Density functional theory / David S Sholl

Public ISBD Titre : Density functional theory : a practical introduction Type de document : texte imprimé Auteurs : David S Sholl (19..-...), Auteur ; Janice A Steckel (19..-...), Auteur Mention d'édition : Second edition Editeur : Hoboken, NJ : Wiley Année de publication : 2023 Importance : 204 p. Présentation : ill., couv. ill. en coul Format : 27cm ISBN/ISSN/EAN : 978-1-119-84086-2 Langues : Anglais (eng) Catégories : Livres Tags : Density functionals  Mathematical physics  Quantum chemistry  Fonctionnelles densité  Théorie de la fonctionnelle de densité  Physique mathématique  Chimie quantique Index. décimale : 541 Chimie physique Résumé : "The application of density functional theory (DFT) calculations has become a "standard tool" for diverse materials modeling problems in physics, chemistry, materials science, and multiple branches of engineering. Consequently, newcomers to these methods need a concise introduction to rapidly learn the tools that allow them to actually perform calculations that are now routine in the fields listed above and to remain up to date with the new developments in DFT The textbook offers a concise, easy-to-follow introduction to the key concepts and practical applications of density functional theory (DFT), focusing on plane-wave DFT. The authors have many years of experience introducing DFT to students from a variety of backgrounds, including physics, chemistry and materials science. The new edition retains the successful concept of the first edition by striking a balance between brevity and detail, making it possible for the readers to digest the text in its entirety." "A concise and rigorous introduction to the applications of DFT calculations. In the newly revised second edition of Density Functional Theory: A Practical Introduction, the authors deliver a concise and easy-to-follow introduction to the key concepts and practical applications of density functional theory (DFT) with an emphasis on plane-wave DFT. The authors draw on decades of experience in the field, offering students from a variety of backgrounds a balanced approach between accessibility and rigor, creating a text that is highly digestible in its entirety. This new edition: Discusses in more detail the accuracy of DFT calculations and the choice of functionals, adds an overview of the wide range of available DFT codes, contains more examples on the use of DFT for high throughput materials calculations, puts more emphasis on computing phase diagrams and on open ensemble methods widely used in electrochemistry, is significantly extended to cover calculation beyond standard DFT, e.g., dispersion-corrected DFT, DFT+U, time-dependent DFT. Perfect for graduate students and postdoctoral candidates in physics and engineering, Density Functional Theory: A Practical Introduction will also earn a place in the libraries of researchers and practitioners in chemistry, materials science, and mechanical engineering." Density functional theory : a practical introduction [texte imprimé] / David S Sholl (19..-...), Auteur ; Janice A Steckel (19..-...), Auteur  . -  Second edition . - Hoboken, NJ : Wiley, 2023 . - 204 p. : ill., couv. ill. en coul ; 27cm. ISBN : 978-1-119-84086-2 Langues : Anglais (eng) Catégories : Livres Tags : Density functionals  Mathematical physics  Quantum chemistry  Fonctionnelles densité  Théorie de la fonctionnelle de densité  Physique mathématique  Chimie quantique Index. décimale : 541 Chimie physique Résumé : "The application of density functional theory (DFT) calculations has become a "standard tool" for diverse materials modeling problems in physics, chemistry, materials science, and multiple branches of engineering. Consequently, newcomers to these methods need a concise introduction to rapidly learn the tools that allow them to actually perform calculations that are now routine in the fields listed above and to remain up to date with the new developments in DFT The textbook offers a concise, easy-to-follow introduction to the key concepts and practical applications of density functional theory (DFT), focusing on plane-wave DFT. The authors have many years of experience introducing DFT to students from a variety of backgrounds, including physics, chemistry and materials science. The new edition retains the successful concept of the first edition by striking a balance between brevity and detail, making it possible for the readers to digest the text in its entirety." "A concise and rigorous introduction to the applications of DFT calculations. In the newly revised second edition of Density Functional Theory: A Practical Introduction, the authors deliver a concise and easy-to-follow introduction to the key concepts and practical applications of density functional theory (DFT) with an emphasis on plane-wave DFT. The authors draw on decades of experience in the field, offering students from a variety of backgrounds a balanced approach between accessibility and rigor, creating a text that is highly digestible in its entirety. This new edition: Discusses in more detail the accuracy of DFT calculations and the choice of functionals, adds an overview of the wide range of available DFT codes, contains more examples on the use of DFT for high throughput materials calculations, puts more emphasis on computing phase diagrams and on open ensemble methods widely used in electrochemistry, is significantly extended to cover calculation beyond standard DFT, e.g., dispersion-corrected DFT, DFT+U, time-dependent DFT. Perfect for graduate students and postdoctoral candidates in physics and engineering, Density Functional Theory: A Practical Introduction will also earn a place in the libraries of researchers and practitioners in chemistry, materials science, and mechanical engineering."

