eBook - PDF

Density Functional Theory

Name: Density Functional Theory
ISBN: 9781838818364

Daniel Glossman-Mitnik,

166 pages
English
PDF
Available on iOS & Android

eBook - PDF

Density Functional Theory

Daniel Glossman-Mitnik,

About this book

Density Functional Theory (or DFT for short) is a potent methodology useful for calculating and understanding the molecular and electronic structure of atoms, molecules, clusters, and solids. Its use relies not only in the ability to calculate the molecular properties of the species of interest but also provides interesting concepts that allow a better comprehension of the chemical reactivity of the studied systems. This book represents an attempt to present examples on the utility of DFT for the understanding of the chemical reactivity through descriptors that constitute the basis of the so called Conceptual DFT (sometimes also named as Chemical Reactivity Theory) as well as the application of the theory and its related computational procedures in the determination of the molecular properties of different systems of academic and industrial interest.

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Yes, you can access Density Functional Theory by Daniel Glossman-Mitnik in PDF and/or ePUB format, as well as other popular books in Physical Sciences & Condensed Matter. We have over one million books available in our catalogue for you to explore.