Atomic Clusters With Unusual Structure, Bonding And Reactivity, Chattaraj, Pratim Kumar
Автор: Perez Pariente, Joaquin. Название: Structure and reactivity of metals in zeolite materials / ISBN: 3319989049 ISBN-13(EAN): 9783319989044 Издательство: Springer Рейтинг: Цена: 279500.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: This volume provides the reader with the most up-to-date and relevant knowledge on the reactivity of metals located in zeolite materials, either in framework or extra-framework positions, and the way it is connected with the nature of the chemical environment provided by the host. Since the first report of the isomorphous substitution of titanium in the framework of zeolites giving rise to materials with unusual catalytic properties, the incorporation of many other metals have been investigated with the aim for developing catalysts with improved performance in different reactions. The continuous expansion of the field, both in the variety of metals and zeolite structures, has been accompanied by an increasing focus on the relationship between the reactivity of metal centers and their unique chemical environment.The concepts covered in this volume are of interest to people working in the field of inorganic and physical chemistry, catalysis and chemical engineering, but also for those more interested in theoretical approaches to chemical reactivity. In particular the volume is useful to postgraduate students conducting research in the design, synthesis and catalytic performance of metal-containing zeolites in both academic and application contexts.
Автор: Joaqu?n P?rez Pariente; Manuel S?nchez-S?nchez Название: Structure and Reactivity of Metals in Zeolite Materials ISBN: 303007546X ISBN-13(EAN): 9783030075460 Издательство: Springer Рейтинг: Цена: 167700.00 T Наличие на складе: Поставка под заказ. Описание: This volume provides the reader with the most up-to-date and relevant knowledge on the reactivity of metals located in zeolite materials, either in framework or extra-framework positions, and the way it is connected with the nature of the chemical environment provided by the host. Since the first report of the isomorphous substitution of titanium in the framework of zeolites giving rise to materials with unusual catalytic properties, the incorporation of many other metals have been investigated with the aim for developing catalysts with improved performance in different reactions. The continuous expansion of the field, both in the variety of metals and zeolite structures, has been accompanied by an increasing focus on the relationship between the reactivity of metal centers and their unique chemical environment.The concepts covered in this volume are of interest to people working in the field of inorganic and physical chemistry, catalysis and chemical engineering, but also for those more interested in theoretical approaches to chemical reactivity. In particular the volume is useful to postgraduate students conducting research in the design, synthesis and catalytic performance of metal-containing zeolites in both academic and application contexts.
Автор: Frank De Proft; Paul Geerlings Название: Structure, Bonding and Reactivity of Heterocyclic Compounds ISBN: 3642451489 ISBN-13(EAN): 9783642451485 Издательство: Springer Рейтинг: Цена: 217680.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: The series Topics in Heterocyclic Chemistry presents critical reviews on present and future trends in the research of heterocyclic compounds. Overall the scope is to cover topics dealing with all areas within heterocyclic chemistry, both experimental and theoretical, of interest to the general heterocyclic chemistry community.
Автор: Peter Politzer; Donald G. Truhlar Название: Chemical Applications of Atomic and Molecular Electrostatic Potentials ISBN: 1475796366 ISBN-13(EAN): 9781475796360 Издательство: Springer Рейтинг: Цена: 156720.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: We hope that this book will achieve two goals: First, we are trying to provide an overall picture, including recent advances, of current chemical research, both fundamental and applied, involving the electrostatic potential.
Автор: N. Russo; Dennis R. Salahub Название: Metal-Ligand Interactions ISBN: 940106556X ISBN-13(EAN): 9789401065566 Издательство: Springer Рейтинг: Цена: 287890.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: Proceedings of the NATO Advanced Study Institute, Cetraro, Italy, September 4-16, 1994
Автор: Nguyen Minh Tho, Kiran Boggavarapu Название: Clusters: Structure, Bonding and Reactivity ISBN: 3319840479 ISBN-13(EAN): 9783319840475 Издательство: Springer Рейтинг: Цена: 186330.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: Overview new experimental methodologies for characterizing structures, spectroscopic and thermodynamic properties of clusters.- These include the dual-laser mass, infrared (RI-MPD), photoelectron, magnetic .. spectrometries.- Theoretical approaches including the group theory for electronic structure, graph theory for topology, theory of magnetism .- The current status and extensions of the electron shell models (phenomenological, jellium... models) in the interpretation of electronic structure of doped clusters.- Successful applications of computational quantum chemical methods in the determination of geometrical and electronic structures, thermochemical and spectroscopic parameters, and rationalization of bonding phenomenon.- Presented for different classes of binary clusters including: 1) Lithium, 2) Boron, in particular the boron buckball B80, 3) Aluminum, 4) Carbon, 5) Silicon, 6) Gemanium, 7) Nitrogen, 8) Phosphorus, 8) Copper, 9) Silver and 10) Gold.
