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Reaxff Reactive Force Field Modeling Of High Capacity Electrodes In Lithium Ion Batteries And Two Dimensional Materials
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Book Synopsis Nanostructured Materials for Energy Storage by : Kalim Deshmukh
Download or read book Nanostructured Materials for Energy Storage written by Kalim Deshmukh and published by John Wiley & Sons. This book was released on 2024-08-14 with total page 1981 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Book Synopsis Silicon Anode Systems for Lithium-Ion Batteries by : Prashant Kumta
Download or read book Silicon Anode Systems for Lithium-Ion Batteries written by Prashant Kumta and published by Elsevier. This book was released on 2021-09-10 with total page 538 pages. Available in PDF, EPUB and Kindle. Book excerpt: Silicon Anode Systems for Lithium-Ion Batteries is an introduction to silicon anodes as an alternative to traditional graphite-based anodes. The book provides a comprehensive overview including abundance, system voltage, and capacity. It provides key insights into the basic challenges faced by the materials system such as new configurations and concepts for overcoming the expansion and contraction related problems. This book has been written for the practitioner, researcher or developer of commercial technologies. - Provides a thorough explanation of the advantages, challenge, materials science, and commercial prospects of silicon and related anode materials for lithium-ion batteries - Provides insights into practical issues including processing and performance of advanced Si-based materials in battery-relevant materials systems - Discusses suppressants in electrolytes to minimize adverse effects of solid electrolyte interphase (SEI) formation and safety limitations associated with this technology
Book Synopsis Classical And Quantum Dynamics In Condensed Phase Simulations: Proceedings Of The International School Of Physics by : Bruce J Berne
Download or read book Classical And Quantum Dynamics In Condensed Phase Simulations: Proceedings Of The International School Of Physics written by Bruce J Berne and published by World Scientific. This book was released on 1998-06-17 with total page 881 pages. Available in PDF, EPUB and Kindle. Book excerpt: The school held at Villa Marigola, Lerici, Italy, in July 1997 was very much an educational experiment aimed not just at teaching a new generation of students the latest developments in computer simulation methods and theory, but also at bringing together researchers from the condensed matter computer simulation community, the biophysical chemistry community and the quantum dynamics community to confront the shared problem: the development of methods to treat the dynamics of quantum condensed phase systems.This volume collects the lectures delivered there. Due to the focus of the school, the contributions divide along natural lines into two broad groups: (1) the most sophisticated forms of the art of computer simulation, including biased phase space sampling schemes, methods which address the multiplicity of time scales in condensed phase problems, and static equilibrium methods for treating quantum systems; (2) the contributions on quantum dynamics, including methods for mixing quantum and classical dynamics in condensed phase simulations and methods capable of treating all degrees of freedom quantum-mechanically.
Book Synopsis Computational Catalysis by : Aravind Asthagiri
Download or read book Computational Catalysis written by Aravind Asthagiri and published by Royal Society of Chemistry. This book was released on 2014 with total page 277 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents a comprehensive review of the methods and approaches being adopted to push forward the boundaries of computational catalysis.
Book Synopsis Electrolytes for Lithium and Lithium-Ion Batteries by : T. Richard Jow
Download or read book Electrolytes for Lithium and Lithium-Ion Batteries written by T. Richard Jow and published by Springer. This book was released on 2014-05-06 with total page 488 pages. Available in PDF, EPUB and Kindle. Book excerpt: 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.
