Publications of Jörg Neugebauer

Freysoldt, C.; Pfanner, G.; Neugebauer, J.: Defects in amorphous silicon from H insertion. Workshop "Spins as Functional Probes in Solar Energy Research", Berlin, Germany (2013)

Friák, M.; Titrian, H.; Aydin, U.; Raabe, D.; Neugebauer, J.: Self-consistent scale-bridging approach to compute the elasticity of multi-phase polycrystals. DPG Frühjahrstagung, Regensburg, Germany (2013)

Hemzalová, P.; Friák, M.; Šob, M.; Udyanksy, A.; Ma, D.; Neugebauer, J.: Ab initio study of thermodynamic, electronic, magnetic, structural, and elastic properties of Ni₄N allotropes. DPG Frühjahrstagung, Regensburg, Germany (2013)

Neugebauer, J.: Smart microstructures by non-ergodic martensitic transitions. Non-ergodic behavior in martensites, Universität Duisburg-Essen, Duisburg, Germany (2013)

Neugebauer, J.: Ab initio guided materials design: Application to doping and growth of group-III nitride. Colloquium, TH Ilmenau, Ilmenau, Germany (2013)

Neugebauer, J.: Modeling steels exhibiting unconventional deformation mechanisms based on ab initio based multiscale simulations. Kolloquium TH Ilmenau, Ilmenau, Germany (2013)

Neugebauer, J.: Modeling steels exhibiting unconventional deformation mechanisms based on ab initio based multiscale simulations. ESISM Workshop, Kyoto, Japan (2013)

Neugebauer, J.: Ab initio based free energy sampling. Workshop Talk, ESISM Workshop Kyoto, Japan (2013)

Pei, Z.; Friák, M.; Zhu, L.-F.; Sandlöbes, S.; Svendsen, B.; Raabe, D.; Neugebauer, J.: Ab initio stacking fault energy calculations in Mg–Y alloys. DPG Frühjahrstagung, Regensburg, Germany (2013)

Pei, Z.; Zhu, L.-F.; Friák, M.; Sandlöbes, S.; Svendsen, B.; Raabe, D.; Neugebauer, J.: Ab initio study of stacking fault energies in Mg alloys. European Congress and Exhibition on Advanced Materials and Processes, Sevilla, Spain (2013)

Zhang, X.; Hickel, T.; Rogal, J.; Drautz, R.; Neugebauer, J.: Adaptive behavior in the Fe–C system. ICAMS Advanced Discussion, Bochum, Germany (2013)

Zhu, L.-F.; Friák, M.; Fabritius, H.-O.; Hemzalová, P.; Nikolov, S. D.; Ziegler, A. S.; Janus, A. M.; Raabe, D.; Neugebauer, J.: Ab initio study of single-crystalline and polycrystalline elastic properties of Mg-substituted calcite crystals. DPG Frühjahrstagung, Regensburg, Germany (2013)

Neugebauer, J.: Ab initio based free energy sampling. Workshop, Lake Arrowhead, CA, USA (2012)

Neugebauer, J.: Materials Design based on predictive ab initio Thermodynamics. Colloquium Talk at Imperial College London, London, UK (2012)

Neugebauer, J.: Fully ab initio determination of free energies: Achievments and challenges. SGTE-Workshop, Herzogenrath, Germany (2012)

Hüter, C.; Twiste, F.; Spatschek, R.; Neugebauer, J.: Liquid Metal Embrittlement: Linking Small Scale Wetting Phenomena and Mesoscale Pattern Formation Processes. MRS 2012, Boston, MA, USA (2012)

Glensk, A.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Ab initio point defects up to melting: Deviations from Arrhenius-like behavior. MRS, Fall meeting, Boston, MA, USA (2012)

Spatschek, R.; Korbmacher, D.; von Pezold, J.; Hüter, C.; Brinckmann, S.; Neugebauer, J.: Scale Bridging Modeling of Hydrogen Embrittlement. 2012 MRS Fall Meeting & Exhibit, Boston, MA, USA (2012)

Neugebauer, J.: Fully ab initio determination of free energies: Basis for inverse approaches in materials design. MRS Fall Meeting, Boston, MA, USA (2012)

Sandlöbes, S.; Friák, M.; Dick, A.; Zaefferer, S.; Pei, Z.; Zhu, L.-F.; Sha, G.; Ringer, S.; Neugebauer, J.; Raabe, D.: Combining ab initio calculations and high resolution experiments to improve the understanding of advanced Mg-Y and Mg-RE alloys. 7th Annual Conference of the ARC Centre of Excellence for Design in Light Metals, Melbourne, VIC, Australia (2012)