Computational, Theoretical Investigation of Materials for a Sustainable Energy Future

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Publisher :
ISBN 13 :
Total Pages : 186 pages
Book Rating : 4.:/5 (96 download)

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Book Synopsis Computational, Theoretical Investigation of Materials for a Sustainable Energy Future by : Shannon Kaylie Stauffer

Download or read book Computational, Theoretical Investigation of Materials for a Sustainable Energy Future written by Shannon Kaylie Stauffer and published by . This book was released on 2016 with total page 186 pages. Available in PDF, EPUB and Kindle. Book excerpt: Over the past several decades there has been significant progress in electronic structure theory, statistical sampling algorithms and computational resources which can be leveraged to calculate fundamental properties of materials and estimate rates of relevant chemical reactions. In the following dissertation, I use computational methods to address the materials problem of a sustainable energy future. Energy storage technologies have played a vital role in the mobile-technology revolution and the transition to utilize more sustainable energy sources; however improvements to the energy density, charge/discharge rate, and safety of rechargeable batteries are needed to realize the ambitious goals of fully electric vehicles and on-grid storage in areas with intermittent, renewable power sources. Li-ion batteries, in general, have a potential to fulfill these demands. In the following work, a new, high energy density electrode material with little capacity loss is considered. Additionally, the complex interaction between an electrode/electrolyte model system is considered in a potential dependent computational framework. Having a sustainable energy future also means utilizing energy-efficient processing in industrial scale applications. Separation processes use roughly 12% of all energy consumed in the United States due to energy-intensive thermal separation techniques. A final study looks at an alloy catalysts for the separation of ethylene from ethane/ethylene mixtures. A unique selectivity property was discovered that may help design catalysts to replace thermal separation of gases.

Computational Approaches to Energy Materials

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Publisher : John Wiley & Sons
ISBN 13 : 1118551443
Total Pages : 423 pages
Book Rating : 4.1/5 (185 download)

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Book Synopsis Computational Approaches to Energy Materials by : Richard Catlow

Download or read book Computational Approaches to Energy Materials written by Richard Catlow and published by John Wiley & Sons. This book was released on 2013-04-03 with total page 423 pages. Available in PDF, EPUB and Kindle. Book excerpt: The development of materials for clean and efficient energy generation and storage is one of the most rapidly developing, multi-disciplinary areas of contemporary science, driven primarily by concerns over global warming, diminishing fossil-fuel reserves, the need for energy security, and increasing consumer demand for portable electronics. Computational methods are now an integral and indispensable part of the materials characterisation and development process. Computational Approaches to Energy Materials presents a detailed survey of current computational techniques for the development and optimization of energy materials, outlining their strengths, limitations, and future applications. The review of techniques includes current methodologies based on electronic structure, interatomic potential and hybrid methods. The methodological components are integrated into a comprehensive survey of applications, addressing the major themes in energy research. Topics covered include: • Introduction to computational methods and approaches • Modelling materials for energy generation applications: solar energy and nuclear energy • Modelling materials for storage applications: batteries and hydrogen • Modelling materials for energy conversion applications: fuel cells, heterogeneous catalysis and solid-state lighting • Nanostructures for energy applications This full colour text is an accessible introduction for newcomers to the field, and a valuable reference source for experienced researchers working on computational techniques and their application to energy materials.

A Theoretical Investigation of New Materials with Applications in Renewable Energy

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Publisher :
ISBN 13 :
Total Pages : 54 pages
Book Rating : 4.:/5 (886 download)

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Book Synopsis A Theoretical Investigation of New Materials with Applications in Renewable Energy by : Tyler Jordan Harrison

Download or read book A Theoretical Investigation of New Materials with Applications in Renewable Energy written by Tyler Jordan Harrison and published by . This book was released on 2014 with total page 54 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Energy Materials Discovery

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Publisher : Royal Society of Chemistry
ISBN 13 : 1839163836
Total Pages : 464 pages
Book Rating : 4.8/5 (391 download)

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Book Synopsis Energy Materials Discovery by : Geoffrey A Ozin

