Theoretical Insights into the Electrochemical Properties of Ionic Liquid Electrolytes in Lithium-Ion Batteries

Theoretical Insights into the Electrochemical Properties of Ionic Liquid Electrolytes in Lithium-Ion Batteries

Author: Leila Maftoon-Azad

Publisher: CRC Press

Published: 2024-09-17

Total Pages: 75

ISBN-13: 1040157610

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This book provides a concise overview of the use of ionic liquids as electrolytes in lithium-ion batteries (LIBs) from a theoretical and computational perspective. It focuses on computational studies to understand the behavior of lithium ions in different ionic liquids and to optimize the performance of ionic liquid-based electrolytes. The main features of the book are as follows: • Provides a thorough understanding of the theoretical and computational aspects of using ionic liquids as electrolytes in LIBs, including the evaluation and reproducibility of the theoretical paths. • Covers various computational methods such as density functional theory, molecular dynamics, and quantum mechanics that have been used to study the behavior of lithium ions in different solvents and to optimize the performance of ionic liquid-based electrolytes. • Discusses recent advances such as new computational methods for predicting the properties of ionic liquid-based electrolytes, new strategies for improving the stability and conductivity of these electrolytes, and new approaches for understanding the kinetics and thermodynamics of redox reactions with ionic liquids. • Suggests how theoretical insights can be translated into practical applications for improving performance and safety. This monograph will be of interest to engineers working on LIB optimization.


Electrolytes for Lithium and Lithium-Ion Batteries

Electrolytes for Lithium and Lithium-Ion Batteries

Author: T. Richard Jow

Publisher: Springer

Published: 2014-05-06

Total Pages: 488

ISBN-13: 1493903020

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Electrolytes for Lithium and Lithium-ion Batteries provides a comprehensive overview of the scientific understanding and technological development of electrolyte materials in the last several years. This book covers key electrolytes such as LiPF6 salt in mixed-carbonate solvents with additives for the state-of-the-art Li-ion batteries as well as new electrolyte materials developed recently that lay the foundation for future advances. This book also reviews the characterization of electrolyte materials for their transport properties, structures, phase relationships, stabilities, and impurities. The book discusses in-depth the electrode-electrolyte interactions and interphasial chemistries that are key for the successful use of the electrolyte in practical devices. The Quantum Mechanical and Molecular Dynamical calculations that has proved to be so powerful in understanding and predicating behavior and properties of materials is also reviewed in this book. Electrolytes for Lithium and Lithium-ion Batteries is ideal for electrochemists, engineers, researchers interested in energy science and technology, material scientists, and physicists working on energy.


Polymerized Ionic Liquids

Polymerized Ionic Liquids

Author: Ali Eftekhari

Publisher: Royal Society of Chemistry

Published: 2017-09-18

Total Pages: 564

ISBN-13: 1782629602

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The series covers the fundamentals and applications of different smart material systems from renowned international experts.


Nanocarbons for Advanced Energy Storage, Volume 1

Nanocarbons for Advanced Energy Storage, Volume 1

Author: Xinliang Feng

Publisher: John Wiley & Sons

Published: 2015-03-20

Total Pages: 488

ISBN-13: 3527680071

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This first volume in the series on nanocarbons for advanced applications presents the latest achievements in the design, synthesis, characterization, and applications of these materials for electrochemical energy storage. The highly renowned series and volume editor, Xinliang Feng, has put together an internationally acclaimed expert team who covers nanocarbons such as carbon nanotubes, fullerenes, graphenes, and porous carbons. The first two parts focus on nanocarbon-based anode and cathode materials for lithium ion batteries, while the third part deals with carbon material-based supercapacitors with various applications in power electronics, automotive engineering and as energy storage elements in portable electric devices. This book will be indispensable for materials scientists, electrochemists, physical chemists, solid state physicists, and those working in the electrotechnical industry.


