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Computer-Aided Design of Catalysts

Computer-Aided Design of Catalysts
Author: Robert Becker
Publisher: CRC Press
Total Pages: 648
Release: 2020-08-19
Genre: Science
ISBN: 1000148203

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This volume provides an update on recent developments in computer-aided design and modeling of catalysts for a variety of important industrial applications. Key hurdles in catalyst design are different for each application: the modeling frontiers for methane partial oxidation, automotive catalysis,


30th European Symposium on Computer Aided Chemical Engineering

30th European Symposium on Computer Aided Chemical Engineering
Author: Sauro Pierucci
Publisher: Elsevier
Total Pages: 2119
Release: 2020-10-23
Genre: Technology & Engineering
ISBN: 0128233788

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30th European Symposium on Computer Aided Chemical Engineering, Volume 47 contains the papers presented at the 30th European Symposium of Computer Aided Process Engineering (ESCAPE) event held in Milan, Italy, May 24-27, 2020. It is a valuable resource for chemical engineers, chemical process engineers, researchers in industry and academia, students, and consultants for chemical industries. Presents findings and discussions from the 30th European Symposium of Computer Aided Process Engineering (ESCAPE) event Offers a valuable resource for chemical engineers, chemical process engineers, researchers in industry and academia, students, and consultants for chemical industries


Combinatorial Catalysis and High Throughput Catalyst Design and Testing

Combinatorial Catalysis and High Throughput Catalyst Design and Testing
Author: E.G. Derouane
Publisher: Springer Science & Business Media
Total Pages: 497
Release: 2012-12-06
Genre: Science
ISBN: 9401143293

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Catalysts are central in modern industrial chemistry and there is an urgent need to develop new catalysts. Such a rapid pace of development brings with it a new set of challenges at all levels of research, from synthesis and characterization to testing and modelling. This book reviews the current status of combinatorial catalysis, scientific catalyst design techniques, methods for preparing inorganic combinatorial libraries, experimental design methods, data processing, system modelling an simulation, and catalyst testing. The individual contributions reveal the development of high throughput catalyst design and test methods and identify the main challenges in the field, including new catalyst preparation techniques, rapid performance evaluation, and new microreactor configurations. Readership: All those working in catalytic process analysis and development. The extensive review of catalysis principles is especially relevant for postgraduate students seeking to pursue studies in catalysis.


Computer Aided Innovation of New Materials II

Computer Aided Innovation of New Materials II
Author: M. Doyama
Publisher: Elsevier
Total Pages: 980
Release: 2017-01-31
Genre: Computers
ISBN: 1483291472

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With advanced materials being in the midst of a widely acknowledged revolution, there is relentless pressure on scientists and engineers to be on the cutting edge of emerging theories and design methodologies. The 379 papers in this two part volume bring together the experience of specialists in the entire field of applications of Materials Science. This multidisciplinary meeting was held to bring together workers in a wide range of materials science and engineering activities who employ common analytical and experimental methods in their day to day work. The results of the meeting are of worldwide interest, and will help to stimulate future research and analysis in this area.


Structured Catalysts and Reactors

Structured Catalysts and Reactors
Author: Andrzej Cybulski
Publisher: CRC Press
Total Pages: 828
Release: 2005-11-02
Genre: Science
ISBN: 1420028006

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Interest in structured catalysts is steadily increasing due to the already proven, as well as potential, advantages of these catalysts. Updating the comprehensive coverage of the first edition published in 1998 with the latest science and applications, Structured Catalysts and Reactors, Second Edition gives detailed information on all aspect


Catalyst Engineering Technology

Catalyst Engineering Technology
Author: Jean W. L. Beeckman
Publisher: John Wiley & Sons
Total Pages: 304
Release: 2020-07-28
Genre: Science
ISBN: 1119635012

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This book gives a comprehensive explanation of what governs the breakage of extruded materials, and what techniques are used to measure it. The breakage during impact aka collision is explained using basic laws of nature allowing readers to determine the handling severity of catalyst manufacturing equipment and the severity of entire plants. This information can then be used to improve on the architecture of existing plants and how to design grass-roots plants. The book begins with a summary of particle forming techniques in the particle technology industry. It covers extrusion technology in more detail since extrusion is one of the workhorses for particle manufacture. A section is also dedicated on how to describe transport and chemical reaction in such particulates for of course their final use. It presents the fundamentals of the study of breakage by relating basic laws in different fields (mechanics and physics) and this leads to two novel dimensionless groups that govern breakage. These topics are then apply these topics to R&D scale-up and manufacturing and shows how this approach is directly applicable.


Chemical Product Design: Towards a Perspective through Case Studies

Chemical Product Design: Towards a Perspective through Case Studies
Author: Ka M. Ng
Publisher: Elsevier
Total Pages: 513
Release: 2006-10-24
Genre: Technology & Engineering
ISBN: 0080466745

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Chemical Product Design: Towards a Perspective through Case Studies provides a framework for chemical product design problems which are clearly defined together with different solution approaches. This book covers the latest methods and tools currently available in the field and discusses future challenges that the chemical industry is faced with. It focuses on important issues of chemical product design and provides a good overview on industrial chemical product design problems through case studies supplied by leading experts. The editors of Chemical Product Design teach chemical product design at graduate level courses and also serve as consultants for various chemical companies. They have also developed experimental techniques for chemical product design as well as computer-aided design methods and tools. Highlights important issues of chemical product design through case studies Case studies supplied by leading experts in chemical product design Provides a complete framework for chemical product design


Fundamentals of Industrial Catalytic Processes

Fundamentals of Industrial Catalytic Processes
Author: C. H. Bartholomew
Publisher: John Wiley & Sons
Total Pages: 1224
Release: 2011-11-30
Genre: Technology & Engineering
ISBN: 1118209737

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Catalysis is central to the chemical industry, as it is directly or involved in the production of almost all useful chemical products. In this book the authors, present the definitive account of industrial catalytic processes. Throughout Fundamentals of Industrial Catalytic Processes the information is illustrated with many case studies and problems. This book is valuable to anyone wanting a clear account of industrial catalytic processes, but is particularly useful to industrial and academic chemists and engineers and graduate working on catalysis. This book also: Covers fundamentals of catalytic processes, including chemistry, catalyst preparation, properties and reaction engineering. Addresses heterogeneous catalytic processes employed by industry. Provides detailed data on existing catalysts and catalytic reactions, process design and chemical engineering. Covers catalysts used in fuel cells.


Preparation of Solid Catalysts

Preparation of Solid Catalysts
Author: Gerhard Ertl
Publisher: John Wiley & Sons
Total Pages: 639
Release: 2008-08-29
Genre: Science
ISBN: 3527620680

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Solid catalysts play a fundamental role in all areas between basic research and industrial applications. This book offers a large amount of information about the preparation of solid catalysts. All types of solid catalysts and all important aspects of their preparation are discussed. The highly topical contributions are written by leading experts in disciplines ranging from solid state, interface and solution chemistry to industrial engineering. The straightforward presentation of the material and the comprehensive coverage make this book an essential and indispensible tool for every scientist and engineer working with solid catalysts.


Combinatorial Development of Solid Catalytic Materials

Combinatorial Development of Solid Catalytic Materials
Author: Manfred Baerns
Publisher: World Scientific
Total Pages: 191
Release: 2009
Genre: Computers
ISBN: 1848163436

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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.