Computational Design Of Battery Materials

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Computational Design Of Battery Materials
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Author : Dorian A. H. Hanaor
language : en
Publisher:
Release Date : 2024
Computational Design Of Battery Materials written by Dorian A. H. Hanaor and has been published by this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024 with categories.
Computational Design Of Battery Materials
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Author : Dorian A. H. Hanaor
language : en
Publisher: Springer Nature
Release Date : 2024-07-04
Computational Design Of Battery Materials written by Dorian A. H. Hanaor and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-07-04 with Technology & Engineering categories.
This book presents an essential survey of the state of the art in the application of diverse computational methods to the interpretation, prediction, and design of high-performance battery materials. Rechargeable batteries have become one of the most important technologies supporting the global transition from fossil fuels to renewable energy sources. Aided by the growth of high-performance computing and machine learning technologies, computational methods are being applied to design the battery materials of the future and pave the way to a more sustainable energy economy. In this contributed collection, leading battery material researchers from across the globe share their methods, insights, and expert knowledge in the application of computational methods for battery material design and interpretation. With chapters featuring an array of computational techniques applied to model the relevant properties of cathodes, anodes, and electrolytes, this book provides the ideal starting point for any researcher looking to integrate computational tools in the development of next-generation battery materials and processes.
Computational Design Of Engineering Materials
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Author : Yong Du
language : en
Publisher: Cambridge University Press
Release Date : 2023-06-29
Computational Design Of Engineering Materials written by Yong Du and has been published by Cambridge University Press this book supported file pdf, txt, epub, kindle and other format this book has been release on 2023-06-29 with Technology & Engineering categories.
Introducing state-of-the art computational methods, this book combines detailed explanations with real-world case studies to give a full grounding in the design of engineering materials. This book presents a wide spectrum of key computational methods, such as CALPHAD-method, first-principles calculations, phase-field simulation and finite element analysis, covering the atomic-meso-macro scale range. The reader will see these methods applied to case studies for steel, light alloys, superalloys, cemented carbides, hard coating and energy materials, demonstrating in detail how real-world materials are designed. Online ancillary material includes input files for computational design software, providing the reader with hands-on design experience. Step-by-step instructions will allow you to perform and repeat the simulations discussed in the book. Aimed at both graduate and undergraduate students as well as non-specialist researchers in materials science and engineering, including ceramics, metallurgy, and chemistry, this is an ideal introductory and reference book.
Nanostructured Materials Engineering And Characterization For Battery Applications
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Author : Amadou Belal Gueye
language : en
Publisher: Elsevier
Release Date : 2024-06-21
Nanostructured Materials Engineering And Characterization For Battery Applications written by Amadou Belal Gueye and has been published by Elsevier this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-06-21 with Technology & Engineering categories.
Nanostructured Materials Engineering and Characterization for Battery Applications is designed to help solve fundamental and applied problems in the field of energy storage. Broken up into four separate sections, the book begins with a discussion of the fundamental electrochemical concepts in the field of energy storage. Other sections look at battery materials engineering such as cathodes, electrolytes, separators and anodes and review various battery characterization methods and their applications. The book concludes with a review of the practical considerations and applications of batteries.This will be a valuable reference source for university professors, researchers, undergraduate and postgraduate students, as well as scientists working primarily in the field of materials science, applied chemistry, applied physics and nanotechnology. - Presents practical consideration for battery usage such as LCA, recycling and green batteries - Covers battery characterization techniques including electrochemical methods, microscopy, spectroscopy and X-ray methods - Explores battery models and computational materials design theories
Advanced Energy Materials For Flexible Batteries
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Author : Colin Tong
language : en
Publisher: Springer Nature
Release Date : 2025-03-07
Advanced Energy Materials For Flexible Batteries written by Colin Tong and has been published by Springer Nature this book supported file pdf, txt, epub, kindle and other format this book has been release on 2025-03-07 with Science categories.
