Neugebauer, J.; Janßen, J.; Körmann, F.; Hickel, T.; Grabowski, B.: Exploration of large ab initio data spaces to design materials with superior mechanical properties. Physics and Theoretical Division Colloquium, Los Alamos, NM, USA (2019)
Ikeda, Y.; Körmann, F.; Neugebauer, J.: Impact of chemical compositions and interstitial alloying on the stacking fault energy of CrMnFeCoNi-based HEAs from first principles. The 2nd International Conference on High-Entropy Materials , Jeju, South Korea (2018)
Dutta, B.; Körmann, F.; Hickel, T.; Neugebauer, J.: Temperature-driven effects in functional materials: Ab initio insights. Talk at University Pierre and Marie CURIE (UPMC), Paris, France (2017)
Zendegani, A.; Körmann, F.; Hickel, T.; Hallstedt, B.; Neugebauer, J.: Thermodynamic properties of the quaternary Q phase in Al–Cu–Mg–Si: a combined ab-initio, phonon and compound energy formalism approach. International Conference on Advanced Materials Modelling (ICAMM), Rennes, France (2016)
Körmann, F.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Lattice excitations in magnetic alloys: Recent advances in ab initio modeling of coupled spin and atomic fluctuations. TMS Annual Meeting 2016, Nashville, TN, USA (2016)
Körmann, F.: Temperature dependent coupling of atomic and magnetic degrees of freedom from first-principles. Workshop on Electronic Structure Theory of Accelerated Design of Structural Materials, Moscow, Russia (2015)
Körmann, F.; Grabowski, B.; Hickel, T.; Neugebauer, J.: Temperature-dependent coupling of atomic and magnetic degree of freedom from first-principles. Electronic Structure Theory for the Accelerated Design of Structural Materials, Moscow, Russia (2015)
International researcher team presents a novel microstructure design strategy for lean medium-manganese steels with optimized properties in the journal Science
In this ongoing project, we investigate spinodal fluctuations at crystal defects such as grain boundaries and dislocations in Fe-Mn alloys using atom probe tomography, electron microscopy and thermodynamic modeling [1,2].
The aim of the Additive micromanufacturing (AMMicro) project is to fabricate advanced multimaterial/multiphase MEMS devices with superior impact-resistance and self-damage sensing mechanisms.
The Ni- and Co-based γ/γ’ superalloys are famous for their excellent high-temperature mechanical properties that result from their fine-scaled coherent microstructure of L12-ordered precipitates (γ’ phase) in an fcc solid solution matrix (γ phase). The only binary Co-based system showing this special type of microstructure is the Co-Ti system…
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.