Discovering Chemistry With Natural Bond Orbitals, Weinhold
Автор: Fleming, Ian Название: Molecular orbitals and organic chemical reactions ISBN: 0470746580 ISBN-13(EAN): 9780470746585 Издательство: Wiley Рейтинг: Цена: 19792.00 р. Наличие на складе: Поставка под заказ.
Описание: Winner of the PROSE Award for Chemistry & Physics 2010 Acknowledging the very best in professional and scholarlypublishing, the annual PROSE Awards recognise publishers` andauthors` commitment to pioneering works of research and forcontributing to the conception, production, and design of landmarkworks in their fields.
Автор: Satoshi Inagaki Название: Orbitals in Chemistry ISBN: 3642261914 ISBN-13(EAN): 9783642261916 Издательство: Springer Рейтинг: Цена: 59955.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Orbital mixing rules were developed by Libit and Hoffmann and by Inagaki and Fukui in 1974 and Hirano and Imamura in 1975 to predict magnitudes of orbital amplitudes (Scheme 2) for understanding and designing stereoselective reactions.
Автор: Sapse, Anne-Marie Название: Molecular Orbital Calculations for Biological Systems (Hardback) ISBN: 0195098730 ISBN-13(EAN): 9780195098730 Издательство: Oxford Academ Рейтинг: Цена: 11088.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: This is a guide for the growing number of researchers in organic chemistry, biochemistry and molecular biology who would like to augment their experiments with theoretical calculations. The book teaches the use of quantum chemical computer programs while side-stepping the complex mathematics.
Название: Molecular Orbitals and Organic Chemical Reactions ISBN: 0470746599 ISBN-13(EAN): 9780470746592 Издательство: Wiley Рейтинг: Цена: 6962.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Winner of the PROSE Award for Chemistry & Physics 2010 Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers` and authors` commitment to pioneering works of research and for contributing to the conception, production, and design of landmark works in their fields.
Автор: Satoshi Inagaki Название: Orbitals in Chemistry ISBN: 3642017509 ISBN-13(EAN): 9783642017506 Издательство: Springer Рейтинг: Цена: 59955.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: Aimed at chemists in both academia and industry, and written by world-renowned experts in their fields, this text, made up of concise yet authoritative reports, is part of a series that presents critical reviews of current ideas and future trends in research.
Автор: McCaw Charles S. Название: Orbitals ISBN: 1783264136 ISBN-13(EAN): 9781783264131 Издательство: World Scientific Publishing Рейтинг: Цена: 13622.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание:
"This clearly written and elegantly presented short textbook will meet essential needs in diverse undergraduate Chemistry courses, covering orbitals in simple hydrogen - like atoms, multi-electron atoms and in molecules in a mathematically rigorous yet simultaneously physically insightful manner. I will certainly recommend the text to my undergraduates. In excess of 100 problems with full worked answers at all levels are provided and will certainly become a major teaching resource."
Richard G Compton Tutor in Chemistry St John's College Oxford University, UK
This book describes atomic orbitals at a level suitable for undergraduates in chemistry. The mathematical treatment is brought to life by many illustrations rendered from mathematical functions (no artists' impressions), including three-dimensional plots of angular functions, showing orbital phase, and contour plots of the wavefunctions that result from orbital hybridisation.
Orbitals extends the key fundamental quantum properties to many-electron atoms, linear combinations of atomic orbitals, simple molecules, delocalised systems and atomic spectroscopy. By focusing on simple model systems, use of analogies and avoiding group theory the results are obtained from initial postulates without the need for sophisticated mathematics.
Описание: Winner of the PROSE Award for Chemistry & Physics 2010Acknowledging the very best in professional and scholarly publishing, the annual PROSE Awards recognise publishers` and authors` commitment to pioneering works of research and for contributing to the conception, production, and design of landmark works in their fields.
Автор: Wesolowski Tomasz A. Название: Recent Progress in Orbital-Free Density Functional Theory ISBN: 9814436720 ISBN-13(EAN): 9789814436724 Издательство: World Scientific Publishing Рейтинг: Цена: 22968.00 р. Наличие на складе: Есть у поставщика Поставка под заказ.
Описание: This is a comprehensive overview of state-of-the-art computational methods based on orbital-free formulation of density functional theory completed by the most recent developments concerning the exact properties, approximations, and interpretations of the relevant quantities in density functional theory.The book is a compilation of contributions stemming from a series of workshops which had been taking place since 2002. It not only chronicles many of the latest developments but also summarises some of the more significant ones. The chapters are mainly reviews of sub-domains but also include original research.
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