Die DPG-Frühjahrstagung in Dresden musste abgesagt werden! Lesen Sie mehr ...

Bereiche | Tage | Auswahl | Suche | Aktualisierungen | Downloads | Hilfe

MM: Fachverband Metall- und Materialphysik

MM 14: Computational Materials Modelling - Methods I

Montag, 16. März 2020, 15:45–16:45, IFW D

15:45 MM 14.1 Accuracy vs. efficiency? Towards ACKS2-based polarization in force fields — •Patrick Gütlein, Karsten Reuter, Harald Oberhofer, and Jochen Blumberger
16:00 MM 14.2 Modified Becke-Johnson calculations using pseudopotential plane-wave approach: Systematic analysis — •Hazem Abu-Farsakh, Mohammad Abu-Jafar, and Abdallah Qteish
16:15 MM 14.3 Optimized effective potentials to increase the accuracy of approximate proton transfer energy calculations in the excited state — •Pouya Partovi-Azar and Daniel Sebastiani
16:30 MM 14.4 Assessing the accuracy of screened range-separated hybrids for bulk properties of semiconductors — •Stefan Alois Seidl, Bernhard Kretz, and David Alexander Egger
100% | Bildschirmansicht | English Version | Kontakt/Impressum/Datenschutz
DPG-Physik > DPG-Verhandlungen > 2020 > Dresden