Download or read book Combinatorial Development Of Solid Catalytic Materials Design Of High throughput Experiments Data Analysis Data Mining written by Manfred Baerns and published by World Scientific. This book was released on 2009-11-26 with total page 191 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book provides a comprehensive treatment of combinatorial development of heterogeneous catalysts. In particular, two computer-aided approaches that have played a key role in combinatorial catalysis and high-throughput experimentation during the last decade — evolutionary optimization and artificial neural networks — are described. The book is unique in that it describes evolutionary optimization in a broader context of methods of searching for optimal catalytic materials, including statistical design of experiments, as well as presents neural networks in a broader context of data analysis. It is the first book that demystifies the attractiveness of artificial neural networks, explaining its rational fundamental — their universal approximation capability. At the same time, it shows the limitations of that capability and describes two methods for how it can be improved. The book is also the first that presents two other important topics pertaining to evolutionary optimization and artificial neural networks: automatic generating of problem-tailored genetic algorithms, and tuning evolutionary algorithms with neural networks. Both are not only theoretically explained, but also well illustrated through detailed case studies./a
Download or read book In vitro Materials Design written by Roman Leitsmann and published by John Wiley & Sons. This book was released on 2015-08-10 with total page 236 pages. Available in PDF, EPUB and Kindle. Book excerpt: An overview of the latest computational materials science methods on an atomic scale. The authors present the physical and mathematical background in sufficient detail for this highly current and important topic, but without unnecessary complications. They focus on approaches with industrial relevance, covering real-life applications taken from concrete projects that range from tribology modeling to performance optimization of integrated circuits. Following an introduction to the fundamentals, the book describes the most relevant approaches, covering such classical simulation methods as simple and reactive force field methods, as well as highly accurate quantum-mechanical methods ranging from density-functional theory to Hartree-Fock and beyond. A review of the increasingly important multiscale approaches rounds off this section. The last section demonstrates and illustrates the capabilities of the methods previously described using recent real-life examples of industrial applications. As a result, readers gain a heightened user awareness, since the authors clearly state the conditions of applicability for the respective modeling methods so as to avoid fatal mistakes.
Download or read book Electrocatalytic Materials written by Santanu Patra and published by Springer Nature. This book was released on with total page 631 pages. Available in PDF, EPUB and Kindle. Book excerpt:
Download or read book Polymer Electrolyte Fuel Cells written by Michael Eikerling and published by CRC Press. This book was released on 2014-09-23 with total page 567 pages. Available in PDF, EPUB and Kindle. Book excerpt: The book provides a systematic and profound account of scientific challenges in fuel cell research. The introductory chapters bring readers up to date on the urgency and implications of the global energy challenge, the prospects of electrochemical energy conversion technologies, and the thermodynamic and electrochemical principles underlying the op
Download or read book Catalysis written by James J Spivey and published by Royal Society of Chemistry. This book was released on 2021-06-14 with total page 494 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume looks at modern approaches to catalysis and reviews the extensive literature. Chapters highlight application of 2D materials in biomass conversion catalysis, plasmonic photocatalysis, catalytic demonstration of mesoporosity in the hierarchical zeolite and the effect of surface phase oxides on supported metals and catalysis. Looking to the future a chapter on ab initio machine learning for accelerating catalytic materials discovery is included. Appealing broadly to researchers in academia and industry, these illustrative chapters bridge the gap from academic studies in the laboratory to practical applications in industry not only for catalysis field but also for environmental protection. Other chapters with an industrial perspective include heterogeneous and homogeneous catalytic routes for vinyl acetate synthesis, catalysis for production of jet fuel from renewable sources by HDO/HDC and microwave-assisted catalysis for fuel conversion. Chemical reactions in ball mills is also explored. The book will be of great benefit to any researcher wanting a succinct reference on developments in this area now and looking to the future.