This book provides a comprehensive guide to the cutting-edge science and engineering behind the development of flexible batteries. These innovative devices, capable of bending, twisting, and stretching, hold immense potential for applications ranging from wearable electronics to large-scale energy storage systems. The book presents a thorough overview of the essential materials and design principles that underpin flexible battery technology. It explores the latest advancements in electrode materials, electrolytes, and separators, focusing on materials that exhibit exceptional flexibility, high energy density, and excellent rate capability. In addition to materials selection, the book addresses the challenges and opportunities associated with designing and manufacturing flexible batteries. It discusses strategies for creating flexible battery cells that can withstand mechanical deformation, as well as efficient manufacturing processes and performance evaluation methods. By offering a deep understanding of the materials science and engineering principles governing flexible batteries, this book aims to inspire further research and development in this rapidly evolving field. This book is an essential resource for engineers and materials scientists involved in battery development.
Electrochemical Storage Materials
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Author : Dirk C. Meyer
language : en
Publisher: Walter de Gruyter GmbH & Co KG
Release Date : 2018-12-17
Electrochemical Storage Materials written by Dirk C. Meyer and has been published by Walter de Gruyter GmbH & Co KG this book supported file pdf, txt, epub, kindle and other format this book has been release on 2018-12-17 with Science categories.
This work gives a comprehensive overview on materials, processes and technological challenges for electrochemical storage and conversion of energy. Optimization and development of electrochemical cells requires consideration of the cell as a whole, taking into account the complex interplay of all individual components. Considering the availability of resources, their environmental impact and requirements for recycling, the design of new concepts has to be based on the understanding of relevant processes at an atomic level.
Atomic Scale Modelling Of Electrochemical Systems
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Author : Marko M. Melander
language : en
Publisher: John Wiley & Sons
Release Date : 2021-09-14
Atomic Scale Modelling Of Electrochemical Systems written by Marko M. Melander and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021-09-14 with Science categories.
Atomic-Scale Modelling of Electrochemical Systems A comprehensive overview of atomistic computational electrochemistry, discussing methods, implementation, and state-of-the-art applications in the field The first book to review state-of-the-art computational and theoretical methods for modelling, understanding, and predicting the properties of electrochemical interfaces. This book presents a detailed description of the current methods, their background, limitations, and use for addressing the electrochemical interface and reactions. It also highlights several applications in electrocatalysis and electrochemistry. Atomic-Scale Modelling of Electrochemical Systems discusses different ways of including the electrode potential in the computational setup and fixed potential calculations within the framework of grand canonical density functional theory. It examines classical and quantum mechanical models for the solid-liquid interface and formation of an electrochemical double-layer using molecular dynamics and/or continuum descriptions. A thermodynamic description of the interface and reactions taking place at the interface as a function of the electrode potential is provided, as are novel ways to describe rates of heterogeneous electron transfer, proton-coupled electron transfer, and other electrocatalytic reactions. The book also covers multiscale modelling, where atomic level information is used for predicting experimental observables to enable direct comparison with experiments, to rationalize experimental results, and to predict the following electrochemical performance. Uniquely explains how to understand, predict, and optimize the properties and reactivity of electrochemical interfaces starting from the atomic scale Uses an engaging “tutorial style” presentation, highlighting a solid physicochemical background, computational implementation, and applications for different methods, including merits and limitations Bridges the gap between experimental electrochemistry and computational atomistic modelling Written by a team of experts within the field of computational electrochemistry and the wider computational condensed matter community, this book serves as an introduction to the subject for readers entering the field of atom-level electrochemical modeling, while also serving as an invaluable reference for advanced practitioners already working in the field.
Nanostructured Materials For Energy Storage
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Author : Kalim Deshmukh
language : en
Publisher: John Wiley & Sons
Release Date : 2024-08-14
Nanostructured Materials For Energy Storage written by Kalim Deshmukh and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2024-08-14 with Science categories.