Book Synopsis Magnesium Batteries by : Maximilian Fichtner
Download or read book Magnesium Batteries written by Maximilian Fichtner and published by Royal Society of Chemistry. This book was released on 2019-09-13 with total page 352 pages. Available in PDF, EPUB and Kindle. Book excerpt: The quest for efficient and durable battery technologies is one of the key challenges for enabling the transition to renewable energy economies. Magnesium batteries, and in particular rechargeable non-aqueous systems, are an area of extensive opportunity and intense research. Rechargeable magnesium batteries hold numerous advantages over current lithium-ion batteries, namely the relative abundance of magnesium to lithium and the potential for magnesium batteries to greatly outperform their Li-ion counterparts. Magnesium Batteries comprehensively outlines the scientific and technical challenges in the field, covering anodes, cathodes, electrolytes and particularly promising systems such as the Mg–S cell. Edited by a leading figure in the field of electrochemical energy storage, with contributions from global experts, this book is a vital resource for students and researchers at all levels. Whether entering into the subject for the first time or extending their knowledge of battery materials across chemistry, physics, energy, engineering and materials science this book provides an ideal reference for anyone interested in the state-of-the-art and future of magnesium batteries.
Book Synopsis Practical Aspects of Computational Chemistry V by : Jerzy Leszczynski
Download or read book Practical Aspects of Computational Chemistry V written by Jerzy Leszczynski and published by Springer Nature. This book was released on 2021-10-21 with total page 292 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book presents contributions on a wide range of computational research applied to fields ranging from molecular systems to bulk structures. This volume highlights current trends in modern computational chemistry and discusses the development of theoretical methodologies, state-of-the-art computational algorithms and their practical applications. This volume is part of a continuous effort by the editors to document recent advances by prominent researchers in the area of computational chemistry. Most of the chapters are contributed by invited speakers and participants to International annual conference “Current Trends in Computational Chemistry”, organized by Jerzy Leszczynski, one of the editors of the current volume. This conference series has become an exciting platform for eminent theoretical and computational chemists to discuss their recent findings and is regularly honored by the presence of Nobel laureates. Topics covered in the book include reactive force-field methodologies, coarse-grained modeling, DNA damage radiosensitizers, modeling and simulation of surfaces and interfaces, non-covalent interactions, and many others. The book is intended for theoretical and computational chemists, physical chemists, material scientists and those who are eager to apply computational chemistry methods to problems of chemical and physical importance. It is a valuable resource for undergraduate, graduate and PhD students as well as for established researchers.
Book Synopsis Handbook of Supercapacitor Materials by : Rajender Boddula
Download or read book Handbook of Supercapacitor Materials written by Rajender Boddula and published by John Wiley & Sons. This book was released on 2021-12-20 with total page 356 pages. Available in PDF, EPUB and Kindle. Book excerpt: Introduction to Electromagnetic Waves with Maxwell???s Equations Discover an innovative and fresh approach to teaching classical electromagnetics at a foundational level Introduction to Electromagnetic Waves with Maxwell???s Equations delivers an accessible and practical approach to teaching the well-known topics all electromagnetics instructors must include in their syllabus. Based on the author???s decades of experience teaching the subject, the book is carefully tuned to be relevant to an audience of engineering students who have already been exposed to the basic curricula of linear algebra and multivariate calculus. Forming the backbone of the book, Maxwell???s equations are developed step-by-step in consecutive chapters, while related electromagnetic phenomena are discussed simultaneously. The author presents accompanying mathematical tools alongside the material provided in the book to assist students with retention and comprehension. The book contains over 100 solved problems and examples with stepwise solutions offered alongside them. An accompanying website provides readers with additional problems and solutions. Readers will also benefit from the inclusion of: A thorough introduction to preliminary concepts in the field, including scalar and vector fields, cartesian coordinate systems, basic vector operations, orthogonal coordinate systems, and electrostatics, magnetostatics, and electromagnetics An exploration of Gauss??? Law, including integral forms, differential forms, and boundary conditions A discussion of Ampere???s Law, including integral and differential forms and Stoke???s Theorem An examination of Faraday???s Law, including integral and differential forms and the Lorentz Force Law Perfect for third- and fourth-year undergraduate students in electrical engineering, mechanical engineering, applied maths, physics, and computer science, Introduction to Electromagnetic Waves with Maxwell???s Equations will also earn a place in the libraries of graduate and postgraduate students in any STEM program with applications in electromagnetics.
