Full-Potential Electronic Structure Method: Energy and Force Calculations with Density Functional and Dynamical Mean Field Theory

by John M. Wills, Mebarek Alouani, Anna Delin, et al.

Book Overview

This is a book describing electronic structure theory and application within the framework of a methodology implemented in the computer code RSPt. In 1986, when the code that was to become RSPt was developed enough to be useful, it was one of the ?rst full-potential, all-electron, relativistic implem- tations of DFT (density functional theory). While RSPt was documented p- asitically in many publications describing the results of its application,...

• Format: Paperback
• Language: English
• ISBN: 364226624X
• ISBN13: 9783642266249
• Release Date: January 2013
• Publisher: Springer
• Length: 200 Pages
• Weight: 0.67 lbs.
• Dimensions: 0.5" x 6.1" x 9.2"