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Berlin 2018 – wissenschaftliches Programm

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MM: Fachverband Metall- und Materialphysik

MM 42: Focus Session: Frontiers of Electronic-Structure Theory: Correlated Electron Materials V (joint session O/MM/DS/TT/CPP)

Mittwoch, 14. März 2018, 15:00–17:45, HL 001

Organizers: Silke Biermann, Ecole Polytechnique, Palaiseau cedex, France; Paul R. Kent, Oak Ridge National Laboratory, USA; Matthias Scheffler, Fritz-Haber-Institut der Max-Planck-Gesellschaft, Berlin

(Synopsis provided with part I of this session)

15:00 MM 42.1 Hauptvortrag: Computational Approach to the Electronic Structure of Strongly Correlated Materials: Towards Theoretical Spectroscopy and Theory Assisted Material Design — •Gabriel Kotliar
15:30 MM 42.2 Spectral properties of Sr2IrO4 from first principles — •Cyril Martins, Benjamin Lenz, and Silke Biermann
15:45 MM 42.3 Role of non-local correlations in doped Sr2IrO4 — •Benjamin Lenz, Cyril Martins, and Silke Biermann
16:00 MM 42.4 Describing the coupled structural and metal-insulator transition in rare-earth nickelates with DFT+DMFT — •Alexander Hampel and Claude Ederer
16:15 MM 42.5 Magnetocrystalline anisotropy of FePt: LDA+DMFT study — •saleem Ayaz Khan, Junqing Xu, johan Schott, Ondřej Šipr, and Jan Minár
16:30 MM 42.6 Diagnostics for plasmon satellites and Hubbard bands in transition metal oxides — •Steffen Backes, Hong Jiang, and Silke Biermann
16:45 MM 42.7 Phase transitions of the 2D Hubbard-Holstein model — •Teresa E. Reinhard, Uliana Mordovina, Heiko Appel, and Angel Rubio
17:00 MM 42.8 A quantum embedding theory combining many-body perturbation theory with configuration interaction — •Marc Dvorak and Patrick Rinke
17:15 MM 42.9 Real-Structure Effects and Correlation in Layered Sodium CobaltatesSophie Chauvin, Silke Biermann, Lucia Reining, and •Claudia Rödl
17:30 MM 42.10 Slave rotor approach to impurity models with correlated dp orbitals — •Jakob Steinbauer and Silke Biermann
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