At CINaM together with Andres Saul and Hans-christian Weissker we are organizing a series of lectures on DFT and the Quantum Espresso code. The course will cover standard DFT, functionals, psedo-potentials, surfaces, STM images, structure optimization, etc..
Teaching material and lecture notes can be downloaded here:
- Quantum Espresso Tutorials by Paolo Giannozzi
- DFT for beginners by Fabio Finocchi
- A primer in DFT
- How To Do Simple Calculations with Quantum ESPRESSO by Shobhana NarasimhanYou
Note that you can run all QuantumEspresso tutorials using MaterialApps Live! on you PC.
Help files from QE: pw.x input file, pp.x input file
Here you can find the tutorials used in the course:
Si bulk.tar.gz , H2O.tar.gz, GrapheneOx.tar.gz , tutorials_octopus.tar