Book Synopsis Machine Learning in Chemistry by : Hugh M. Cartwright
Download or read book Machine Learning in Chemistry written by Hugh M. Cartwright and published by Royal Society of Chemistry. This book was released on 2020-07-15 with total page 564 pages. Available in PDF, EPUB and Kindle. Book excerpt: Progress in the application of machine learning (ML) to the physical and life sciences has been rapid. A decade ago, the method was mainly of interest to those in computer science departments, but more recently ML tools have been developed that show significant potential across wide areas of science. There is a growing consensus that ML software, and related areas of artificial intelligence, may, in due course, become as fundamental to scientific research as computers themselves. Yet a perception remains that ML is obscure or esoteric, that only computer scientists can really understand it, and that few meaningful applications in scientific research exist. This book challenges that view. With contributions from leading research groups, it presents in-depth examples to illustrate how ML can be applied to real chemical problems. Through these examples, the reader can both gain a feel for what ML can and cannot (so far) achieve, and also identify characteristics that might make a problem in physical science amenable to a ML approach. This text is a valuable resource for scientists who are intrigued by the power of machine learning and want to learn more about how it can be applied in their own field.
Book Synopsis Rare Earth Elements by : Gordon Haxel
Download or read book Rare Earth Elements written by Gordon Haxel and published by . This book was released on 2002 with total page 4 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Book Synopsis Nanomaterials and Nanocomposites for Environmental Remediation by : Swatantra P. Singh
Download or read book Nanomaterials and Nanocomposites for Environmental Remediation written by Swatantra P. Singh and published by Springer Nature. This book was released on 2021-08-10 with total page 341 pages. Available in PDF, EPUB and Kindle. Book excerpt: p="" This monograph focuses on recent development of nanomaterials and nanocomposites for pollution measurement and their control in water, air, and soil. The contents incorporate carbon-based, metal-based, and metal-organic framework based nanomaterials and nanocomposites for emerging contaminants (pharmaceuticals and personal care products) degradation, disinfection, and other traditional pollutants degradation and removal. The book also offers updated literature for researchers and academicians working in the field of environmental remediation by nanomaterials. Readers will learn about different metal and non-metal based nanoparticles for environmental remediation. It will be a useful guide for professionals, and post-graduate students involved in material science & engineering, chemical engineering and environmental nanotechnology research. ^
Book Synopsis Science and Application of Nanotubes by : D. Tománek
Download or read book Science and Application of Nanotubes written by D. Tománek and published by Springer Science & Business Media. This book was released on 2005-12-17 with total page 393 pages. Available in PDF, EPUB and Kindle. Book excerpt: This series of books, which is published at the rate of about one per year, addresses fundamental problems in materials science. The contents cover a broad range of topics from small clusters of atoms to engineering materials and involve chemistry, physics, materials science, and engineering, with length scales ranging from Ångstroms up to millimeters. The emphasis is on basic science rather than on applications. Each book focuses on a single area of current interest and brings together leading experts to give an up-to-date discussion of their work and the work of others. Each article contains enough references that the interested reader can access the relevant literature. Thanks are given to the Center for Fundamental Materials Research at Michigan State University for supporting this series. M. F. Thorpe, Series Editor E-mail: thorpe@pa. msu. edu East Lansing, Michigan V PREFACE It is hard to believe that not quite ten years ago, namely in 1991, nanotubes of carbon were discovered by Sumio Iijima in deposits on the electrodes of the same carbon arc apparatus that was used to produce fullerenes such as the “buckyball”. Nanotubes of carbon or other materials, consisting ofhollow cylinders that are only a few nanometers in diameter, yet up to millimeters long, are amazing structures that self-assemble under extreme conditions. Their quasi-one-dimensional character and virtual absence of atomic defects give rise to a plethora of unusual phenomena.
