Mini-symposium: “Modeling and simulation of condensed matter”

Agenda:

Hälsar välkommen: Göran Wahnström

10.00 Hannu-Pekka Komsa, University of Oulu
“Machine-learning accelerated simulations of Raman spectra"

10.40 Julia Wiktor, Chalmers
“Self-trapped excitons from time-dependent hybrid density functional calculations"

11.20 Lucy Whalley, Northumbria University
“Halide and chalcogenide perovskite materials: defects and dynamics”

13.00 Paul Erhart, Chalmers
“Optical line shapes of color centers in solids from classical autocorrelation functions”    

13.40 Alexander Ganose, Imperial College
“Accelerating lattice dynamics calculations through automation and machine learning”

14.20 Sergey Simak, Linköping University
"Disorder from first principles”