Density Functional Theory in Quantum Chemistry (Paperback, Softcover reprint of the original 1st ed. 2014)

In this book, density functional theory (DFT) is introduced within the overall context of quantum chemistry. DFT has become the most frequently used theory in quantum chemistry calculations. However, thus far, there has been no book on the fundamentals of DFT that uses the terminology and methodology of quantum chemistry, which is familiar to many chemists, including experimentalists. This book first reviews the basic concepts and historical background of quantum chemistry and then explains those of DFT, showing how the latter fits into the bigger picture. Recent interesting topics of DFT in chemistry are also targeted. In particular, the physical meanings of state-of-the-art exchange-correlation functionals and their corrections are described in detail. Owing to its unconventionality, this book is certain to be of great interest not only to chemists but also to solid state physicists.

General

Imprint:	Springer Verlag,Japan
Country of origin:	Japan
Release date:	August 2016
First published:	2014
Authors:	Takao Tsuneda
Dimensions:	235 x 155 x 11mm (L x W x T)
Format:	Paperback
Pages:	200
Edition:	Softcover reprint of the original 1st ed. 2014
ISBN-13:	978-4-431-56344-0
Categories:	Books > Science & Mathematics > Physics > General Books > Science & Mathematics > Mathematics > Applied mathematics > General Books > Science & Mathematics > Chemistry > Physical chemistry > Quantum & theoretical chemistry Books > Science & Mathematics > Chemistry > Analytical chemistry > Qualitative analytical chemistry > Chemical spectroscopy, spectrochemistry > General Promotions
LSN:	4-431-56344-X
Barcode:	9784431563440

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