Publications of J. Neugebauer

Hickel, T.; Uijttewaal, M.; Neugebauer, J.: Ab initio investigation of temperature dependent effects in magnetic shape memory Heusler alloys. SPP 1239 Convention, Duisburg, Germany (2009)

Hickel, T.; Dick, A.; Körmann, F.; Grabowski, B.; Neugebauer, J.: Ab initio steel design: Achievements and challenges. Scientific Advisory Board Meeting 2009, MPI für Eisenforschung GmbH, Düsseldorf, Düsseldorf, Germany (2009)

Fabritius, H.; Hild, S.; Nikolov, S.; Ziegler, A.; Raabe, D.; Friák, M.; Neugebauer, J.: Variations in the constructional morphology of crustacean skeletal elements at different hierarchical levels. Third International Conference on Mechanics of Biomaterials & Tissues ICMOBT 2009, Clearwater, FL, USA (2009)

Fabritius, H.; Ziegler, A.; Hild, S.; Nikolov, S.; Petrov, M.; Sachs, C.; Lymperakis, L.; Friák, M.; Neugebauer, J.; Raabe, D.: Extremal stiffness of crustacean cuticle through hierarchical optimization: Experiments and modeling from ab initio to macroscale. PLASTICITY 2009, St. Thomas, Virgin Islands, USA (2009)

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)

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)

Hickel, T.; Neugebauer, J.: Ab-initio simulation of hydrogen in metals. ICAMS Seminar, ICAMS Bochum, Germany (2008)

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)

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)

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)

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)

Lymperakis, L.; Neugebauer, J.: Ab-initio based growth simulations of GaN based nanowires. MRS fall meeting, Boston, MA, USA (2008)

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)

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)

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)

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)

Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Understanding the phase transformations of the Ni2MnGa shape memory system. (2008)

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)

Neugebauer, J.: Design of engineering materials based on ab initio thermodynamics and kinetics. Materials Science and Technology 2008, Pittsburgh, PA, USA (2008)

Lymperakis, L.; Neugebauer, J.: Ab initio study of Thermodynamics and adatom kinetics on non-polar GaN surfaces: Consequences on the growth morphology and the formation of nanowires. International Workshop on Nitride Semiconductors, Montreux, Switzerland (2008)