Lectures & Exercises: Summer term 2022
Timetable: UFV/APMM/19P, Tuesday 08:00 – 09:30, Room: KNKTFA (PA9-PKn); distant due to COVID-19 (bbb link), exercises, Tuesday 09:30 – 11:00, distant due COVID-19
Outline:
- Crash course to Many-body Schrodinger Equation
- Introduction to Density Functional Theory
- Numerical Methods for Realistic Calculations
- Equilibrium Structures of Materials
- Elastic Properties of Materials
- Vibration of Molecules and Solids
- Phonons and Vibrational Spectroscopy
- Photoelectron Spectroscopy
- Dielectric Function and Optical Spectra
- Density Functional Theory and Magnetic Materials
Literature:
- F. Giustino, Materials Modelling using Density Functional Theory, Oxford University Press 2014, ISBN 978-0-19-966243
- J. Kohanoff, Electronic Structure Calculations for Solids and Molecules, Cambridge University Press 2006, ISBN 978-0-521-81591-8
- M. P. Marder, Condensed Matter Physics, John Wiley & Sons 2010, ISBN 978-0-470-61798-4
- R. M. Martin, Electronic Structure, Cambridge University Press 2004, ISBN 978-0-521-53440-6
- S. Bluegel et al., Computing Solids, Lecture Notes of the 45th IFF Spring School 2014, ISBN 978-3-89336-912-6
Supporting materials: check webdisk
Exam assignments:
2022
- Juraj Mnich – bilayer graphene stacking (pdf)
- Timon Moško – TaSi2N4 monolayer (pdf)
- Dávid Sivý – MnCuN6C6 molecular chain (pdf)
- Dominik Volavka – 1T and 1H polymorph NbSe2 (pdf)
2021