Density Functional Theory and Electronic Structure (WS2019) - Tutorial

Program of the tutorial

date topic
23.10.2019 Obtaining and installing Fleur
30.10.2019 Calculating lattice constants
06.11.2019 Convergence with respect to parameters
13.11.2019 Band structures, semicore states, and local orbitals
20.11.2019 Density of states
04.12.2019 Force relaxations and thin films
11.12.2019 Simple magnetic systems
18.12.2019 Spin-orbit coupling
08.01.2020 Noncollinear magnetism and force theorem
15.01.2020 GW approximation
22.01.2020 GW bandstructures utilizing Wannier interpolation
29.01.2020 Spin spirals