Berlin 2012 –
scientific programme
MM 13: Computational Materials Modelling III - Alloys
Monday, March 26, 2012, 15:45–17:00, TC 006
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15:45 |
MM 13.1 |
Cluster expansions for kinetic Monte-Carlo simulations: towards time evolution with DFT accuracy — •Tobias C. Kerscher, Martin Leitner, Stefan Müller, and Raimund Podloucky
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16:00 |
MM 13.2 |
Tight-binding modelling of complex alloys: methods and challenges — •Eunan J. McEniry, Georg K. H. Madsen, and Ralf Drautz
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16:15 |
MM 13.3 |
Theoretical investigation of Cr-Sb compounds - structure and magnetic properties — •G. Kuhn, S. Mankovsky, S. Polesya, H. Ebert, M. Regus, and W. Bensch
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16:30 |
MM 13.4 |
Effects of In concentration in CuGa1−xInxSe2: a first-principles study — •Rolando Saniz, Dirk Lamoen, and Bart Partoens
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16:45 |
MM 13.5 |
Ground-state structures and elastic properties of Ni-Ti-Hf shape memory alloys: An ab-initio study — •Jürgen Spitaler, Daniel Lüftner, Rostam Golesorkhtabar, Peter Puschnig, and Claudia Ambrosch-Draxl
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