Electronic Structure Calculations for Solids and Molecules: Theory and Computational Methods

By Professor Jorge Kohanoff.

Electronic Structure Calculations for Solids and Molecules: Theory and Computational Methods

Description

Electronic structure problems are studied in condensed matter physics and theoretical chemistry to provide important insights into the properties of matter. This 2006 graduate textbook describes the main theoretical approaches and computational techniques, from the simplest approximations to the most sophisticated methods. It starts with a detailed description of the various theoretical approaches to calculating the electronic structure of solids and molecules, including density-functional theory and chemical methods based on Hartree-Fock theory. The basic approximations are thoroughly disc...

ISBN(s)

0521815916, 9780521815918

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