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Electromagnetism for engineers / Andrew J. Flewitt

Public ISBD Titre : Electromagnetism for engineers Type de document : texte imprimé Auteurs : Andrew J. Flewitt, Auteur Editeur : Hoboken, NJ : Wiley Année de publication : 2023 Importance : 208 p Présentation : couv. ill. en coul. Format : 25 cm. ISBN/ISSN/EAN : 978-1-119-40616-7 Langues : Anglais (eng) Catégories : Livres Tags : Electromagnetism Index. décimale : 621.3 Eléctrotechnique, technologie du magnétisme, optique appliquée, électronique Résumé : Electromagnetism can be a difficult subject to grasp and to teach. Much of what we take for granted in modern life is enabled by electromagnetic effects, but it isn’t always easy to understand the impact of electromagnetism compared to other areas of engineering, such as mechanics, which are more tangibly observed and felt. Although electromagnetism is a crucial and important branch of physics with elegant mathematics, many students can find the study of electromagnetism inaccessible. It is crucial for students of electrical and electronic engineering and physics to have a strong understanding of electromagnetism and how it impacts communications, power generation and transmission, semiconductor devices, motors, and more. Electromagnetism for Engineers aims to develop a student’s understanding of electromagnetism in the context of real effects and how they apply to such applications, whilst maintaining the sophistication of the mathematics that can be used to give deeper insight. It begins by describing the fundamentals of electromagnetism before a more detailed discussion of the basic concepts developed for specific application areas. It then considers the application of electromagnetism to transmission lines, antennas, and waveguides. Electromagnetism for Engineers readers will find: A unique approach that illustrates the link between real-life applications and fundamental theory of electromagnetism Clear, concise language to help students gain a full understanding of the subject Carefully designed figures to illustrate points throughout the book Accompanying website at www.wiley.com/go/flewitt1418 Electromagnetism for Engineers has been written as a textbook for undergraduates studying electronic or electrical engineering. The manual can also be of interest to physics students and??to graduate-level students desirous of having a general book on electromagnetism. It is also a useful reference for professional engineers looking for a refresher on the fundamentals of electromagnetism. Electromagnetism for engineers [texte imprimé] / Andrew J. Flewitt, Auteur . - Hoboken, NJ : Wiley, 2023 . - 208 p : couv. ill. en coul. ; 25 cm. ISBN : 978-1-119-40616-7 Langues : Anglais (eng) Catégories : Livres Tags : Electromagnetism Index. décimale : 621.3 Eléctrotechnique, technologie du magnétisme, optique appliquée, électronique Résumé : Electromagnetism can be a difficult subject to grasp and to teach. Much of what we take for granted in modern life is enabled by electromagnetic effects, but it isn’t always easy to understand the impact of electromagnetism compared to other areas of engineering, such as mechanics, which are more tangibly observed and felt. Although electromagnetism is a crucial and important branch of physics with elegant mathematics, many students can find the study of electromagnetism inaccessible. It is crucial for students of electrical and electronic engineering and physics to have a strong understanding of electromagnetism and how it impacts communications, power generation and transmission, semiconductor devices, motors, and more. Electromagnetism for Engineers aims to develop a student’s understanding of electromagnetism in the context of real effects and how they apply to such applications, whilst maintaining the sophistication of the mathematics that can be used to give deeper insight. It begins by describing the fundamentals of electromagnetism before a more detailed discussion of the basic concepts developed for specific application areas. It then considers the application of electromagnetism to transmission lines, antennas, and waveguides. Electromagnetism for Engineers readers will find: A unique approach that illustrates the link between real-life applications and fundamental theory of electromagnetism Clear, concise language to help students gain a full understanding of the subject Carefully designed figures to illustrate points throughout the book Accompanying website at www.wiley.com/go/flewitt1418 Electromagnetism for Engineers has been written as a textbook for undergraduates studying electronic or electrical engineering. The manual can also be of interest to physics students and??to graduate-level students desirous of having a general book on electromagnetism. It is also a useful reference for professional engineers looking for a refresher on the fundamentals of electromagnetism.

