O 82: Poster Session VI: Poster to Mini-Symposium: Frontiers of electronic-structure theory III
Mittwoch, 3. März 2021, 13:30–15:30, P
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13:30 |
O 82.1 |
Diagrammatic Monte Carlo study of the acoustic lattice polaron — •Thomas Hahn, Andrey Mishchenko, Naoto Nagaosa, and Cesare Franchini
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13:30 |
O 82.2 |
First principles study of spin spirals in the multiferroic BiFeO3 — •Sebastian Meyer, Bin Xu, Matthieu Verstraete, Laurent Bellaiche, and Bertrand Dupé
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13:30 |
O 82.3 |
Influence of electronic excitations on defect formation on GaAs — •Daniel Muñoz-Santiburcio, Natalia Koval, Fabiana Da Pieve, and Emilio Artacho
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13:30 |
O 82.4 |
Optimized effective potentials to increase the accuracy of approximate proton transfer energy calculations in the excited state — •Pouya Partovi-Azar and Daniel Sebastiani
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13:30 |
O 82.5 |
Assessment of the Ab Initio Bethe-Salpeter Equation Approach for the Low-Lying Excitation Energies of Bacteriochlorophylls and Chlorophylls — •Zohreh Hashemi and Linn Leppert
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13:30 |
O 82.6 |
microscopic modeling of rare-earth perovskite properties — •alireza sasani, jorge iniguez, and eric bousquet
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13:30 |
O 82.7 |
Ab initio phonon self-energies and fluctuation diagnostics of phonon anomalies: Lattice instabilities from Dirac pseudospin physics in transition metal dichalcogenides — •Jan Berges, Erik van Loon, Arne Schobert, Malte Rösner, and Tim Wehling
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