Download or read book Energy Materials Discovery written by Geoffrey A Ozin and published by Royal Society of Chemistry. This book was released on 2022-06-13 with total page 464 pages. Available in PDF, EPUB and Kindle. Book excerpt: Materials have the potential to be the centrepiece for the transition to viable renewable energy technologies if they realise a specific suite of properties and achieve a desired set of performance metrics. The envisioned transition involves the discovery of materials that enable generation, conversion, storage, transmission, and utilization of renewable energy. This book presents, through the eye of materials chemistry, an umbrella view of the myriad of classes of materials that make renewable energy technologies work. They are poised to facilitate the transition of non-renewable and unsustainable energy systems of the past into renewable and sustainable energy systems of the future. It is a story that often begins in chemistry laboratories with the discovery of new energy materials. Yet, to displace materials in existing energy technologies with new ones, depends not only on the ability to design and engineer a superior set of performance metrics for the material and the technology but also the requirement to meet a demanding collection of economic, regulatory, social, policy, environmental and sustainability criteria. Disruption in the traditional way of discovering materials is coming with the emergence of artificial intelligence, machine learning and robotic automation designed to accelerate the well-established discovery process, massive libraries of materials can be evaluated and the possibilities are endless. This book provides a perspective on the application of these new technologies to this field as well as an overview of energy materials discovery in the broader techno-economic and social context. Any budding researcher or more experienced materials scientist will find a guide to a fascinating story of discovery and emerge with a vision of what is next.

Fueling the Future

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Publisher :
ISBN 13 :
Total Pages : 376 pages
Book Rating : 4.0/5 (14 download)

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Book Synopsis Fueling the Future by : United States. Congress. House. Committee on Science. Subcommittee on Energy

Download or read book Fueling the Future written by United States. Congress. House. Committee on Science. Subcommittee on Energy and published by . This book was released on 2006 with total page 376 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Materials for Sustainable Energy

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Publisher : World Scientific
ISBN 13 : 9814317640
Total Pages : 360 pages
Book Rating : 4.8/5 (143 download)

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Book Synopsis Materials for Sustainable Energy by : Vincent Dusastre

Download or read book Materials for Sustainable Energy written by Vincent Dusastre and published by World Scientific. This book was released on 2011 with total page 360 pages. Available in PDF, EPUB and Kindle. Book excerpt: The search for cleaner, cheaper, smaller and more efficient energy technologies has to a large extent been motivated by the development of new materials. The aim of this collection of articles is therefore to focus on what materials-based solutions can offer and show how the rationale design and improvement of their physical and chemical properties can lead to energy-production alternatives that have the potential to compete with existing technologies. In terms of alternative means to generate electricity that utilize renewable energy sources, the most dramatic breakthroughs for both mobile (i.e., transportation) and stationary applications are taking place in the fields of solar and fuel cells. And from an energy-storage perspective, exciting developments can be seen emerging from the fields of rechargeable batteries and hydrogen storage.

Green Energy

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Publisher : Academic Press
ISBN 13 : 0323859496
Total Pages : 258 pages
Book Rating : 4.3/5 (238 download)

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Book Synopsis Green Energy by : M. A. Parvez Mahmud

Download or read book Green Energy written by M. A. Parvez Mahmud and published by Academic Press. This book was released on 2023-01-11 with total page 258 pages. Available in PDF, EPUB and Kindle. Book excerpt: Green Energy: A Sustainable Future looks at life cycle assessment theory, practice, and methodologies applied in renewable energy power plants. The state-of-the-art life cycle assessment methodologies applied in power generation units are discussed following LCA analysis and key findings from energy production processes. Providing fundamental knowledge of how to measure sustainability metrics using life cycle assessment in renewable power plants, this title outlines state-of-the-art research about LCA methodologies related to low-carbon energy systems, their outcome, and how to relate the sustainable power concept with a circular economy. With theoretical concepts of LCA applied in low-carbon power generation systems, outlining environmental impacts based on comprehensive examples and case studies in solar PV, solar thermal, hydropower plants and micro-grids, this book is of great interest to engineers, policy makers, researchers and academics in the area of electric power engineering. Consists of extensive and comprehensive life-cycle assessment examples and case studies for various renewable energy plants Enables power engineers to evaluate the sustainability index through environmental impact assessment in renewable power plants and micro-grids Includes assessment results showing future pathways for sustainability enhancement

Computational Intelligence Methods for Green Technology and Sustainable Development

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Publisher : Springer Nature
ISBN 13 : 3031196945
Total Pages : 685 pages
Book Rating : 4.0/5 (311 download)

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Book Synopsis Computational Intelligence Methods for Green Technology and Sustainable Development by : Yo-Ping Huang