Автор: Minh Tho Nguyen; Boggavarapu Kiran Название: Clusters ISBN: 331948916X ISBN-13(EAN): 9783319489162 Издательство: Springer Рейтинг: Цена: 186330.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: Overview new experimental methodologies for characterizing structures, spectroscopic and thermodynamic properties of clusters.- These include the dual-laser mass, infrared (RI-MPD), photoelectron, magnetic .. spectrometries.- Theoretical approaches including the group theory for electronic structure, graph theory for topology, theory of magnetism .- The current status and extensions of the electron shell models (phenomenological, jellium... models) in the interpretation of electronic structure of doped clusters.- Successful applications of computational quantum chemical methods in the determination of geometrical and electronic structures, thermochemical and spectroscopic parameters, and rationalization of bonding phenomenon.- Presented for different classes of binary clusters including: 1) Lithium, 2) Boron, in particular the boron buckball B80, 3) Aluminum, 4) Carbon, 5) Silicon, 6) Gemanium, 7) Nitrogen, 8) Phosphorus, 8) Copper, 9) Silver and 10) Gold.
Автор: Peter Politzer; Donald G. Truhlar Название: Chemical Applications of Atomic and Molecular Electrostatic Potentials ISBN: 0306406578 ISBN-13(EAN): 9780306406577 Издательство: Springer Рейтинг: Цена: 174130.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: We hope that this book will achieve two goals: First, we are trying to provide an overall picture, including recent advances, of current chemical research, both fundamental and applied, involving the electrostatic potential.
Автор: Arnaut, Luis Название: Chemical Kinetics ISBN: 0444640398 ISBN-13(EAN): 9780444640390 Издательство: Elsevier Science Рейтинг: Цена: 218960.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание:
Chemical Kinetics: From Molecular Structure to Chemical Reactivity, second edition is written for both the specialist in the field as well as upper undergraduate and graduate-level chemistry students. It bridges the gap between the two with a path that leads the reader from the phenomenological approach to the rates of chemical reactions to the state-of-the-art calculation of the rate constants of the most prevalent reactions: atom transfers, catalysis, proton transfers, substitution reactions, energy transfers and electron transfers. In the process, the reader is presented with the details of collision and transition state theories.
Readers are offered a simple rational to interpret and predict the rates of chemical reactions, both in the gas and condensed (liquid, supercritical fluids, enzymes) phases. The book places great emphasis on the clarity of the concepts and does not compromise rigor and exactitude. This is achieved by illustrating all the theories and mechanisms with recent examples, some of them described with sufficient detail and simplicity to be used in General Chemistry and lab courses.
Chemical Kinetics From Molecular Structure to Chemical Reactivity is a journey in the world of atoms and molecules, guided by the explanation of how molecular structures change with time. For students and less experienced young researchers, the book provides the basics: the simplest concepts, the fundamental experiments, and the underlying theories. For the seasoned specialist, it takes them to the viewpoint where sophisticated experimental and theoretical methods combine to offer a panorama of time-dependent molecular phenomena connected by a new rational.
Features two new chapters on Fractals, Chaos and Oscillatory Reactions and Pharmacokinetics, and all chapters from the first edition are thoroughly revised
Includes practical examples, detailed theoretical calculations, and cross-relations between reactions throughout the text to underscore key concepts
Provides a state-of-the-art presentation on the kinetics of reactions implicated in the most active research fields
Название: Concepts and Methods in Modern Theoretical Chemistry ISBN: 0367380323 ISBN-13(EAN): 9780367380328 Издательство: Taylor&Francis Рейтинг: Цена: 61240.00 T Наличие на складе: Невозможна поставка. Описание:
Concepts and Methods in Modern Theoretical Chemistry: Electronic Structure and Reactivity, the first book in a two-volume set, focuses on the structure and reactivity of systems and phenomena. A new addition to the series Atoms, Molecules, and Clusters, this book offers chapters written by experts in their fields. It enables readers to learn how concepts from ab initio quantum chemistry and density functional theory (DFT) can be used to describe, understand, and predict electronic structure and chemical reactivity.
This book covers a wide range of subjects, including discussions on the following topics:
DFT, particularly the functional and conceptual aspects
Excited states, molecular electrostatic potentials, and intermolecular interactions
General theoretical aspects and application to molecules
Clusters and solids, electronic stress, and electron affinity difference
The information theory and the virial theorem
New periodic tables
The role of the ionization potential
Although most of the chapters are written at a level that is accessible to a senior graduate student, experienced researchers will also find interesting new insights in these experts' perspectives. This comprehensive book provides an invaluable resource toward understanding the whole gamut of atoms, molecules, and clusters.
Название: Effects of Electric Fields on Structure and Reactivity: New Horizons in Chemistry ISBN: 1839161698 ISBN-13(EAN): 9781839161698 Издательство: Royal Society of Chemistry Рейтинг: Цена: 252030.00 T Наличие на складе: Нет в наличии. Описание: Starting with an overview of the theory behind - and demonstrations of the effect of - electric fields on structure and reactivity, this accessible reference work aims to encourage those new to the field to consider harnessing these effects in their own work.
Автор: Ghosh, Swapan Kumar Название: Concepts and Methods in Modern Theoretical Chemistry ISBN: 1466505281 ISBN-13(EAN): 9781466505285 Издательство: Taylor&Francis Рейтинг: Цена: 173530.00 T Наличие на складе: Нет в наличии.
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