Автор: Piela, Lucjan Название: Ideas Of Quantum Chemistry ISBN: 044464248X ISBN-13(EAN): 9780444642486 Издательство: Elsevier Science Цена: 129130 T Описание:
Ideas of Quantum Chemistry, Volume Two: Interactions highlights the motions and systems in quantum chemistry and the models and tools used to assess them, thus giving detailed insights into the behaviors underlying quantum chemistry. Using an innovative structure to show the logical relationships between different topics, systems and methods, it answers questions and emphasizes knowledge using practical examples. Beginning with a review of the orbital model of electronic motion in periodic systems, the book goes on to explore the correlation of electronic motions, density functional theory (DFT), electric and magnetic fields, intermolecular interactions, chemical reactions and information processing.
This third release has been updated and revised to cover the latest developments in the field. It can be used on its own as a guide to key interactions and tools or in combination with Volume Two to give a complete overview of the field.
Автор: Davis William M Название: Physical Chemistry ISBN: 143981077X ISBN-13(EAN): 9781439810774 Издательство: Taylor&Francis Рейтинг: Цена: 193950.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание:
Designed for a two-semester introductory course sequence in physical chemistry, Physical Chemistry: A Modern Introduction, Second Edition offers a streamlined introduction to the subject. Focusing on core concepts, the text stresses fundamental issues and includes basic examples rather than the myriad of applications often presented in other, more encyclopedic books. Physical chemistry need not appear as a large assortment of different, disconnected, and sometimes intimidating topics. Instead, students should see that physical chemistry provides a coherent framework for chemical knowledge, from the molecular to the macroscopic level.
The book offers:
Novel organization to foster student understanding, giving students the strongest sophistication in the least amount of time and preparing them to tackle more challenging topics
Strong problem-solving emphasis, with numerous end-of-chapter practice exercises, over two dozen in-text worked examples, and a number of clearly identified spreadsheet exercises
A quick review in calculus, via an appendix providing the necessary mathematical background for the study of physical chemistry
Powerful streamlined development of group theory and advanced topics in quantum mechanics, via appendices covering molecular symmetry and special quantum mechanical approaches
Автор: Atkins Название: Elements of Physical Chemistry ISBN: 0199608113 ISBN-13(EAN): 9780199608119 Издательство: Oxford Academ Рейтинг: Цена: 42230.00 T Наличие на складе: Невозможна поставка. Описание: Getting to grips with physical chemistry can be a daunting task. With new concepts to understand and a large amount of mathematics to master, it is no wonder that students can sometimes find it overwhelming. Elements of Physical Chemistry has been carefully developed to help the reader increase their confidence when using physics and mathematics to answer fundamental questions about the structure of molecules, how chemical reactions take place, and why materials behave the way they do. The content is tightly focussed and well-matched to undergraduate courses, making it easy to find the information needed. Topics are covered in a clear, easy-to-follow style, using everyday examples to help students to visualise things that can otherwise seem very abstract. This edition sees further development of the learning features. These include Chemist's toolkits, which provide a reminder of mathematical techniques or introductory chemistry needed to follow material in the chapters; Worked examples, providing a step-by-step route through a problem; Brief illustrations which explain how to use equations; and Self-tests, allowing students to check their understanding. On the accompanying Online Resource Centre, students have access to multiple choice questions and Webcasts; short videos showing, step-by-step, how to solve an exercise. For lecturers, there is a test bank and the figures from the text are available to download.
Автор: Bader, Richard F.W. (Professor of Chemistry, McMas Название: Atoms in Molecules: A Quantum Theory ISBN: 0198558651 ISBN-13(EAN): 9780198558651 Издательство: Oxford Academ Рейтинг: Цена: 77090.00 T Наличие на складе: Невозможна поставка. Описание: The purpose of this monograph is to show that a theory can be developed to underpin the molecular structure hypothesis - that the atoms in a molecule are real, with properties predicted and defined by the laws of quantum mechanics.
Автор: Vemulapalli, G.K. Название: Invitation to Physical Chemistry ISBN: 1848163010 ISBN-13(EAN): 9781848163010 Издательство: World Scientific Publishing Рейтинг: Цена: 57030.00 T Наличие на складе: Невозможна поставка. Описание: Presents a modern view of the different aspects of physical chemistry. With only the essential examples and steps in derivations given, this title intends to provide students/readers with the big picture first, which they need to keep in mind as they subsequently develop more detailed skills. It also includes a CD-ROM.
Автор: V.P. Gupta Название: Principles And Applications Of Quantum Chemistry ISBN: 0128034785 ISBN-13(EAN): 9780128034781 Издательство: Elsevier Science Рейтинг: Цена: 83080.00 T Наличие на складе: Есть у поставщика Поставка под заказ. Описание: Principles and Applications of Quantum Chemistry offers clear and simple coverage based on the author’s extensive teaching at advanced universities around the globe. Where needed, derivations are detailed in an easy-to-follow manner so that you will understand the physical and mathematical aspects of quantum chemistry and molecular electronic structure. Building on this foundation, this book then explores applications, using illustrative examples to demonstrate the use of quantum chemical tools in research problems. Each chapter also uses innovative problems and bibliographic references to guide you, and throughout the book chapters cover important advances in the field including: Density functional theory (DFT) and time-dependent DFT (TD-DFT), characterization of chemical reactions, prediction of molecular geometry, molecular electrostatic potential, and quantum theory of atoms in molecules.
Автор: Janssen, Curtis L. Название: Parallel computing in quantum chemistry ISBN: 1420051644 ISBN-13(EAN): 9781420051643 Издательство: Taylor&Francis Рейтинг: Цена: 183750.00 T Наличие на складе: Невозможна поставка. Описание: Enables readers to develop and implement efficient quantum chemistry software capable of utilizing large-scale parallel computers. This book addresses specific parallel programming challenges facing quantum chemists that are not covered in other resources, including message-passing, multi-threading, and parallel computer architectures.
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