Talk (1232)

1641.
Talk
Hickel, T.: Computational Phase Studies: Deriving free energies and phase transitions from first principles. MRS 2009 Fall Meeting, Boston, MA, USA (2009)
1642.
Talk
Ma, D.; Friák, M.; Knezevic, M.; Kalidindi, S. R.; Lebensohn, R. A.; Roters, F.; Neugebauer, J.; Raabe, D.: Polycrystal coarse graining of elastic properties for Ti-Nb biomedical grades using ab-initio single crystal elastic constants. International Plasticity Conference 2009, Virgin Islands, USA (2009)
1643.
Talk
Nikolov, S.; Sachs, C.; Fabritius, H.; Raabe, D.; Petrov, M.; Friák, M.; Neugebauer, J.: Modeling of the mechanical properties of lobster cuticle from ab initio to macroscale: How nature designs multifunctional composites with optimal properties. International Plasticity Conference 2009, Virgin Islands, USA (2009)
1644.
Talk
von Pezold, J.: Ab initio based approaches to failure mechanisms in steels: Application to hydrogen embrittlement. Materialphysikalisches Seminar, Georg August Universitaet Goettingen (2008)
1645.
Talk
Todorova, M.: Oxidation von Übergangsmetalloberflächen. Technische und Makromolekulare Chemie, Universität Paderborn, Paderborn, Germany (2008)
1646.
Talk
Rayson, M. J.: Progress in techniques for large-scale ab initio calculations: A quantum of speed-up. AIMPRO 2008, Institute of Materials Jean Rouxel, Nantes, France. (2008)
1647.
Talk
Hickel, T.; Neugebauer, J.: Ab-initio simulation of hydrogen in metals. ICAMS Seminar, ICAMS Bochum, Germany (2008)
1648.
Talk
Petrov, M.; Friák, M.; Lymperakis, L.; Raabe, D.; Neugebauer, J.: Atomic Structure and Elastic Anisotropy of Crystalline α-chitin: An Ab-initio Based Conformational Analysis. MRS Fall Conference 2008, Boston, MA, USA (2008)
1649.
Talk
Counts, W. A.; Friák, M.; Battaile, C.; Raabe, D.; Neugebauer, J.: Multiscale Prediction of Polycrystal Elastic Properties of Ultralight Weight Mg-Li Alloys using Ab Initio and FEM Approaches. MRS Fall Conference 2008, Boston, MA, USA (2008)
1650.
Talk
Friák, M.; Deges, J.; Stein, F.; Palm, M.; Frommeyer, G.; Neugebauer, J.: Ab inito study on elastic properties of Fe3Al-based alloys. MRS Fall Meeting 2008, Boston, MA, USA (2008)
1651.
Talk
Knezevic, M.; Ma, D.; Raabe, D.; Kalidindi, S. R.; Friák, M.; Neugebauer, J.: Application of Spectral Methods for Anisotropy Design of Ti-Nb Polycrystals for Biomedical Applications based on ab Initio Elastic Single Crystal Constants and Fast Fourier Homogenization. MRS Fall Conference 2008, Boston, MA, USA (2008)
1652.
Talk
Lymperakis, L.; Neugebauer, J.: Ab-initio based growth simulations of GaN based nanowires. MRS fall meeting, Boston, MA, USA (2008)
1653.
Talk
Nikolov, S.; Petrov, M.; Friák, M.; Raabe, D.; Sachs, C.; Fabritius, H.; Neugebauer, J.; Lymperakis, L.: Hierarchical Modeling of the Elastic Properties of Lobster Cuticle via Ab Initio Calculations and Mean-field Homogenization. MRS Fall Conference 2008, Boston, MA, USA (2008)
1654.
Talk
Petrov, M.; Friák, M.; Lymperakis, L.; Neugebauer, J.; Raabe, D.: Ground-state structure and elastic anisotropy of crystalline alpha-chitin: An ab-initio based conformational analysis. Materials Research Society meeting (MRS), Boston, MA, USA (2008)
1655.
Talk
Todorova, M.: Oxidation of transition metal surfaces. GO-Seminar, MPI für Eisenforschung GmbH, Düsseldorf, Germany (2008)
1656.
Talk
Nikolov, S.; Petrov, M.; Friák, M.; Sachs, C.; Fabritius, H.; Raabe, D.; Neugebauer, J.; Lymperakis, L.: Multiscale Modelling of the Elastic Properties of Biological Polymer-Based Nanocomposites with Hierarchical Microstructure: The Lobster Cuticle. 3rd International Conference on Polymer Behaviour, Marrakech, Morocco (2008)
1657.
Talk
Neugebauer, J.: Ab initio based modeling of engineering materials: From a predictive thermodynamic description to tailored mechanical properties. Multiscale Materials Modeling 2008, Tallahassee, FL, USA (2008)
1658.
Talk
Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Understanding the phase transformations of the Ni2MnGa shape memory system. (2008)
1659.
Talk
Udyansky, A.; Bugaev, V.; von Pezold, J.; Friák, M.; Neugebauer, J.: Modeling of the strain-induced interaction between carbon atoms in Fe-C solid solution using embedded atom method potential. Contemporary Problems of Metal Physics, Kiev, Ukraine (2008)
1660.
Talk
Neugebauer, J.: Design of engineering materials based on ab initio thermodynamics and kinetics. Materials Science and Technology 2008, Pittsburgh, PA, USA (2008)
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