Publications of J. Neugebauer

Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Phase transformations of Ni2MnGa shape memory alloy from first principles. International Workshop on Ab initio Description of Iron and Steel (ADIS2008), Ringberg Castle, Germany (2008)

Uijttewaal, M.; Hickel, T.; Neugebauer, J.: Ab initio investigation of temperature dependent effects in magnetic shape memory alloys. Evaluation of the SPP 1239 program, Dresden, Germany (2008)

Friák, M.; Neugebauer, J.: Error-propagation in multi-scale approaches to the elasticity of polycrystals. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Hickel, T.; Uijttewaal, M.; Grabowski, B.; Neugebauer, J.: First principles determination of phase transitions: The (pre)martensitic transition in Ni₂MnGa. UCSB-MPG Workshop on Inorganic Materials for Energy Conversion, Storage and Conservation, UCLA Lake Arrowhead Conference Center, CA, USA (2008)

Ismer, L.; Hickel, T.; Neugebauer, J.: First principles analysis of Hydrogen in Manganese-rich austentitic steels. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Ismer, L.; Hickel, T.; Neugebauer, J.: First principles study of Hydrogen in Mn-rich austenitic steels. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Körmann, F.; Dick, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Importance of magnetism for the thermal expansion of transition metals: An ab initio study. Spring meeting of the German Physical Society (DPG), Berlin, Germany (2008)

Ma, D.; Friák, M.; Neugebauer, J.; Raabe, D.: Novel multi-descriptive approach to crystal plasticity of textured beta-Ti alloys. Deutschen Physikalischen Gesellschaft (DPG) Annual Meeting 2008, Berlin, Germany (2008)

Abu-Farsakh, H.; Neugebauer, J.; Albrecht, M.: Ab-initio study of compositional anti-correlation of In and N in InGaAsN alloys. The 7th International Conference of Nitride Semiconductors (ICNS-7), Las Vegas, NV, USA (2007)

Friák, M.; Ma, D.; Sander, B.; Raabe, D.; Neugebauer, J.: Bottom up design of novel titanium-based biomaterials through the combination of ab-initio simulations and experimental methods. Euromat 2007, Nürnberg, Germany (2007)

Kim, O.; Friák, M.; Neugebauer, J.: First-Principles Study of the Carbon-Carbon Interaction in Iron. Euromat 2007, Nürnberg, Germany (2007)

Petrov, M.; Friák, M.; Lymperakis, L.; Neugebauer, J.: An ab-initio study of hardness anisotropy of crystalline alpha-chitin. Euromat 2007, Nürnberg,Germany (2007)

von Pezold, J.; Neugebauer, J.: Hydrogen enhanced local plasticity: An atomistic study. Small Scale Plasticity Workshop, Braunwald, Switzerland (2007)

Friák, M.; Ma, D.; Sander, B.; Raabe, D.; Neugebauer, J.: Theory-guided design of Ti-binaries for human implants. "Theory Meets Industry" workshop, Vienna, Austria (2007)

Hickel, T.; Uijttewaal, M.; Grabowski, B.; Neugebauer, J.: A first principle determination of phase transitions in magnetic shape memory alloys. Multiscale approach to alloys: Advances and challenges, Stockholm, Sweden (2007)

Hickel, T.; Uijttewaal, M.; Grabowski, B.; Neugebauer, J.: Determination of symmetry reduced structures by a soft-phonon analysis in magnetic shape memory alloys. Theory meets industry. The impact of density-functional calculation on materials science, Vienna, Austria (2007)

Petrov, M.; Friák, M.; Lymperakis, L.; Neugebauer, J.; Raabe, D.: Hardness anisotropy of crystalline alpha-chitin: An ab-initio based conformational analysis. Spring meeting of the German Physical Society (DPG), Regensburg, Germany (2007)

Petrov, M.; Lymperakis, L.; Neugebauer, J.: Nonlinear Elastic Effects in Group III-Nitrides. Mid-term Review Meeting of PARSEM, Berlin, Germany (2007)

Uijttewaal, M.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Towards an ab initio determination of the phase transformations of Ni₂MnGa. Fokus-Treffen of the SPP 1239, Schloss Ringberg, Germany (2007)

Grabowski, B.; Hickel, T.; Neugebauer, J.: Accuracy and error bars of DFT calculated thermodynamic properties for elementary metals. 13th International Workshop on Computational Physics and Materials Science: Total Energy and Force Methods, Trieste, Italy (2007)