Download or read book Catalysis written by James Spivey and published by Royal Society of Chemistry. This book was released on 2020-02-05 with total page 246 pages. Available in PDF, EPUB and Kindle. Book excerpt: Catalysts are required for a variety of applications and researchers are increasingly challenged to find cost effective and environmentally benign catalysts to use. This volume looks at modern approaches to catalysis and reviews the extensive literature. Chapters highlight reactions active under oxidative coupling of methane conditions and how they are interlinked, heterogeneous nickel catalysts and their use in laboratory and industry, the reaction mechanism of heterogeneous catalysis with the surface science probe, the concepts of electroless deposition (ED) methods for preparation of true bimetallic catalysts, the general subject of metal-support interactions occurring over ruthenium-based catalysts and benzene as the target volatile organic compound (VOC). Appealing broadly to researchers in academia and industry, these illustrative chapters bridge the gap from academic studies in the laboratory to practical applications in industry not only for catalysis field but also for environmental protection. The book will be of great benefit to any researcher wanting a succinct reference on developments in this area now and looking to the future.
Download or read book Atomic Clusters with Unusual Structure Bonding and Reactivity written by Pratim Kumar Chattaraj and published by Elsevier. This book was released on 2022-10-06 with total page 446 pages. Available in PDF, EPUB and Kindle. Book excerpt: Atomic Clusters with Unusual Structure, Bonding and Reactivity: Theoretical Approaches, Computational Assessment and Applications reviews the latest computational tools and approaches available for accurately assessing the properties of a cluster, while also highlighting how such clusters can be adapted and utilized for the development of novel materials and applications. Sections provide an introduction to the computational methods used to obtain global minima for clusters and effectively analyze bonds, outline experimental approaches to produce clusters, discuss specific applications, and explore cluster reactivity and usage across a number of fields.Drawing on the knowledge of its expert editors and contributors, this book provides a detailed guide to ascertaining the stability, bonding and properties of atomic clusters. Atomic clusters, which exhibit unusual properties, offer huge potential as building blocks for new materials and novel applications, but understanding their properties, stability and bonding is essential in order to accurately understand, characterize and manipulate them for further use. Searching for the most stable geometry of a given cluster is difficult and becomes even more so for clusters of medium and large sizes, where the number of possible isomers sharply increase, hence this book provides a unique and comprehensive approach to the topic and available techniques and applications. - Introduces readers to the vast structural and bonding diversity that clusters show and reflects on their potential for novel application and material development - Highlights the latest computational methods and theoretical tools available for identification of the most stable isomers and accurate analysis of bonding in the clusters - Focuses on clusters which violate the rules established in traditional chemistry and exhibit unusual structure, bonding and reactivity
Download or read book Advanced Power Plant Materials Design and Technology written by Dermot Roddy and published by Elsevier. This book was released on 2010-05-24 with total page 447 pages. Available in PDF, EPUB and Kindle. Book excerpt: Fossil-fuel power plants account for the majority of worldwide power generation. Increasing global energy demands, coupled with issues of ageing and inefficient power plants, have led to new power plant construction programmes. As cheaper fossil fuel resources are exhausted and emissions criteria are tightened, utilities are turning to power plants designed with performance in mind to satisfy requirements for improved capacity, efficiency, and environmental characteristics.Advanced power plant materials, design and technology provides a comprehensive reference on the state of the art of gas-fired and coal-fired power plants, their major components and performance improvement options. Part one critically reviews advanced power plant designs which target both higher efficiency and flexible operation, including reviews of combined cycle technology and materials performance issues.Part two reviews major plant components for improved operation, including advanced membrane technology for both hydrogen (H2) and carbon dioxide (CO2) separation, as well as flue gas handling technologies for improved emissions control of sulphur oxides (SOx), nitrogen oxides (NOx), mercury, ash and particulates. The section concludes with coverage of high-temperature sensors, and monitoring and control technology that are essential to power plant operation and performance optimisation.Part three begins with coverage of low-rank coal upgrading and biomass resource utilisation for improved power plant fuel flexibility. Routes to improve the environmental impact are also reviewed, with chapters detailing the integration of underground coal gasification and the application of carbon dioxide (CO2) capture and storage. Finally, improved generation performance is reviewed with coverage of syngas and hydrogen (H2) production from fossil-fuel feedstocks.With its distinguished international team of contributors, Advanced power plant materials, design and technology is a standard reference for all power plant engineers and operators, as well as to academics and researchers in this field. - Provides a comprehensive reference on the state-of-the-art gas-fired and coal-fired power plants, their major components and performance improvement options - Examines major plant components for improved operation as well as flue gas handling technologies for improved emissions control - Routes to improve environmental impact are discussed with chapters detailing the integration of underground coal gasification
