A matter of density : exploring the electron density concept in the chemical, biological, and materials sciences /

• Άλλοι συγγραφείς: Sukumar, N., 1957- (Επιμελητής έκδοσης)
• Μορφή: Ηλ. βιβλίο
• Γλώσσα: English
• Έκδοση: Hoboken, New Jersey : Wiley, A John Wiley & Sons, Inc., Publication, [2013]
• Θέματα: Electron distribution.; SCIENCE > Chemistry > Physical & Theoretical.; Electronic books.

"This book presents a conceptual treatment of electron density with equal emphasis on computational and philosophical questions in a coherent and logically connected manner consisting of foundations, analysis, and applications"--

Πίνακας περιεχομένων:

• Introduction of Probability Concepts in Physics
• Does God Play Dice?
• The Electron Density
• Atoms in Molecules
• Density Functional Approach to the Electronic Structure of Matter
• Density-Functional Approximations for Exchange and Correlation
• An Understanding of the Origin of Chemical Reactivity from a Conceptual DFT Approach
• Electron Density and Molecular Similarity
• Electrostatic Potentials and Local Ionization Energies in Nanomaterial Applications
• Probing Electron Dynamics with the Laplacian of the Momentum Density
• Applications of Modern Density Functional Theory to Surfaces and Interfaces.