The Augmented Spherical Wave Method A Comprehensive Treatment /

• Main Author: Eyert, Volker (Author)
• Corporate Author: SpringerLink (Online service)
• Format: Electronic eBook
• Language: English
• Published: Berlin, Heidelberg : Springer Berlin Heidelberg : Imprint: Springer, 2013.
• Edition: 2nd ed. 2013.
• Series: Lecture Notes in Physics, 849
• Subjects: Physics.; Chemistry, Physical and theoretical.; Condensed matter.; Materials science.; Condensed Matter Physics.; Numerical and Computational Physics.; Theoretical and Computational Chemistry.; Materials Science, general.

The Augmented Spherical Wave (ASW) method is one of the most powerful approaches to handle the requirements of finite basis sets in DFT calculations. It is particularly suited for the calculation of the electronic, magnetic, and optical properties of solid-state materials. Recent developments allow...