Publikationen von J. Neugebauer

Nazarov, R.; Hickel, T.; Neugebauer, J.: Wasserstoff in X-IP Stahl (ab initio): Einfluss von Defekten auf die Energetik und Dynamik von Wasserstoff in Manganstählen. X-IP Workshop, Duisburg, Germany (2009)

Neugebauer, J.: Density functional theory in a nutshell. MD Seminar Series, Los Angeles, CA, USA (2009)

Neugebauer, J.: Material- und Werkstoffdesign am Computer: Möglichkeiten, Grenzen und Perspektiven. Kolloquium at Akademie der Wissenschaften, Düsseldorf, Germany (2009)

Udyansky, A.; von Pezold, J.; Friák, M.; Neugebauer, J.: Influence of long-range C-C elastic interactions on the structural stability of dilute Fe-C solid solutions. Invited Talk at ICAMS, Bochum, Germany (2009)

Friak, M.; Counts, W. A.; Raabe, D.; Neugebauer, J.: Using Ab Initio Calculations in Designing BCC Mg–Li Alloys for Ultra Light-Weight Applications. THERMEC'2009: International Conference on PROCESSING & MANUFACTURING OF ADVANCED MATERIALS, Berlin, Germany (2009)

Hickel, T.; Körmann, F.; Dick, A.; Neugebauer, J.: First principles simulation of thermodynamic properties of iron and iron-based alloys. Thermec'2009. International conference on processing & manufacturing of advanced materials, Berlin, Germany (2009)

Freysoldt, C.; Pfanner, G.; Neugebauer, J.: What can EPR hyperfine parameters tell about the Si dangling bond? - A theoretical study. International conference on amorphous and nanoporous semiconductors (ICANS) 23, Utrecht, Netherlands (2009)

Friak, M.; Counts, W. A.; Raabe, D.; Neugebauer, J.: Theory guided design of bcc Mg-Li alloys for ultra-light weight applications. ICSMA 15: International Conference on the Strength of Materials, Dresden, Germany (2009)

Ma, D.; Friák, M.; Raabe, D.; Neugebauer, J.: Multi-physical alloy approaches to solid solution strengthening of Al. 15th International Conference of Strength of Materials, Dresden, Germany (2009)

Nikolov, S.; Petrov, M.; Friak, M.; Sachs, C.; Fabritius, H.; Ma, D.; Lymperakis, L.; Raabe, D.; Neugebauer, J.: Hierarchical modeling of the mechanical properties of lobster cuticle from the nanoscale up to the macroscale. ICSMA 15: International Conference on the Strength of Materials, Dresden, Germany (2009)

Hickel, T.; Grabowski, B.; Körmann, F.; Dick, A.; Neugebauer, J.: The accuracy of first principles methods inpredicting thermodynamic properties of metals. XVIII International Material Research Conference, Cancun, Mexico (2009)

Raabe, D.; Roters, F.; Eisenlohr, P.; Zaefferer, S.; Tjahjanto, D. D.; Demir, E.; Ma, D.; Bieler, T. R.; Hantcherli, L.; Friak, M. et al.; Neugebauer, J.: Overview of the crystal plasticity finite element method. THERMEC 2009, Berlin, Germany (2009)

Counts, W. A.; Friák, M.; Raabe, D.; Neugebauer, J.: Fundamental materials-design limits in ultra light-weight Mg-Li alloys determined from ab initio calculations. Seminar in the Department of Low Dimensional Structures and Metastable Phases at the Max Planck Institute for Metals Research, Stuttgart, Germany (2009)

Counts, W. A.; Friák, M.; Raabe, D.; Neugebauer, J.: Ab initio determined materials-design limits in ultra light-weight Mg-Li alloys. Seminar in the Department of Strukture at the Institute of Physics of Materials of the Academy of Sciences of the Czech Republic and Institute of Chemistry of the Faculty of Sciences of Masaryk University, Brno, Czech Republic (2009)

Friák, M.; Sander, B.; Ma, D.; Counts, W. A.; Raabe, D.; Neugebauer, J.: Ab-initio based multi-scale approaches to the elasticity of polycrystals. Seminar at the Department of Physical Metallurgy and Materials Testing at Montan Universität Leoben, Leoben, Austria (2009)

Friák, M.; Sob, M.; Kim, O.; Ismer, L.; Neugebauer, J.: Ab initio calculation of phase boundaries in iron along the bcc-fcc transformation path and magnetism of iron overlayers. Seminar at the Department of Materials Physics at Montan Universität Leoben, Leoben, Austria (2009)

Neugebauer, J.: Materials Design based on Ab Initio Thermodynamics: Status, Perspectives, and Trends. Colloquium Talk at Institut für Materialprüfung, Werkstoffkunde und Festigkeitslehre, Universität Stuttgart, Stuttgart, Germany (2009)

Lymperakis, L.; von Pezold, J.; Neugebauer, J.: Atomistic calculations of interfaces: Bridging the relevant scales. Institute’s Colloquium, Institut für Gesteinshüttenkunde, Aachen, Germany (2009)

Neugebauer, J.; Grabowski, B.; Körmann, F.; Dick, A.; Hickel, T.: Ab Initio Thermodynamics: Status, applications and challenges. The second Sino-German Symposium on “Computational Thermodynamics and Kinetics and Their Applications to Solidification”, Kornelimünster/Aachen, Germany (2009)

Freysoldt, C.; Neugebauer, J.; Van de Walle, C. G.: Fully ab initio supercell corrections for charged defects. CECAM workshop "Which Electronic Structure Method for the Study of Defects?", Lausanne, Switzerland (2009)