Concepts and Methods in Modern Theoretical Chem, Ghosh, Chat..

Name: Concepts and Methods in Modern Theoretical Chem, Ghosh, Chat..
Brand: CRC Press

CRC Press

Concepts and Methods in Modern Theoretical ChemistryElectronic Structure and Reactivity\nAuthor(s): Swapan Kumar Ghosh, Pratim Kumar Chattaraj\nFormat: Paperback\nPublisher: Taylor & Francis Ltd, United Kingdom\nImprint: CRC Press\nISBN-13: 9780367380328, 978-0367380328\nSynopsis\nConcepts 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.\n\nThis book covers a wide range of subjects, including discussions on the following topics:\n\nDFT, particularly the functional and conceptual aspects\n\nExcited states, molecular electrosta.