Regensburg 2019 – wissenschaftliches Programm

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

MM: Fachverband Metall- und Materialphysik

MM 16: Methods in Computational Materials Modelling (methodological aspects, numerics)

Dienstag, 2. April 2019, 10:15–13:15, H45

Sessions: Nucleation; Interfaces

10:15 MM 16.1 Atomistic mechanism of nucleation in Ni: the role of pre-structuring and seeding in polymorph selection — •Grisell Díaz Leines and Jutta Rogal
10:30 MM 16.2 Transition path sampling of homogeneous nucleation during solidification in molybdenum — •Sarath Menon, Grisell Diaz Leines, Jutta Rogal, and Ralf Drautz
10:45 MM 16.3 Hysteretic phase transitions of IrTe2: a unified picture from ab initio approaches — •Gabriele Saleh and Sergey Artyukhin
11:00 MM 16.4 Atomistic Modelling of Early Stage Clusters In Al-Mg-Si alloys — •David Kleiven and Jaakko Akola
11:15 MM 16.5 Atomistic Study of Nucleation and Growth in Ni3Al — •Yanyan Liang, Grisell Díaz Leines, Jutta Rogal, and Ralf Drautz
  11:30 15 min. break
11:45 MM 16.6 Machine learning and the thermodynamics of grain boundary segregation — •Liam Huber, Raheleh Hadian, Blazej Grabowski, and Joerg Neugebauer
12:00 MM 16.7 Development of a layer-specific surface segregation model based on atomistic simulations beyond McLeanTamara Krauß and •Sebastian Eich
12:15 MM 16.8 Atomistic simulation of bulk and grain boundaries diffusion in iron — •Sergei Starikov, Matous Mrovec, and Ralf Drautz
12:30 MM 16.9 Modelling of Magnetic Driving Force in Grain Boundary Migration: Using Multi-Phase Field Method — •Liu Huo, Raphael Schiedung, and Ingo Steinbach
12:45 MM 16.10 Determining mobilities and anisotropic grain boundary energies from MD simulations of shrinking grains — •Adrian A. Schratt and Volker Mohles
13:00 MM 16.11 Simulations of anisotropy effects of interface energies — •Volker Mohles and Adrian A. Schratt
100% | Mobil-Ansicht | English Version | Kontakt/Impressum/Datenschutz
DPG-Physik > DPG-Verhandlungen > 2019 > Regensburg