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Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) by Robert G. Parr (Repost)
Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) by Robert G. Parr (Repost)
Date: 11 November 2010, 15:19

Density-Functional Theory of Atoms and Molecules (International Series of Monographs on Chemistry) by Robert G. Parr (Repost)
Publisher: Oxford University Press, USA (May 26, 1994) | ISBN: 0195092767 | Pages: 352 | DJVU | 9.51 MB

This book is a rigorous, unified account of the fundamental principles of the density-functional theory of the electronic structure of matter and its applications to atoms and molecules. Containing a detailed discussion of the chemical potential and its derivatives, it provides an understanding of the concepts of electronegativity, hardness and softness, and chemical reactivity.
Both the Hohenberg-Kohn-Sham and the Levy-Lieb derivations of the basic theorems are presented, and extensive references to the literature are included. Two introductory chapters and several appendices provide all the background material necessary beyond a knowledge of elementary quantum theory. The book is intended for physicists, chemists, and advanced students in chemistry.



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