Materials Computation Center

Overview of Electronic Structure theory and methods including Density Functional Theory

Richard M. Martin, University of Illinois at Urbana-Champaign

Hands-on introduction to the plane wave pseudopotential code ABINIT using the ABINIT

Donald R. Hamann, Bell Labs and Rutgers

Hands-on introduction to the local orbital pseudopotential code SIESTA for electronic structure calculations and ab initio molecular dynamics simulations of molecules and solids

J. Miguel Alonso-Pruneda, Institut de Ciencia de Materials de Barcelona