Download or read book Computational Intelligence Methods for Green Technology and Sustainable Development written by Yo-Ping Huang and published by Springer Nature. This book was released on 2022-12-14 with total page 685 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book provides readers with peer-reviewed research papers presented at the 6th International Conference on Green Technology and Sustainable Development (GTSD) held in Nha Trang City, Vietnam, from July 29 to 30, 2022. The book is original work of researchers from academia and industry focusing on the theme “Green technology and sustainable development in Industrial Revolution 4.0” not only to raise awareness of the vital importance of sustainability in education, technology, and economic development, but also to highlight the essential roles of technology innovation for the green future. The book presents a wide range of research aspects including energy engineering, electric power systems, renewable energy systems, automatic control engineering, robotics, vehicle engineering, material engineering, construction engineering, mechanical engineering, vibrations, computational analysis, numerical investigation, system failure, technological solutions in health care, and so on. Through thorough research basing on both experimental and numerical methods, the authors feature either solutions for existing problems or optimization and improvement for performance of existing methods. The collected research results could be useful alternatives and implications for industry experts, research institutions, universities, and all others who share a common interest in the future global sustainable development.

Computational Materials Discovery

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Publisher : Royal Society of Chemistry
ISBN 13 : 1782629610
Total Pages : 470 pages
Book Rating : 4.7/5 (826 download)

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Book Synopsis Computational Materials Discovery by : Artem Oganov

Download or read book Computational Materials Discovery written by Artem Oganov and published by Royal Society of Chemistry. This book was released on 2018-10-30 with total page 470 pages. Available in PDF, EPUB and Kindle. Book excerpt: A unique and timely book providing an overview of both the methodologies and applications of computational materials design.

fueling the future: on the road to the hydrogen economy

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Publisher : DIANE Publishing
ISBN 13 : 1422332829
Total Pages : 366 pages
Book Rating : 4.4/5 (223 download)

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Book Synopsis fueling the future: on the road to the hydrogen economy by :

Download or read book fueling the future: on the road to the hydrogen economy written by and published by DIANE Publishing. This book was released on with total page 366 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Theoretical Investigation of Solar Energy Conversion and Water Oxidation Catalysis

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Publisher :
ISBN 13 :
Total Pages : 196 pages
Book Rating : 4.:/5 (746 download)

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Book Synopsis Theoretical Investigation of Solar Energy Conversion and Water Oxidation Catalysis by : Lee-Ping Wang

Download or read book Theoretical Investigation of Solar Energy Conversion and Water Oxidation Catalysis written by Lee-Ping Wang and published by . This book was released on 2011 with total page 196 pages. Available in PDF, EPUB and Kindle. Book excerpt: Solar energy conversion and water oxidation catalysis are two great scientific and engineering challenges that will play pivotal roles in a future sustainable energy economy. In this work, I apply electronic structure theory and molecular dynamics simulation methods to understand some of the detailed mechanisms behind solar energy conversion and water oxidation catalysis. I will present a detailed atomistic picture of charge separation processes at a donor-acceptor interface between two organic semiconductor materials in an organic photovoltaic device. This will be followed by an investigation of the water oxidation mechanism of a homogeneous ruthenium water-splitting catalyst and a heterogeneous cobalt phosphate water-splitting catalyst. I will also introduce several advances in theoretical methods that allow us to more accurately compute observables that are critically relevant to the operation and performance of these materials and devices.

Efficient, Effective, Accountable

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Publisher : Government Printing Office
ISBN 13 : 9780160944819
Total Pages : 1318 pages
Book Rating : 4.9/5 (448 download)

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Book Synopsis Efficient, Effective, Accountable by : United States. Office of Management and Budget

Download or read book Efficient, Effective, Accountable written by United States. Office of Management and Budget and published by Government Printing Office. This book was released on 2018 with total page 1318 pages. Available in PDF, EPUB and Kindle. Book excerpt:

Research Topics in Bioactivity, Environment and Energy

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Publisher : Springer Nature
ISBN 13 : 3031076222
Total Pages : 729 pages
Book Rating : 4.0/5 (31 download)

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Book Synopsis Research Topics in Bioactivity, Environment and Energy by : Carlton A. Taft

Download or read book Research Topics in Bioactivity, Environment and Energy written by Carlton A. Taft and published by Springer Nature. This book was released on 2022-09-05 with total page 729 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book covers edge-point applications in science and engineering. The chapters discuss the functional properties of advanced engineering materials and biomolecules, improving the comprehension of their chemical physical properties and potential for new technological and medicinal applications. The book presents a small number of experimental techniques and computational simulation models from basic concepts of classical/quantum mechanics, physics, chemistry, biology, statistical methods that can predict important applications and properties of these materials/biomolecules. The content shows how improving design of new systems helps in addressing future world problems (health, energy, food, environment, transportation, housing, clothing, etc.), i.e., almost every aspects of our daily lives.

