Raabe, D.; Fabritius, H.; Nikolov, S.; Petrov, M.; Friak, M.; Elstnerová, P.; Neugebauer, J.: Ab initio based multiscale modeling of biological composites: Example of the exoskeleton of the lobster Homarus Americanus. Colloquium Lecture, Center for Nanoscience CeNS, Ludwigs-Maximilians Universität München, München, Germany (2010)
Elstnerová, P.; Friák, M.; Neugebauer, J.: Ab initio study of calcite substituted by Mg and P. Seminar talk at Masaryk University, Brno, Czech Republic (2009)
Elstnerová, P.; Friák, M.; Neugebauer, J.: Ab initio study of calcite substituted by Mg and P. Multiscale design modeling 2009, Brno, Czech Republic (2009)
Elstnerová, P.; Friák, M.; Neugebauer, J.: Crustacean skeletal elements: Variations in the constructional morphology at different hierarchical levels. Seminar talk at Masaryk University, Brno, Czech Republic (2009)
Elstnerová, P.; Friák, M.; Neugebauer, J.: Enhancing mechanical properties of calcite by Mg substitutions - A quantum-mechanical Study. 75. Annual Meeting of the DPG, Dresden, Germany (2011)
Elstnerová, P.; Friák, M.; Neugebauer, J.: Ab initio study of thermodynamic, structural, and elastic properties of Mg-substituted crystalline calcite. 4. Wiener Biomaterialsymposium, Vienna, Austria (2010)
International researcher team presents a novel microstructure design strategy for lean medium-manganese steels with optimized properties in the journal Science
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.
In this project, we aim to design novel NiCoCr-based medium entropy alloys (MEAs) and further enhance their mechanical properties by tuning the multiscale heterogeneous composite structures. This is being achieved by alloying of varying elements in the NiCoCr matrix and appropriate thermal-mechanical processing.