Theory and Applications of the Empirical Valence Bond Approach - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Theory and Applications of the Empirical Valence Bond Approach write by Fernanda Duarte. This book was released on 2017-04-17. Theory and Applications of the Empirical Valence Bond Approach available in PDF, EPUB and Kindle. A comprehensive overview of current empirical valence bond (EVB) theory and applications, one of the most powerful tools for studying chemical processes in the condensed phase and in enzymes. Discusses the application of EVB models to a broad range of molecular systems of chemical and biological interest, including reaction dynamics, design of artificial catalysts, and the study of complex biological problems Edited by a rising star in the field of computational enzymology Foreword by Nobel laureate Arieh Warshel, who first developed the EVB approach
Valence Bond Methods
Valence Bond Methods - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Valence Bond Methods write by Gordon A. Gallup. This book was released on 2002-07-11. Valence Bond Methods available in PDF, EPUB and Kindle. Publisher Description
A Chemist's Guide to Valence Bond Theory
A Chemist's Guide to Valence Bond Theory - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook A Chemist's Guide to Valence Bond Theory write by Sason S. Shaik. This book was released on 2007-12-04. A Chemist's Guide to Valence Bond Theory available in PDF, EPUB and Kindle. This reference on current VB theory and applications presents a practical system that can be applied to a variety of chemical problems in a uniform manner. After explaining basic VB theory, it discusses VB applications to bonding problems, aromaticity and antiaromaticity, the dioxygen molecule, polyradicals, excited states, organic reactions, inorganic/organometallic reactions, photochemical reactions, and catalytic reactions. With a guide for performing VB calculations, exercises and answers, and numerous solved problems, this is the premier reference for practitioners and upper-level students.
Valence Bond Theory
Valence Bond Theory - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Valence Bond Theory write by David Cooper. This book was released on 2002-06-05. Valence Bond Theory available in PDF, EPUB and Kindle. Valence bond (VB) theory, which builds the descriptions of molecules from those of its constituent parts, provided the first successful quantum mechanical treatments of chemical bonding. Its language and concepts permeate much of chemistry, at all levels. Various modern formulations of VB theory represent serious tools for quantum chemical studies of molecular electronic structure and reactivity. In physics, there is much VB-based work (particularly in semi-empirical form) on larger systems. Importance of TopicThe last decade has seen significant advances in methodology and a vast increase in the range of applications, with many new researchers entering the field.Why This TitleValence Bond Theory succeeds in presenting a comprehensive selection of contributions from leading valence bond (VB) theory researchers throughout the world. It focuses on the vast increase in the range of applications of methodology based on VB theory during the last decade and especially emphasizes recent advances.
Valence Bond Theory and Chemical Structure
Valence Bond Theory and Chemical Structure - read free eBook in online reader or directly download on the web page. Select files or add your book in reader. Download and read online ebook Valence Bond Theory and Chemical Structure write by D. J. Klein. This book was released on 1990. Valence Bond Theory and Chemical Structure available in PDF, EPUB and Kindle. For the last two or three decades molecular-orbital theory has been the main foundation of descriptions of molecular structure. In recent years, however, there has been a strong resurgence of interest in the older valence bond theory. In this timely book leading researchers describe valence bond theory and its applications to a wide range of chemical problems. The opening articles provide background materials and a historical perspective of the subject. These are followed by articles on recent computational methodology, discussions of recent novel ab initio calculations (as on benzene), descriptions for conceptual chemical bonding ideas as applied both to molecular structures and chemical reactions, and finally several applications involving condensed matter, including polymers, magnetic solids, metals and high-T c superconductors.
