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Concepts and Methods in Modern Theoretical Chemistry: Electronic Structure and Reactivity 第1 版
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Concepts and Methods in Modern Theoretical Chemistry: Electronic Structure and Reactivity
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:
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.
498 pages
| メディア | 書籍 Paperback Book (ソフトカバーで背表紙を接着した本) |
| リリース済み | 2019年9月23日 |
| ISBN13 | 9780367380328 |
| 出版社 | Taylor & Francis Ltd |
| ページ数 | 498 |
| 寸法 | 150 × 220 × 10 mm · 704 g |
| 言語 | 英語 |
| 編集者 | Chattaraj, Pratim Kumar |
| 編集者 | Ghosh, Swapan Kumar |
