Berlin 2015 –
wissenschaftliches Programm
O 68: Electronic Structure Theory: Many-Body Effects
Mittwoch, 18. März 2015, 18:15–21:00, Poster A
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18:15 |
O 68.1 |
Spin Entanglement in Atoms and Molecules — •Stefano Pittalis, Filippo Troiani, Carlo Andrea Rozzi, and Giovanni Vignale
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18:15 |
O 68.2 |
The role of the quantum well states in the oscillating behavior of the magnetic anisotropy energy and the orbital moment anisotropy — •Leonid Sandratskii
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18:15 |
O 68.3 |
Ab initio calculation of the first order Raman spectrum of graphene and graphite — •Albin Hertrich, Caterina Cocchi, Pasquale Pavone, and Claudia Draxl
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18:15 |
O 68.4 |
Thermoelectric clathrates: stability of the Ba8AlxSi46−x and Sr8AlxSi46−x compounds — •Maria Troppenz, Santiago Rigamonti, and Claudia Draxl
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18:15 |
O 68.5 |
Atomistic Modeling of Optical Coefficients in Layered Materials — •Christian Vorwerk, Caterina Cocchi, and Claudia Draxl
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18:15 |
O 68.6 |
The Novel Materials Discovery (NoMaD) Repository — •Evgeny Blokhin, Fawzi Mohamed, Karsten Hannewald, Luca Ghiringhelli, Pasquale Pavone, Christian Carbogno, Johann-Christoph Freytag, Matthias Scheffler, and Claudia Draxl
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18:15 |
O 68.7 |
Acoustic magnons in the long-wavelength limit: resolving the Goldstone violation in many-body perturbation theory — •Mathias C.T.D. Müller, Christoph Friedrich, and Stefan Blügel
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18:15 |
O 68.8 |
Electronic Structure of Hybrid Materials by Means of Self-Consistent GW — •Nora Salas-Illanes and Claudia Draxl
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18:15 |
O 68.9 |
Size-dependent optical gaps of Cu chalcogenide nanocrystals from GW and the Bethe-Salpeter equation — •Sabine Körbel, Miguel Alexandre Lopes Marques, and Silvana Botti
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18:15 |
O 68.10 |
2D Metal Dichalocogenides and Oxides for Hydrogen Evolution: A Computational Approach — •Mohnish Pandey, Aleksandra Vojvodic, Kristian S. Thygesen, and Karsten W. Jacobsen
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