Dresden 2014 – wissenschaftliches Programm

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O: Fachverband Oberflächenphysik

O 56: Focussed Session: Frontiers of Electronic Structure Theory - Non-equilibrium Phenomena at the Nano-scale V

Mittwoch, 2. April 2014, 16:00–19:15, TRE Ma

16:00 O 56.1 Topical Talk: Theory of nonlinear phononics for coherent light-control of solids — •Antoine Georges, Alaska Subedi, and Andrea Cavalleri
16:30 O 56.2 DFT+Frontier Orbital U — •Emine Kucukbenli and Nicola Marzari
16:45 O 56.3 Quasiparticle self-consistent GW method with spin-orbit coupling applied to Bi and HgTe — •Christoph Friedrich, Irene Aguilera, Markus Betzinger, and Stefan Blügel
17:00 O 56.4 Studies of semiconducting pyrite and marcasite compounds using many-body perturbation theory in the GW approximation — •Timo Schena, Gustav Bihlmayer, Christoph Friedrich, and Stefan Blügel
17:15 O 56.4a Localized Resolution of Identity: Accurate and efficient evaluation of the coulomb operator for advanced functionals — •Arvid Conrad Ihrig, Jürgen Wieferink, Igor Ying Zhang, Sergey Levchenko, Matti Ropo, Patrick Rinke, Volker Blum, and Matthias Scheffler
17:30 O 56.5 Probing d-band Quantum Well States in Palladium Nanofilms — •Srijan Kumar Saha, Sujit Manna, Marek Przybylski, Valeri Stepanyuk, and Jurgen Kirschener
17:45 O 56.6 Implementation and analysis of a plane wave and real space pseudopotential method including an efficient spin-orbit coupling treatment tailored to calculate the electronic structure of large-scale semiconductor nanostructures — •Frank Zirkelbach, Pierre-Yves Prodhomme, Jerome Jackson, and Gabriel Bester
18:00 O 56.7 Strong Parallelization of Real-Space DFT Calculations — •Andrea Nobile, Paul Baumeister, Daniel Wortmann, and Stefan Blügel
18:15 O 56.8 Rare Earth Metals in Density-Functional Theory — •Marco Casadei, Xinguo Ren, Patrick Rinke, Angel Rubio, and Matthias Scheffler
18:30 O 56.9 Electronic Structure and van der Waals Interactions in the Stability and Mobility of Point Defects in Semiconductors — •Wang Gao and Alexandre Tkatchenko
18:45 O 56.10 Efficient Path-Integral Molecular Dynamics with High-Order Decomposition of the Boltzmann Operator — •Igor Poltavsky, Kim Kwang, and Alexandre Tkatchenko
19:00 O 56.11 2D nanopatterns of shape-persistent molecular polygons on HOPG — •Stefan-S. Jester, Nina Schönfelder, Eva Sigmund, and Sigurd Höger
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DPG-Physik > DPG-Verhandlungen > 2014 > Dresden