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Molecular Theory of Electric Double Layers

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The focus is the application of modern liquid state theories to the electric double layer, where it demonstrates the ability of statistical mechanical approaches to enable a better and more quantit...
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  • 22 October 2021
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The electrical double layer describes charge and potential distributions that form at the interface between electrolyte solutions and the surface of an object, and they play a fundamental role in chemical and electrochemical behaviour. Colloid science, electrochemistry, material science, and biology are a few examples where such interfaces play a crucial role. The focus of this book is on the application of modern liquid state theories to the properties of electric double layers, where it demonstrates the ability of statistical mechanical approaches, such as the classical density functional theory, to provide insights and details that will enable a better and more quantitative understanding of electric double layers. The book will be essential reading for advanced students and researchers in interfacial science and its numerous applications.

Key Features

  • Includes both continuum and molecular models
  • Relies on modern statistical mechanical approaches
  • Suitable for chemists, physicists, material scientists and engineers
  • Offers a new outlook for fundamental and applied researchers on the basic physics and chemistry of charged interfaces involving electrolytes
  • Helps to advance further research fields as colloid science, electrochemistry, material science, and physical chemistry of electrolytes.
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Price: £99.00
Pages: 350
Publisher: Institute of Physics Publishing
Imprint: Institute of Physics Publishing
Publication Date: 22 October 2021
ISBN: 9780750322768
Format: eBook
BISACs:

SCIENCE / Chemistry / Electrochemistry, Electrochemistry and magnetochemistry

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Preface

1 Introduction: A Historical Overview

Part I Theory

2 The Origin of Charge at Interfaces Involving Electrolyte Solutions

3 Continuum Models of the Electric Double Layers

4 Integral Equation Theory

5 Perturbation and Mean Field Theory

6 Density Functional Theory

7 Classical-DFT for Electrolyte Interfaces

Part II Structure of a Single Electric Double Layer: Effects Due to Surface Charge Regulation and Non-Coulombic Interactions

8 Molecular Properties of a Single Electric Double Layer

9 Ionic Solvation Effects and Solvent-Solvent Interactions

10 Surface Solvation and Non-Coulombic Ion-Surface Interactions

11 The Potential Distribution in the Electric Double Layer and Its Relationship to the Fluid Charge

12 Electric Double Layers Containing Multivalent Ions

13 Ionic Size Effects

Part III Numerical Methods

14 Molecular Simulation: Methods

15 Molecular Simulation: Applications

16 Numerical Methods for Classical-DFT

A The Poisson-Nernst-Planck-Bikerman Theory

B MSA: Thermodynamic Properties

C Some Conventions: Dimensionless Quantities

D Details of Lekner’s Mathematical Transformations

E Finite Difference and Finite Element methods for PDEs