Electrochemical Devices for Energy Storage Applications

Electrochemical Devices for Energy Storage Applications

Author: Mesfin A. Kebede

Publisher: CRC Press

Published: 2019-12-11

Total Pages: 302

ISBN-13: 1000763870

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This book explores a wide range of energy storage devices, such as a lithium ion battery, sodium ion battery, magnesium ion battery and supercapacitors. Providing a comprehensive review of the current field, it also discusses the history of these technologies and introduces next-generation rechargeable batteries and supercapacitors. This book will serve as a valuable reference for researchers working with energy storage technologies across the fields of physics, chemistry, and engineering. Features: • Edited by established authorities in the field, with chapter contributions from subject area specialists • Provides a comprehensive review of field • Up to date with the latest developments and research


Computer Simulation of Liquids

Computer Simulation of Liquids

Author: M. P. Allen

Publisher: Oxford University Press

Published: 1989

Total Pages: 412

ISBN-13: 9780198556459

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Computer simulation is an essential tool in studying the chemistry and physics of liquids. Simulations allow us to develop models and to test them against experimental data. This book is an introduction and practical guide to the molecular dynamics and Monte Carlo methods.


Synthesis and Applications of Nanomaterials and Nanocomposites

Synthesis and Applications of Nanomaterials and Nanocomposites

Author: Imran Uddin

Publisher: Springer Nature

Published: 2023-05-08

Total Pages: 398

ISBN-13: 9819913500

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This book brings together multiple aspects of the recent research conducted in the field of nanotechnology covering topics such as the synthesis of various nanoparticles, nanorods, graphene, graphene oxide-metal composites, characterization of these materials, and ample aspects of various applications including in heavy metal sensing, optoelectronic devices, gas sensing, solar cells, biomedical sensors, role in the drug delivery, and waste-water treatment. The book is of interest to early career researchers, who are trying to grasp multiple aspects of nanomaterials and nanocomposite synthesis and its potential applications.


Handbook of Ionic Liquids

Handbook of Ionic Liquids

Author: Sanchayita Rajkhowa

Publisher: John Wiley & Sons

Published: 2024-03-11

Total Pages: 533

ISBN-13: 3527350667

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Handbook of Ionic Liquids A one-stop reference for researchers interested in ionic liquids and their applications Handbook of Ionic Liquids: Fundamentals, Applications, and Sustainability, constitutes an overview of the latest advances in ionic liquid chemistry. It offers a comprehensive summary of the development history of ionic liquids, their design, and the diverse array of applications—including green and sustainable synthesis, catalysis, drug development and medicine, biotechnology, materials science, and electrochemistry. The authors explain a variety of processes used to develop novel materials with ionic liquids and describe likely future developments using practical examples taken from contemporary research and development in the field. The book includes discussions of biomass conversion, CO2 capture, and more. You’ll also discover: A thorough introduction to the theory of ionic liquids, as well as their different types and recycling methods Comprehensive explorations of the physico-chemical properties of ionic liquids Practical discussions of ionic liquid synthesis and analysis, including green synthesis and heterocyclic chemistry applications Summary of the use of ionic liquids in materials science, including polymers, energy conversion, and storage devices Perfect for organic, catalytic, physical, analytical, and environmental chemists, Handbook of Ionic Liquids: Fundamentals, Applications, and Sustainability will also benefit electrochemists, materials scientists, and biotechnologists with an interest in ionic liquids and their application.


Surface Science of Intercalation Materials and Solid Electrolytes

Surface Science of Intercalation Materials and Solid Electrolytes

Author: René Hausbrand

Publisher: Springer Nature

Published: 2020-07-20

Total Pages: 109

ISBN-13: 303052826X

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This book shares essential insights into the formation and properties of ionic interfaces based on the energy level structures of their interfaces obtained using a surface science approach. It covers both interfaces with liquid and solid electrolyte contacts, and includes different material classes, such as oxides and phosphates. The specific material properties result in particular effects observed at interfaces, which are often not yet, or not sufficiently, taken into account in battery development and technologies. Discussing fundamental issues concerning the properties of intercalation electrodes and electrode–solid electrolyte interfaces, the book investigates the factors that determine voltage, kinetics and reactivity. It presents experimental results on interface formation, and relates them to electron and ion energy levels in the materials and at their interfaces. It explores these topics integrating electrochemistry, solid-state ionics and semiconductor physics, and accordingly will appeal not only to battery scientists, but also to a broader scientific community, including material scientists and electrochemists.