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Heat transfer / Adrian Bejan

Public ISBD Titre : Heat transfer : evolution, design and performance Type de document : texte imprimé Auteurs : Adrian Bejan (1948-...), Auteur Editeur : Hoboken, NJ : Wiley Année de publication : 2022 Importance : 582 p. Présentation : ill Format : 27 cm ISBN/ISSN/EAN : 978-1-119-46740-3 Langues : Anglais (eng) Catégories : Livres Tags : Heat  Transmission  Transfert de chaleur  Chaleur Index. décimale : 621.402 Thermique Résumé : "Heat transfer is a discipline of thermal engineering that concerns the generation, use, conversion, and exchange of thermal energy and heat between physical systems. Heat transfer is classified into various mechanisms, such as thermal conduction, thermal convection, thermal radiation, and transfer of energy by phase changes. Engineers also consider the transfer of mass of differing chemical species, either cold or hot, to achieve heat transfer. While these mechanisms have distinct characteristics, they often occur simultaneously in the same system. Heat transfer has broad application to the functioning of numerous devices and systems. Heat-transfer principles may be used to preserve, increase, or decrease temperature in a wide variety of circumstances. Heat transfer methods are used in numerous disciplines, such as automotive engineering, thermal management of electronic devices and systems, climate control, insulation, materials processing, and power station engineering" Heat transfer : evolution, design and performance [texte imprimé] / Adrian Bejan (1948-...), Auteur . - Hoboken, NJ : Wiley, 2022 . - 582 p. : ill ; 27 cm. ISBN : 978-1-119-46740-3 Langues : Anglais (eng) Catégories : Livres Tags : Heat  Transmission  Transfert de chaleur  Chaleur Index. décimale : 621.402 Thermique Résumé : "Heat transfer is a discipline of thermal engineering that concerns the generation, use, conversion, and exchange of thermal energy and heat between physical systems. Heat transfer is classified into various mechanisms, such as thermal conduction, thermal convection, thermal radiation, and transfer of energy by phase changes. Engineers also consider the transfer of mass of differing chemical species, either cold or hot, to achieve heat transfer. While these mechanisms have distinct characteristics, they often occur simultaneously in the same system. Heat transfer has broad application to the functioning of numerous devices and systems. Heat-transfer principles may be used to preserve, increase, or decrease temperature in a wide variety of circumstances. Heat transfer methods are used in numerous disciplines, such as automotive engineering, thermal management of electronic devices and systems, climate control, insulation, materials processing, and power station engineering"

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Introduction to fluid dynamics / Young J. Moon

Public ISBD Titre : Introduction to fluid dynamics : understanding fundamental physics Type de document : texte imprimé Auteurs : Young J. Moon, Auteur Editeur : Hoboken, NJ : Wiley Année de publication : 2022 Importance : 315 p. Format : 25 cm ISBN/ISSN/EAN : 978-1-119-82315-5 Langues : Anglais (eng) Catégories : Livres Tags : fundamental physics  fluid dynamics Index. décimale : 532 Mécanique des fluides, mécanique des liquides Résumé : Introduction to Fluid Dynamics offers a unique physics-based approach to fluid dynamics. Instead of emphasizing specific problem-solving methodologies, this book explains and interprets the physics behind the theory, which helps mathematically-inclined students develop physical intuition while giving more physically-inclined students a better grasp of the underlying mathematics. Real-world examples and end-of-chapter practice problems are included to further enhance student understanding. Written by a highly-qualified author and experienced educator, topics are covered in a progressive manner, enabling maximum reader comprehension from start to finish. Sample topics covered in the book include: How forces originate in fluids How to define pressure in a fluid in motion How to apply conservation laws to deformable substances How viscous stresses are related to strain rates How centrifugal forces and viscosity play a role in curved motions and vortex dynamics How vortices and centrifugal forces are related in external viscous flows How energy is viscously dissipated in internal viscous flows How compressibility is related to wave and wave speed Students and instructors in advanced undergraduate or graduate fluid dynamics courses will find immense value in this concise yet comprehensive resource. It enables readers to easily understand complex fluid phenomena, regardless of the academic background they come from. Introduction to fluid dynamics : understanding fundamental physics [texte imprimé] / Young J. Moon, Auteur . - Hoboken, NJ : Wiley, 2022 . - 315 p. ; 25 cm. ISBN : 978-1-119-82315-5 Langues : Anglais (eng) Catégories : Livres Tags : fundamental physics  fluid dynamics Index. décimale : 532 Mécanique des fluides, mécanique des liquides Résumé : Introduction to Fluid Dynamics offers a unique physics-based approach to fluid dynamics. Instead of emphasizing specific problem-solving methodologies, this book explains and interprets the physics behind the theory, which helps mathematically-inclined students develop physical intuition while giving more physically-inclined students a better grasp of the underlying mathematics. Real-world examples and end-of-chapter practice problems are included to further enhance student understanding. Written by a highly-qualified author and experienced educator, topics are covered in a progressive manner, enabling maximum reader comprehension from start to finish. Sample topics covered in the book include: How forces originate in fluids How to define pressure in a fluid in motion How to apply conservation laws to deformable substances How viscous stresses are related to strain rates How centrifugal forces and viscosity play a role in curved motions and vortex dynamics How vortices and centrifugal forces are related in external viscous flows How energy is viscously dissipated in internal viscous flows How compressibility is related to wave and wave speed Students and instructors in advanced undergraduate or graduate fluid dynamics courses will find immense value in this concise yet comprehensive resource. It enables readers to easily understand complex fluid phenomena, regardless of the academic background they come from.