Book Synopsis The Fragment Molecular Orbital Method by : Dmitri Fedorov
Download or read book The Fragment Molecular Orbital Method written by Dmitri Fedorov and published by CRC Press. This book was released on 2009-05-14 with total page 304 pages. Available in PDF, EPUB and Kindle. Book excerpt: Answering the need to facilitate quantum-chemical calculations of systems with thousands of atoms, Kazuo Kitaura and his coworkers developed the Fragment Molecular Orbital (FMO) method in 1999. Today, the FMO method can be applied to the study of whole proteins and protein-ligand interactions, and is extremely effective in calculating the propertie
Book Synopsis Adhesion Measurement Methods by : Robert Lacombe
Download or read book Adhesion Measurement Methods written by Robert Lacombe and published by CRC Press. This book was released on 2005-11-21 with total page 448 pages. Available in PDF, EPUB and Kindle. Book excerpt: Adhesion Measurement Methods: Theory and Practice provides practical information on the most important measurement techniques, their unique advantages and disadvantages, and the selection of the proper method for a given application. It includes useful information and formulae on adhesion related matters such as driving force formulae for various m
Book Synopsis Transition Metals in Coordination Environments by : Ewa Broclawik
Download or read book Transition Metals in Coordination Environments written by Ewa Broclawik and published by Springer. This book was released on 2019-03-16 with total page 540 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book focuses on the electronic properties of transition metals in coordination environments. These properties are responsible for the unique and intricate activity of transition metal sites in bio- and inorganic catalysis, but also pose challenges for both theoretical and experimental studies. Written by an international group of recognized experts, the book reviews recent advances in computational modeling and discusses their interplay using experiments. It covers a broad range of topics, including advanced computational methods for transition metal systems; spectroscopic, electrochemical and catalytic properties of transition metals in coordination environments; metalloenzymes and biomimetic compounds; and spin-related phenomena. As such, the book offers an invaluable resource for all researchers and postgraduate students interested in both fundamental and application-oriented research in the field of transition metal systems.
Book Synopsis Isabella at the Library by : Kate Mahoney-Veitch
Download or read book Isabella at the Library written by Kate Mahoney-Veitch and published by . This book was released on 2019-01-24 with total page 29 pages. Available in PDF, EPUB and Kindle. Book excerpt: Isabella is a little girl who adores soft toys and books. She loves making up magical stories where her soft toys come to life and have exciting adventures with her. In this story Isabella and her soft toys go to the library where they visit the world of nursery rhymes.
Book Synopsis Lithium Batteries by : Bruno Scrosati
Download or read book Lithium Batteries written by Bruno Scrosati and published by John Wiley & Sons. This book was released on 2013-06-18 with total page 495 pages. Available in PDF, EPUB and Kindle. Book excerpt: Explains the current state of the science and points the way to technological advances First developed in the late 1980s, lithium-ion batteries now power everything from tablet computers to power tools to electric cars. Despite tremendous progress in the last two decades in the engineering and manufacturing of lithium-ion batteries, they are currently unable to meet the energy and power demands of many new and emerging devices. This book sets the stage for the development of a new generation of higher-energy density, rechargeable lithium-ion batteries by advancing battery chemistry and identifying new electrode and electrolyte materials. The first chapter of Lithium Batteries sets the foundation for the rest of the book with a brief account of the history of lithium-ion battery development. Next, the book covers such topics as: Advanced organic and ionic liquid electrolytes for battery applications Advanced cathode materials for lithium-ion batteries Metal fluorosulphates capable of doubling the energy density of lithium-ion batteries Efforts to develop lithium-air batteries Alternative anode rechargeable batteries such as magnesium and sodium anode systems Each of the sixteen chapters has been contributed by one or more leading experts in electrochemistry and lithium battery technology. Their contributions are based on the latest published findings as well as their own firsthand laboratory experience. Figures throughout the book help readers understand the concepts underlying the latest efforts to advance the science of batteries and develop new materials. Readers will also find a bibliography at the end of each chapter to facilitate further research into individual topics. Lithium Batteries provides electrochemistry students and researchers with a snapshot of current efforts to improve battery performance as well as the tools needed to advance their own research efforts.
