Materials - MATRL

Basic theory and methods of electronic structure, illustrated with examples of practical computational methods and real-world applications. Topics: Band structure; Uniform electron gas; Density functional theory; Exchange and correlation; Kohn-Sham equations; Pseudopotentials; Basis sets; Predicting materials properties: bulk, surfaces, interfaces, defects.

No Prerequisites


MATRL 279
0 / 25 Enrolled
First-Principles Calculations for Materials
Van De Walle
M W
14:00 PM - 15:15 PM