Dresden 2014 – wissenschaftliches Programm

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HL: Fachverband Halbleiterphysik

HL 99: Electronic structure theory

Donnerstag, 3. April 2014, 15:00–17:00, POT 151

15:00 HL 99.1 Time-dependent density functional theory of magneto-optical response of periodic insulators — •Irina V. Lebedeva, Ilya V. Tokatly, and Angel Rubio
15:15 HL 99.2 Predictive GW calculations with pseudopotentials and plane-waves — •Jiri Klimes and Georg Kresse
15:30 HL 99.3 Eigenvalues from Density Functional Theory with exact exchange – chances and limitations — •Tobias Schmidt and Stephan Kümmel
15:45 HL 99.4 Energy Curvature of Solids with Fractional Charge in DFT — •Vojtech Vlcek, Helen Eisenberg, Gerd Steinle-Neumann, Leeor Kronik, and Roi Baer
16:00 HL 99.5 First-principles study of excitonic effects in Raman intensities — •Yannick Gillet, Matteo Giantomassi, and Xavier Gonze
16:15 HL 99.6 Zero-point motion effect on the bandgap of diamond: validation of codes — •Samuel Poncé, Gabriel Antonius, Paul Boulanger, Elena Cannuccia, Andrea Marini, Michel Côté, and Xavier Gonze
16:30 HL 99.7 Wavefunction localisation and acceptor ionisation in Ga1−xMnxAs, an electronic structure perspective — •Jerome Jackson and Gabriel Bester
16:45 HL 99.8 Origin of electronic subgap states in amorphous semiconductor oxides on the example of In-Ga-Zn-O (IGZO)Wolfgang Körner, •Daniel Urban, and Christian Elsässer
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