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Author: Jean-Charles de Hemptinne
Publisher: Editions TECHNIP
ISBN: 9782710809494
Category : Science
Languages : en
Pages : 418
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Book Description
The selection of the most adequate thermodynamic model in a process simulation is an issue that most process engineer has to face sooner or later. This book, conceived as a practical guide, aims at providing adequate answers by analysing the questions to be looked at. The analysis (first chapter) yields three keys that are further discussed in three different chapters. (1) A good understanding of the properties required in the process, and their method of calculation is the first key. The second chapter provides to that end in a synthetic manner the most important equations that are derived from the fundamental principes of thermodynamics. (2) An adequate description of the mixture, which is a combination of models and parameters, is the second key. The third chapter makes the link between components and models, both from a numerical (parameterisation) and physical (molecular interactions) point of view. Finally, (3) a correct view of the phase behaviour and trends in regard of the process conditions is the third key. The fourth chapter illustrates the phase behaviour and makes model recommendations for the most significant industrial systems. A decision tree is provided at the end of this chapter. In the last chapter, the key questions are reviewed for a number of typical processes. This book is intended for process engineers, who are not specialists of thermodynamics but are confronted with this kind of problems and need a reference book, as well as process engineering students who will find an original approach to thermodynamics, complementary of traditional lectures
Author: Mohammad Hossein Keshavarz
Publisher: Walter de Gruyter GmbH & Co KG
ISBN: 3110782138
Category : Technology & Engineering
Languages : en
Pages : 288
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Book Description
The combustion properties of organic materials are used to assess their safety specifications. This knowledge is necessary to avoid potentially disastrous fires. The experimental determination of the combustion properties of a new organic compound is laborious and sometimes even impossible. This book describes methods for the determination and prediction of the combustion properties of organic compounds, along with some examples and exercises. This 2nd Edition includes an updated and improved presentation of the application of different new models for reliable prediction of diverse aspects of flammability of organic compounds.
Author: Jean-Charles de Hemptinne
Publisher: Editions TECHNIP
ISBN: 9782710809494
Category : Science
Languages : en
Pages : 418
Get Book Here
Book Description
The selection of the most adequate thermodynamic model in a process simulation is an issue that most process engineer has to face sooner or later. This book, conceived as a practical guide, aims at providing adequate answers by analysing the questions to be looked at. The analysis (first chapter) yields three keys that are further discussed in three different chapters. (1) A good understanding of the properties required in the process, and their method of calculation is the first key. The second chapter provides to that end in a synthetic manner the most important equations that are derived from the fundamental principes of thermodynamics. (2) An adequate description of the mixture, which is a combination of models and parameters, is the second key. The third chapter makes the link between components and models, both from a numerical (parameterisation) and physical (molecular interactions) point of view. Finally, (3) a correct view of the phase behaviour and trends in regard of the process conditions is the third key. The fourth chapter illustrates the phase behaviour and makes model recommendations for the most significant industrial systems. A decision tree is provided at the end of this chapter. In the last chapter, the key questions are reviewed for a number of typical processes. This book is intended for process engineers, who are not specialists of thermodynamics but are confronted with this kind of problems and need a reference book, as well as process engineering students who will find an original approach to thermodynamics, complementary of traditional lectures
Author:
Publisher: Elsevier
ISBN: 0128032014
Category : Technology & Engineering
Languages : en
Pages : 4609
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Book Description
Comprehensive Medicinal Chemistry III, Eight Volume Set provides a contemporary and forward-looking critical analysis and summary of recent developments, emerging trends, and recently identified new areas where medicinal chemistry is having an impact. The discipline of medicinal chemistry continues to evolve as it adapts to new opportunities and strives to solve new challenges. These include drug targeting, biomolecular therapeutics, development of chemical biology tools, data collection and analysis, in silico models as predictors for biological properties, identification and validation of new targets, approaches to quantify target engagement, new methods for synthesis of drug candidates such as green chemistry, development of novel scaffolds for drug discovery, and the role of regulatory agencies in drug discovery. Reviews the strategies, technologies, principles, and applications of modern medicinal chemistry Provides a global and current perspective of today's drug discovery process and discusses the major therapeutic classes and targets Includes a unique collection of case studies and personal assays reviewing the discovery and development of key drugs