Soft Computing Applications

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Publisher : Springer
ISBN 13 : 9811080496
Total Pages : 170 pages
Book Rating : 4.8/5 (11 download)

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Book Synopsis Soft Computing Applications by : Kanad Ray

Download or read book Soft Computing Applications written by Kanad Ray and published by Springer. This book was released on 2018-03-29 with total page 170 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book provides a reference guide for researchers, scientists and industrialists working in the area of soft computing, and highlights the latest advances in and applications of soft computing techniques in multidisciplinary areas. Gathering papers presented at the International Conference on Soft Computing: Theories and Applications (SoCTA 2016), which was held in Jaipur, Rajasthan, India, on December 28–30, 2016, it focuses on applying soft computing to solve real-life problems arising in various domains, from medical and healthcare to supply chain management, image processing and cryptanalysis. The term soft computing represents an umbrella term for computational techniques like fuzzy logic, neural networks and nature inspired algorithms. In the past few decades, there has been an exponential rise in the application of soft computing techniques to address complex and intricate problems in diverse spheres of life. The versatility of these techniques has made them a favourite among scientists and researchers alike.

Spirooxindole

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Publisher : Elsevier
ISBN 13 : 0443223254
Total Pages : 660 pages
Book Rating : 4.4/5 (432 download)

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Book Synopsis Spirooxindole by : Gautam Patel

Download or read book Spirooxindole written by Gautam Patel and published by Elsevier. This book was released on 2024-06-28 with total page 660 pages. Available in PDF, EPUB and Kindle. Book excerpt: Modern advances in organic synthesis require compouds having attractive properties with high percentage of yield. Spirooxindole examines the current state of the art, recent progress and new challenges associated with the development of spirooxindole derivatives for various medicinal applications. Owing to their exceptional properties, these compounds can be used in vaious fields, including chemical and pharma industries, and in clinical research. This book has chapters written by experts in several different areas. It serves as a useful reference book for scientists, industrial practitioners, graduate students, and other professionals in the field of hetrocyclic chemistry, medicinal chemistry, organic synthesis clinical research and chemical sciences.The growing interest among the academics and industrial researchers in the field of organic chemistry and medicinal chemistry is the driving force for the presentation of this edited book. Consolidates information on each aspect of this novel compound and its applications in various fields, covering the entire spectrum of up-to-date literature citations, current market, and patents Provides a comprehensive, in-depth description of spirooxindole derivatives as well as multipurpose scaffolds Highlights green synthesis and nanocatalysis Describes in-depth various medicinal applications Covers both synthesis and applications

Carbon Nitride Nanostructures for Sustainable Energy Production and Environmental Remediation

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Publisher : Royal Society of Chemistry
ISBN 13 : 1839162139
Total Pages : 397 pages
Book Rating : 4.8/5 (391 download)

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Book Synopsis Carbon Nitride Nanostructures for Sustainable Energy Production and Environmental Remediation by : Kamel Abdelmoniem Mohamed Eid

Download or read book Carbon Nitride Nanostructures for Sustainable Energy Production and Environmental Remediation written by Kamel Abdelmoniem Mohamed Eid and published by Royal Society of Chemistry. This book was released on 2021-07-07 with total page 397 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book covers recent advances in the rational design and characterization of gCN nanostructures for energy and environmental remediation.

Materials for Electronic, Magnetic, and Spintronic Technologies

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Publisher : Springer Nature
ISBN 13 : 3031645421
Total Pages : 261 pages
Book Rating : 4.0/5 (316 download)

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Book Synopsis Materials for Electronic, Magnetic, and Spintronic Technologies by : Amodini Mishra

Download or read book Materials for Electronic, Magnetic, and Spintronic Technologies written by Amodini Mishra and published by Springer Nature. This book was released on with total page 261 pages. Available in PDF, EPUB and Kindle. Book excerpt: