectrodes. It is thus the most comprehensive and
didactic introduction to the topic of electrochemical simulation.
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