Author: Aswathy Joseph
Publisher: Elsevier
ISBN: 0128202815
Category : Science
Languages : en
Pages : 292
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Book Description
Theoretical and Computational Approaches to Predicting Ionic Liquid Properties highlights new approaches to predicting and understanding ionic liquid behavior and selecting ionic liquids based on theoretical knowledge corroborated by experimental studies. Supported throughout with case studies, the book provides a comparison of the accuracy and efficiency of different theoretical approaches. Sections cover the need for integrating theoretical research with experimental data, conformations, electronic structure and non-covalent interactions, microstructures and template effects, thermodynamics and transport properties, and spectro-chemical characteristics. Catalytic and electrochemical properties are then explored, followed by interfacial properties and solvation dynamics. Structured for ease of use, and combining the research knowledge of a global team of experts in the field, this book is an indispensable tool for those involved with the research, development and application of ionic liquids across a vast range of fields. - Highlights new approaches for selecting ionic liquids by combining theoretical knowledge with experimental and simulation-based observations - Discusses how theoretical simulation can help in selecting specific anion-cation combinations to show enhanced properties of interest - Compares the accuracy and efficiency of different theoretical approaches for predicting ionic and liquid characteristics
Author: Ricardo Morales-Rodriguez
Publisher: BoD – Books on Demand
ISBN: 9535107798
Category : Science
Languages : en
Pages : 558
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Book Description
This book presents the selection of various high level contributions involving thermodynamics. The book goes from the fundamentals up to several applications in different scientific fields. The content of the book has been classified in six sections: Classical Thermodynamics, Statistical Thermodynamics, Property Prediction in Thermodynamics, Material and Products, Non Equilibrium and Thermodynamics in Diverse Areas. The classification of the book aims to provide to the reader the facility of finding the desired topic included in the book. It is expected that this collection of chapters will contribute to the state of the art in the thermodynamics area.
Author: Luke Achenie
Publisher: Elsevier
ISBN: 0080529437
Category : Science
Languages : en
Pages : 405
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Book Description
CAMD or Computer Aided Molecular Design refers to the design of molecules with desirable properties. That is, through CAMD, one determines molecules that match a specified set of (target) properties. CAMD as a technique has a very large potential as in principle, all kinds of chemical, bio-chemical and material products can be designed through this technique.This book mainly deals with macroscopic properties and therefore does not cover molecular design of large, complex chemicals such as drugs. While books have been written on computer aided molecular design relating to drugs and large complex chemicals, a book on systematic formulation of CAMD problems and solutions, with emphasis on theory and practice, which helps one to learn, understand and apply the technique is currently unavailable.·This title brings together the theoretical aspects related to Computer Aided Molecular Design, the different techniques that have been developed and the different applications that have been reported. ·Contributing authors are among the leading researchers and users of CAMD·First book available giving a systematic formulation of CAMD problems and solutions
Author: Adrian Bonilla-Petriciolet
Publisher: John Wiley & Sons
ISBN: 1119580315
Category : Technology & Engineering
Languages : en
Pages : 384
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Book Description
A comprehensive overview of current developments and applications in biofuels production Process Systems Engineering for Biofuels Development brings together the latest and most cutting-edge research on the production of biofuels. As the first book specifically devoted to process systems engineering for the production of biofuels, Process Systems Engineering for Biofuels Development covers theoretical, computational and experimental issues in biofuels process engineering. Written for researchers and postgraduate students working on biomass conversion and sustainable process design, as well as industrial practitioners and engineers involved in process design, modeling and optimization, this book is an indispensable guide to the newest developments in areas including: Enzyme-catalyzed biodiesel production Process analysis of biodiesel production (including kinetic modeling, simulation and optimization) The use of ultrasonification in biodiesel production Thermochemical processes for biomass transformation to biofuels Production of alternative biofuels In addition to the comprehensive overview of the subject of biofuels found in the Introduction of the book, the authors of various chapters have provided extensive discussions of the production and separation of biofuels via novel applications and techniques.
