Density-Functional Theory of Atoms and Molecules Paperback / softback
by Robert G. (William R. Kenan Jr Professor of Theoretical Chemistry, William R. Kenan Jr Profess Parr, Postdoctoral Fellow, both at University of North Carolina at Chape Yang Weitao (Postdoctoral Fellow
Part of the International Series of Monographs on Chemistry series
Paperback / softback
Description
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.
Information
-
Only a few left - usually despatched within 24 hours
- Format:Paperback / softback
- Pages:342 pages, 17 illus.
- Publisher:Oxford University Press Inc
- Publication Date:05/01/1995
- Category:
- ISBN:9780195092769
Information
-
Only a few left - usually despatched within 24 hours
- Format:Paperback / softback
- Pages:342 pages, 17 illus.
- Publisher:Oxford University Press Inc
- Publication Date:05/01/1995
- Category:
- ISBN:9780195092769