Download or read book Horizons in Sustainable Industrial Chemistry and Catalysis written by Stefania Albonetti and published by Elsevier. This book was released on 2019-02-13 with total page 446 pages. Available in PDF, EPUB and Kindle. Book excerpt: Horizons in Sustainable Industrial Chemistry and Catalysis, Volume 178, presents a comprehensive picture of recent developments in terms of sustainable industrial processes and the catalytic needs and opportunities to develop these novel routes. Each chapter includes an introduction and state-of-the-art in the field, along with a series of specific aspects and examples. The book identifies new opportunities for research that will help us transition to low carbon and sustainable energy and chemical production. Users will find an integrated view of the new possibilities in this area that unleashes new possibilities in energy and chemistry. - Combines an analysis of each scenario, the state-of-the art, and specific examples to help users better understand needs, opportunities, gaps and challenges - Offers an integrated view of new catalytic technologies that are needed for future use - Presents an interdisciplinary approach that combines broad expertise - Brings together experts in the area of sustainable industrial chemistry
Download or read book Functionalized Nanomaterials for Catalytic Application written by Chaudhery Mustansar Hussain and published by John Wiley & Sons. This book was released on 2021-07-21 with total page 530 pages. Available in PDF, EPUB and Kindle. Book excerpt: Functionalized Nanomaterials for Catalytic Application
Download or read book Emerging Carbon Materials for Catalysis written by Samahe Sadjadi and published by Elsevier. This book was released on 2020-09-24 with total page 450 pages. Available in PDF, EPUB and Kindle. Book excerpt: Emerging Carbon Materials for Catalysis covers various carbon-based materials with a focus on their utility for catalysis. Each chapter examines the photo and electrocatalytic applications of a material, including hybrid systems composed of carbon materials. The range of chemical reactions that can be catalyzed with each material—as well as the potential drawbacks of each—are discussed. Covering nanostructured systems, as well as other microstructured materials, the book reviews emerging carbon-based structures, including carbon organic frameworks. Written by a global team of experts, this volume is ideal for graduate students and researchers working in organic chemistry, catalysis, nanochemistry, and nanomaterials. - Introduces novel and emerging carbon materials with utility for photocatalysis and electrocatalysis - Covers a wide range of photochemical and electrochemical processes that can be catalyzed by carbon-based catalysts - Addresses the hybrid systems composed of carbon materials for catalysis - Serves as an ideal reference for graduate students and researchers working in organic chemistry, catalysis, nanochemistry, and nanomaterials.
Download or read book Heterogeneous Catalysts written by Wey Yang Teoh and published by John Wiley & Sons. This book was released on 2021-02-23 with total page 768 pages. Available in PDF, EPUB and Kindle. Book excerpt: Presents state-of-the-art knowledge of heterogeneous catalysts including new applications in energy and environmental fields This book focuses on emerging techniques in heterogeneous catalysis, from new methodology for catalysts design and synthesis, surface studies and operando spectroscopies, ab initio techniques, to critical catalytic systems as relevant to energy and the environment. It provides the vision of addressing the foreseeable knowledge gap unfilled by classical knowledge in the field. Heterogeneous Catalysts: Advanced Design, Characterization and Applications begins with an overview on the evolution in catalysts synthesis and introduces readers to facets engineering on catalysts; electrochemical synthesis of nanostructured catalytic thin films; and bandgap engineering of semiconductor photocatalysts. Next, it examines how we are gaining a more precise understanding of catalytic events and materials under working conditions. It covers bridging pressure gap in surface catalytic studies; tomography in catalysts design; and resolving catalyst performance at nanoscale via fluorescence microscopy. Quantum approaches to predicting molecular reactions on catalytic surfaces follows that, along with chapters on Density Functional Theory in heterogeneous catalysis; first principles simulation of electrified interfaces in electrochemistry; and high-throughput computational design of novel catalytic materials. The book also discusses embracing the energy and environmental challenges of the 21st century through heterogeneous catalysis and much more. Presents recent developments in heterogeneous catalysis with emphasis on new fundamentals and emerging techniques Offers a comprehensive look at the important aspects of heterogeneous catalysis Provides an applications-oriented, bottoms-up approach to a high-interest subject that plays a vital role in industry and is widely applied in areas related to energy and environment Heterogeneous Catalysts: Advanced Design, Characterization and Applications is an important book for catalytic chemists, materials scientists, surface chemists, physical chemists, inorganic chemists, chemical engineers, and other professionals working in the chemical industry.
