MM 51: Computational Materials Modelling VII - Oxides
Donnerstag, 29. März 2012, 11:45–13:00, TC 006
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11:45 |
MM 51.1 |
Structural and electronic properties of oxides within a transferable tight binding model — •Alessandro Parma, Georg H. K. Madsen, and Ralf Drautz
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12:00 |
MM 51.2 |
Molecular Dynamics of Metal Oxide Systems with Polarizable Force Fields — •Philipp Beck, Peter Brommer, Stephen Hocker, Johannes Roth, Hans-Rainer Trebin, and Siegfried Schmauder
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12:15 |
MM 51.3 |
Thermodynamic stability of Cd2SnO4 and Zn2SnO4 and their point defects: A comparative study using first-principles methods — •Arno Fey, Péter Ágoston, and Karsten Albe
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12:30 |
MM 51.4 |
Interplay between defect dipoles and ferroelectric polarization in a lead-free piezoelectric material — •Sabine Körbel and Christian Elsässer
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12:45 |
MM 51.5 |
Attracting shallow donors: Hydrogen passivation in (Al,Ga,In)-doped ZnO — •Mozhgan Amini, Masahiko Matsubara, Rolando Saniz, Dirk Lamoen, and Bart Partoens
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