Density-functional Theory of Atoms and Molecules PDF ePub eBook

Books Info:

Density-functional Theory of Atoms and Molecules free pdf 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 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.

About Robert G. Parr

Sad to say, at the moment we cannot offer you specifics of your Manager Robert G. Parr. Nevertheless does not necessarily mean that individuals fail to be with her variety. We also question that you simply allow us to within this issue. When you have down time and require will certainly greatly get pleasure from should you tell us your information. Whenever receiving these kinds of opinions and knowledge coming from people in regards to the Density-functional Theory of Atoms and Molecules Writer Robert G. Parr, we very first her look at. When all of us be sure that most real, simply just publish it. All of us fully grasp this aid along with many thanks in advance.

Details Book

Author : Robert G. Parr
Publisher : Oxford University Press Inc
Data Published : 01 March 1994
ISBN : 0195092767
EAN : 9780195092769
Format Book : PDF, Epub, DOCx, TXT
Number of Pages : 352 pages
Age + : 15 years
Language : English
Rating :

Reviews Density-functional Theory of Atoms and Molecules



17 Comments Add a comment




Related eBooks Download


  • Applications of Density Functional Theory to Chemical Reactivity free pdfApplications of Density Functional Theory to Chemical Reactivity

    The series Structure and Bonding publishes critical reviews on topics of research concerned with chemical structure and bonding. The scope of the series spans the entire Periodic Table and addresses structure and bonding issues associated with all of the elements..


  • Spectra of Atoms and Molecules free pdfSpectra of Atoms and Molecules

    Spectra of Atoms and Molecules. 2nd Edition is designed to introduce advanced undergraduates and new graduate students to the vast field of spectroscopy. Of interest to chemists. physicists. astronomers..


  • Energy Density Functional Theory of Many-electron Systems free pdfEnergy Density Functional Theory of Many-electron Systems

    I would like to present to a wide circle of the readers working in quantum chem- istry and solid-state physics. as ..*ell as in other fields of many-body physics and its interfaces. this book deyoted to density functional theory written by my colleagues Eugene S..


  • Energy Density Functional Theory of Many-electron Systems free pdfEnergy Density Functional Theory of Many-electron Systems

    I would like to present to a wide circle of the readers working in quantum chem- istry and solid-state physics. as ..*ell as in other fields of many-body physics and its interfaces. this book deyoted to density functional theory written by my colleagues Eugene S..


  • Quantum Mechanics for Chemists free pdfQuantum Mechanics for Chemists

    Designed to provide chemistry undergraduates with a basic understanding of the principles of quantum mechanics. this text assumes some knowledge of chemical bonding and a familiarity with the qualitative aspects of molecular orbitals in molecules such as butadiene and benzene..


  • Density-functional Theory of Atoms and Molecules free pdfDensity-functional Theory of Atoms and Molecules

    . 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