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Principles and applications of mass transfer / Jaime Benitez

Public ISBD Titre : Principles and applications of mass transfer : the design of separation processes for chemical and biochemical engineering Type de document : texte imprimé Auteurs : Jaime Benitez, Auteur Mention d'édition : 4th edition Editeur : Hoboken, NJ : Wiley Année de publication : 2022 Importance : 618 p. Format : 26 cm ISBN/ISSN/EAN : 978-1-119-78524-8 Langues : Anglais (eng) Catégories : Livres Tags : mass transfer  biochemical engineering Index. décimale : 660.28 Usines chimiques Résumé : Principles and Applications of Mass Transfer teaches the subject of mass transfer fundamentals and their applications to the design of separation processes with enough depth of coverage to guarantee that students using the book will, at the end of the course, be able to specify preliminary designs of the most common separation process equipment. Reflecting the growth of biochemical applications in the field of chemical engineering, the fourth edition expands biochemical coverage, including transient diffusion, environmental applications, electrophoresis, and bioseparations. Also new to the fourth edition is the integration of Python programs, which complement the Mathcad programs of the previous edition. On the accompanying instructor’s website, the online appendices contain a downloadable library of Python and Mathcad programs for the example problems in each chapter. A complete solution manual for all end-of-chapter problems, both in Mathcad and Python, is also provided. Some of the topics covered in Principles and Applications of Mass Transfer include: Molecular mass transfer, covering concentrations, velocities and fluxes, the Maxwell-Stefan relations, and Fick’s first law for binary mixtures The diffusion coefficient, covering diffusion coefficients for binary ideal gas systems, dilute liquids, and concentrated liquids Convective mass transfer, covering mass-transfer coefficients, dimensional analysis, boundary layer theory, and mass- and heat-transfer analogies Interphase mass transfer, covering diffusion between phases, material balances, and equilibrium-stage operations Gas dispersed gas-liquid operations, covering sparged vessels, tray towers, diameter, and gas-pressure drop, and weeping and entrainment Principles and Applications of Mass Transfer is an essential textbook for undergraduate chemical, biochemical, mechanical, and environmental engineering students taking a core course on Separation Processes or Mass Transfer Operations, along with mechanical engineers and mechanical engineering students starting to get involved in combined heat- and mass-transfer applications. Principles and applications of mass transfer : the design of separation processes for chemical and biochemical engineering [texte imprimé] / Jaime Benitez, Auteur  . -  4th edition . - Hoboken, NJ : Wiley, 2022 . - 618 p. ; 26 cm. ISBN : 978-1-119-78524-8 Langues : Anglais (eng) Catégories : Livres Tags : mass transfer  biochemical engineering Index. décimale : 660.28 Usines chimiques Résumé : Principles and Applications of Mass Transfer teaches the subject of mass transfer fundamentals and their applications to the design of separation processes with enough depth of coverage to guarantee that students using the book will, at the end of the course, be able to specify preliminary designs of the most common separation process equipment. Reflecting the growth of biochemical applications in the field of chemical engineering, the fourth edition expands biochemical coverage, including transient diffusion, environmental applications, electrophoresis, and bioseparations. Also new to the fourth edition is the integration of Python programs, which complement the Mathcad programs of the previous edition. On the accompanying instructor’s website, the online appendices contain a downloadable library of Python and Mathcad programs for the example problems in each chapter. A complete solution manual for all end-of-chapter problems, both in Mathcad and Python, is also provided. Some of the topics covered in Principles and Applications of Mass Transfer include: Molecular mass transfer, covering concentrations, velocities and fluxes, the Maxwell-Stefan relations, and Fick’s first law for binary mixtures The diffusion coefficient, covering diffusion coefficients for binary ideal gas systems, dilute liquids, and concentrated liquids Convective mass transfer, covering mass-transfer coefficients, dimensional analysis, boundary layer theory, and mass- and heat-transfer analogies Interphase mass transfer, covering diffusion between phases, material balances, and equilibrium-stage operations Gas dispersed gas-liquid operations, covering sparged vessels, tray towers, diameter, and gas-pressure drop, and weeping and entrainment Principles and Applications of Mass Transfer is an essential textbook for undergraduate chemical, biochemical, mechanical, and environmental engineering students taking a core course on Separation Processes or Mass Transfer Operations, along with mechanical engineers and mechanical engineering students starting to get involved in combined heat- and mass-transfer applications.

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