Author: Clemens Jochum
Publisher: Springer Science & Business Media
ISBN: 3642741401
Category : Science
Languages : en
Pages : 551
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Book Description
For more than 100 years the Beilstein Handbook has been publishing checked and evaluated data on organic compounds. It has become the major reference book for the chemical and physical properties of organic com pounds. The prediction of these physical properties was the subject of the Beilstein workshop. The ability to predict physical properties is for several reasons of great interest to the Beilstein Institute. It is of primary importance to be able to check the abstracted data for accuracy and to eliminate simple mistakes like typing errors. Presently all the work whether manuscript writing or evaluation of data is carried out manually. This is very time consuming, with the entry of Beilstein into electronic data gathering and publication, the opportunity for computerized consistency checking has become available. Contrary to belief, when one examines the Beilstein Handbook or Chemical Abstracts there is a dearth of chemical information. There are a great many compounds but few are well defined resulting in large gaps in the information available to the chemist. These information gaps could be filled by using algorithmic methods to estimate the properties of interest. An important question to answer is "What is the chemist's reaction to estimated data?" Will he accept it for use, within limits defined by the method, or will it be unacceptable and therefore detrimental for the data base. However if one could partly fill gaps in the data base the increase in the power of the search techniques would be marked.
Author: Mahdi Sharifzadeh
Publisher: John Wiley & Sons
ISBN: 1119695953
Category : Technology & Engineering
Languages : en
Pages : 400
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Book Description
Industry 4.0 Vision for the Supply of Energy and Materials Explore the impact of Industry 4.0 technologies on the supply chain with this authoritative text written by a leader in his field In Industry 4.0 Vision for the Supply of Energy and Materials, distinguished researcher and editor, Dr. Mahdi Sharifzadeh, delivers thematic, analytic, and applied discussions of the Industry 4.0 vision for supply chain design and operation. The book compiles all current aspects and emerging notions of Industry 4.0 into clusters of “enablers” and “analytics” of Supply Chain 4.0. Their multifaceted and highly interconnected nature is discussed at length, as are their diverse range of applications. You will discover uses of these new technologies ranging from the supply of conventional energy networks to renewables, pharmaceuticals, and additive manufacturing. You will also learn about their implications for economic prosperity and environmental sustainability. For each sector, this book scrutinizes current industrial practice and discusses developing concepts. Finally, the book concludes with potential future research directions of interest to industry practitioners and academics alike. Readers will also benefit from the inclusion of: A thorough introduction to connectivity through wireless communications and remote sensors An exploration of blockchains and smart contracts, as well as robotics and automation and cloud computing Practical discussions of supply chain analytics, including big data, machine-learning, and artificial intelligence, as well as supply chain modeling, optimization, and control A concise treatment of Industry 4.0 applications in supply chain design and operation, including the circular economy and the power industry An analysis of the oil, gas, and petrochemical industry, the pharmaceutical industry, and additive manufacturing Perfect for PhD-level and Postdoctoral researchers and industrial researchers, Industry 4.0 Vision for the Supply of Energy and Materials will also earn a place in the libraries of working professionals with an interest in the quantitative analysis of Supply Chain 4.0 concepts and techniques.
Author:
Publisher: Elsevier
ISBN: 0444634444
Category : Computers
Languages : en
Pages : 2482
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Book Description
26th European Symposium on Computer Aided Process Engineering contains the papers presented at the 26th European Society of Computer-Aided Process Engineering (ESCAPE) Event held at Portorož Slovenia, from June 12th to June 15th, 2016. Themes discussed at the conference include Process-product Synthesis, Design and Integration, Modelling, Numerical analysis, Simulation and Optimization, Process Operations and Control and Education in CAPE/PSE. Presents findings and discussions from the 26th European Society of Computer-Aided Process Engineering (ESCAPE) Event
