|
Program: topics and instructors
Week 1: Density
Functional Theory Methods for Electronic
Structure
-
The basics of Density Functional Theory (DFT)
-
Total energy and response functions
-
Pseudopotential methods
-
Hands-on introductions to methods and the
ABINIT and SIESTA codes
-
Applications to materials using plane wave
and local orbital codes
Week 2: Prediction of
Thermodynamic and Kinetic Properties of Real
Materials
|
