Talk (1155)

1561.
Talk
Neugebauer, J.: Materials design based on ab initio thermodynamics and kinetics. XVII International Materials Research Congress 2008, Cancun, Mexico (2008)
1562.
Talk
Raabe, D.; Sachs, C.; Fabritius, H.; Friak, M.; Petrov, M.; Nikolov, S.: Principles to design and simulate hierarchical materials with property-relevant structural features. MPI for Colloids and Interfaces, Golm, Potsdam, Germany (2008)
1563.
Talk
Friák, M.; Sander, B.; Ma, D.; Counts, W. A.; Raabe, D.; Neugebauer, J.: Ab-initio based multi-scale approaches to the elasticity of polycrystals. Mid-term COST conference on Multiscale Modeling of Materials, COST action 19, Brno, Czech Republic (2008)
1564.
Talk
Neugebauer, J.: Materials design based on ab initio thermodynamics and kinetics. Mid-term COST conference on Multiscale Modeling of Materials, Brno, Czech Republic (2008)
1565.
Talk
Marquardt, O.; Hickel, T.; Neugebauer, J.: Neues Licht aus künstlichen Atomen - Halbleiterquantenpunkte. Schulvortrag zur Jahrestagung der MPG, Dresden, Germany (2008)
1566.
Talk
Friák, M.; Sob, M.; Kim, O.; Ismer, L.; Neugebauer, J.: Ab initio study of the alpha-iron stability limits. Ab initio Description of Iron and Steel: Magnetism and Phase diagrams (ADIS 2008), Ringberg castle, Tegernsee, Germany (2008)
1567.
Talk
Grabowski, B.; Ismer, L.; Hickel, T.; Neugebauer, J.: Ab initio up to the melting point: Influence of vacancies and explicit anharmonicity. International Workshop on Ab initio Description of Iron and Steel (ADIS2008), Ringberg Castle, Germany (2008)
1568.
Talk
Ismer, L.; Friák, M.; Hickel, T.; Neugebauer, J.: Effect of interstitial carbon on the magnetic structure of fcc iron: Towards an ab-initio simulation of austenitic steels. International Workshop on Ab initio Description of Iron and Steel (ADIS2008), Ringberg Castle, Germany (2008)
1569.
Talk
Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: The free energy of bcc iron: Integrated ab initio derivation of vibrational, electronic, and magnetic contributions. International Workshop on Ab initio Description of Iron and Steel (ADIS2008), Ringberg Castle, Germany (2008)
1570.
Talk
Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Phase transformations of Ni2MnGa shape memory alloy from first principles: The martensitic transition & magnetism, The pre-martensitic transition & soft modes, Off-stoichiometry & the stability of the phases. Workshop on magnetic shape memory alloys, Bremen, Germany (2008)
1571.
Talk
Neugebauer, J.: Ab initio based modeling of engineering materials: From a predictive thermodynamic description to tailored mechanical properties. Kolloquium der TUM, Garching, Germany (2008)
1572.
Talk
Ma, D.; Counts, W. A.; Roters, F.; Friák, M.; Neugebauer, J.; Raabe, D.: Using ab initio Simulations in Texture Research. 15th International Conference on the Texture of Materials (ICOTOM 15), Pittsburgh, PA, USA (2008)
1573.
Talk
Ma, D.; Raabe, D.; Roters, F.; Friák, M.; Neugebauer, J.: Modeling Rolling Textures of Beta Ti Alloys Using Constitutive Data From Ab-initio Simulations. 15 th International Conference on the Texture of Materials (ICOTOM 15), Pittsburgh, PA, USA (2008)
1574.
Talk
Sander, B.; Ma, D.; Friak, M.; Neugebauer, J.; Raabe, D.: Texture Evolution during Casting and Hot Rolling of a β-Ti-Nb alloy. 15th International Conference on the Texture of Materials (ICOTOM 15), Carnegie Mellon University Center, Pittsburgh, PA, USA (2008)
1575.
Talk
Lymperakis, L.; Neugebauer, J.: Thermodynamics and adatom kinetic on non-polar GaN surfaces: origin of a strong growth anisotropy. E-MRS Spring meeting, Strasbourg, France (2008)
1576.
Talk
Lymperakis, L.; Neugebauer, J.: Ab-initio based calculation of GaN surfaces, interfaces, and extended defects. Colloquium Paul-Drude-Institut Berlin, Berlin, Germany (2008)
1577.
Talk
Neugebauer, J.: Simulation of surface growth processes. 4th International Workshop on Crystal Growth Technology (IWCGT-4), Beatenberg, Switzerland (2008)
1578.
Talk
Hickel, T.: Ab initio determination of free energies and phase diagrams. MPIE Inter-Departmental Tutorial Day(s) 2008, MPIE, Duesseldorf, Germany (2008)
1579.
Talk
Counts, W. A.; Petrov, M.; Friák, M.; Grabowski, B.; Hickel, T.; Raabe, D.; Neugebauer, J.: Using Density Functional Theory to Predict Material Properties of Alloy and Biological Systems. Invited talk at University of Groningen, Department of Biomedical Engineering, Groningen, The Netherlands (2008)
1580.
Talk
Marquardt, O.; Hickel, T.; Neugebauer, J.: Optical properties of semiconductor nanostructures including strain and piezoelectric effects. PARSEM meeting and workshop, Cambridge, UK (2008)
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