Hickel, T.; Neugebauer, J.: First principles determination of phase transitions in magnetic shape memory alloys. Esomat 2009. The 8th European Symposium on Martensitic Transformations, Prague, Czech Republic (2009)
Hickel, T.; Uijttewaal, M.; Neugebauer, J.: First principles determination of phase transitions in magnetic shape memory alloys. Euromat 2009, Glasgow, UK (2009)
Ma, D.; Friák, M.; Raabe, D.; Neugebauer, J.: Investigation of solid solution strengthening by density functional theory. EUROMAT 2009, Glasgow, Scotland, UK (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. EUROMAT 2009, Glasgow, UK (2009)
Holec, D.; Friak, M.; Dlouhy, A.; Neugebauer, J.: Ab initio search for the NiTi ground state with shape-memory ability. ESOMAT 2009, Prague, Czech Republic (2009)
Ma, D.; Friák, M.; Raabe, D.; Neugebauer, J.: Investigation of solid solution strengthening by density functional theory. 11-th National Congress on Theoretical and Applied Mechanics, Borovets, Bulgaria (2009)
Friák, M.; Deges, J.; Krein, R.; Stein, F.; Palm, M.; Frommeyer, G.; Neugebauer, J.: Combining Experimental and Computational Methods in the Development of Fe3Al-based Materials. 5th Discussion Meeting on the Development of Innovative Iron Aluminium Alloys (FEAL 2009), Prague, Czech Republic (2009)
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.: 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)
International researcher team presents a novel microstructure design strategy for lean medium-manganese steels with optimized properties in the journal Science
The precipitation of intermetallic phases from a supersaturated Co(Nb) solid solution is studied in a cooperation with the Hokkaido University of Science, Sapporo.
In this project, we employ atomistic computer simulations to study grain boundaries. Primarily, molecular dynamics simulations are used to explore their energetics and mobility in Cu- and Al-based systems in close collaboration with experimental works in the GB-CORRELATE project.
This project is a joint project of the De Magnete group and the Atom Probe Tomography group, and was initiated by MPIE’s participation in the CRC TR 270 HOMMAGE. We also benefit from additional collaborations with the “Machine-learning based data extraction from APT” project and the Defect Chemistry and Spectroscopy group.