Download or read book Advances in Catalysis written by Chunshan Song and published by Academic Press. This book was released on 2018-11-26 with total page 184 pages. Available in PDF, EPUB and Kindle. Book excerpt: Advances in Catalysis, Volume 63 fills the gap between journal papers and textbooks across the diverse areas of catalysis research. For more than 60 years, this series has dedicated itself to record and present the latest progress in the field of catalysis, providing the scientific community with comprehensive and authoritative reviews. This series is an invaluable and comprehensive resource for chemical engineers and chemists working in the field of catalysis in both academia and industry. - Contains authoritative reviews written by experts in the field - Explores topics that reflect progress in the field, such as catalyst synthesis, catalyst characterization, catalytic chemistry, reaction engineering, computational chemistry and physics - Provides insightful and critical articles that are fully edited to suit various backgrounds
Download or read book Carbon Based Nanomaterials for Energy Conversion and Storage written by Jia-Nan Zhang and published by Springer Nature. This book was released on 2022-08-26 with total page 288 pages. Available in PDF, EPUB and Kindle. Book excerpt: This book systematically summarizes the advanced development of carbon-based nanomaterials for electrochemical catalysis, and it is comprised of four sections. The first section discusses about the fundamental synthesis, characterization techniques, and catalytic effects on the energy conversion and storage mechanism. The second section elaborately reviews various types of electrocatalytic reactions on carbon-based materials and their performance. The third section focuses on batteries about carbon-based materials with different storage mechanism. And the last one, the following enlightenment in terms of theoretical development and experimental research is provided to the general readers: 1) Precise design and construction of local atomic and electronic structures at the interface of catalysts; 2) Selective activation and directed conversion of carbon-based energy-carrying molecules at the interface; 3) Interaction mechanism and regulation of catalyst solid surface interface properties under environment and external field. This book will be useful for researchers and students who are interested in carbon-based nanomaterials, electrochemical catalysts and energy storage.
Download or read book Catalysis Volume 34 written by James Spivey and published by Royal Society of Chemistry. This book was released on 2022-07-07 with total page 273 pages. Available in PDF, EPUB and Kindle. Book excerpt: This volume looks at modern approaches to catalysis and reviews the extensive literature which bridges the gap from academic studies in the laboratory to practical applications in industry.
Download or read book Synthesis And Applications In Chemistry And Materials In 4 Volumes written by Armando J L Pombeiro and published by World Scientific. This book was released on 2024-01-16 with total page 2103 pages. Available in PDF, EPUB and Kindle. Book excerpt: Chemistry and Material Sciences naturally depend greatly on Synthesis as the initial stage for the existence of compounds and materials with desired behaviors, within the overall streamline of Design/Synthesis — Properties — Application/Function, and their relations. Such a general approach is of a too wide scope to be properly treated in a single set of publications, but this one on 'Synthesis and Applications in Chemistry and Materials' restricts itself by aiming to show the strength and international character of the current research in synthetic chemistry that is being developed in Portugal or abroad by teams that cooperate with this country. Hence, it gathers representative contributions of main Portuguese research groups and foreign collaborating ones. Nevertheless, the topic should be understood in a wide sense, being open to types of studies with significance on sustainable synthesis and applications in chemistry, materials and/or related sciences.
Download or read book Advanced Catalytic Materials written by Noreña Luis and published by BoD – Books on Demand. This book was released on 2016-02-03 with total page 500 pages. Available in PDF, EPUB and Kindle. Book excerpt: Todays chemical industry processes worldwide largely depend on catalytic reactions and the desirable future evolution of this industry toward more selective products, more environmentally friendly products, more energy-efficient processes, a smaller use of hazardous reagents, and a better use of raw materials also largely involves the development of better catalysts and, specifically, purposely designed catalytic materials. The careful study and development of the new-generation catalysts involve relatively large groups of specialists in universities, research centers, and industries, joining forces from different scientific and technical disciplines. This book has put together recent, state-of-the-art topics on current trends in catalytic materials and consists of 16 chapters.