Comprehensive reference work for researchers and engineers working with advanced and emerging nanostructured battery and supercapacitor materials Lithium-ion batteries and supercapacitors play a vital role in the paradigm shift towards sustainable energy technology. This book reviews how and why different nanostructured materials improve the performance and stability of batteries and capacitors. Sample materials covered throughout the work include: Graphene, carbon nanotubes, and carbon nanofibers MXenes, hexagonal boron nitride, and transition metal dichalcogenides Transition metal oxides, metal-organic frameworks, and lithium titanates Gel polymer electrolytes, hydrogels, and conducting polymer nanocomposites For materials scientists, electrochemists, and solid state chemists, this book is an essential reference to understand the lithium-ion battery and supercapacitor applications of nanostructured materials that are most widely used for developing low-cost, rapid, and highly efficient energy storage systems.
Materials Processing For Production Of Nanostructured Thin Films
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Author : Keith J. Stine
language : en
Publisher: MDPI
Release Date : 2021-09-01
Materials Processing For Production Of Nanostructured Thin Films written by Keith J. Stine and has been published by MDPI this book supported file pdf, txt, epub, kindle and other format this book has been release on 2021-09-01 with Technology & Engineering categories.
Thin films are important in many of the technologies used every day, impacting major markets for energy, medicine, and coatings. Scientists and engineers have been producing thin films on a wide range of surfaces for many decades but now have begun to explore giving these films new and controlled structures at the nanometer scale. These efforts are part of the new horizons opened by the field of nanoscience and impart novel structures and properties to these thin films. This book covers some of the methods for making these nanostructured thin films and their applications in areas impacting on health and energy usage.
Inorganic Battery Materials
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Author : Hailiang Wang
language : en
Publisher: John Wiley & Sons
Release Date : 2019-08-23
Inorganic Battery Materials written by Hailiang Wang and has been published by John Wiley & Sons this book supported file pdf, txt, epub, kindle and other format this book has been release on 2019-08-23 with Science categories.
A guide to the fundamental chemistry and recent advances of battery materials In one comprehensive volume, Inorganic Battery Materials explores the basic chemistry principles, recent advances, and the challenges and opportunities of the current and emerging technologies of battery materials. With contributions from an international panel of experts, this authoritative resource contains information on the fundamental features of battery materials, discussions on material synthesis, structural characterizations and electrochemical reactions. The book explores a wide range of topics including the state-of-the-art lithium ion battery chemistry to more energy-aggressive chemistries involving lithium metal. The authors also include a review of sulfur and oxygen, aqueous battery chemistry, redox flow battery chemistry, solid state battery chemistry and environmentally beneficial carbon dioxide battery chemistry. In the context of renewable energy utilization and transportation electrification, battery technologies have been under more extensive and intensive development than ever. This important book: Provides an understanding of the chemistry of a battery technology Explores battery technology's potential as well as the obstacles that hamper the potential from being realized Highlights new applications and points out the potential growth areas that can serve as inspirations for future research Includes an understanding of the chemistry of battery materials and how they store and convert energy Written for students and academics in the fields of energy materials, electrochemistry, solid state chemistry, inorganic materials chemistry and materials science, Inorganic Battery Materials focuses on the inorganic chemistry of battery materials associated with both current and future battery technologies to provide a unique reference in the field. About EIBC Books The Encyclopedia of Inorganic and Bioinorganic Chemistry (EIBC) was created as an online reference in 2012 by merging the Encyclopedia of Inorganic Chemistry and the Handbook of Metalloproteins. The resulting combination proves to be the defining reference work in the field of inorganic and bioinorganic chemistry, and a lot of chemistry libraries around the world have access to the online version. Many readers, however, prefer to have more concise thematic volumes in print, targeted to their specific area of interest. This feedback from EIBC readers has encouraged the Editors to plan a series of EIBC Books [formerly called EIC Books], focusing on topics of current interest. EIBC Books will appear on a regular basis, will be edited by the EIBC Editors and specialist Guest Editors, and will feature articles from leading scholars in their fields. EIBC Books aim to provide both the starting research student and the confirmed research worker with a critical distillation of the leading concepts in inorganic and bioinorganic chemistry, and provide a structured entry into the fields covered.