Krämer, M.; Favelukis, B.; Sokol, M.; Rosen, B. A.; Eliaz, N.; Kim, S.-H.; Gault, B.: Facilitating Atom Probe Tomography of Free-Standing 2D MXene Films. Atom Probe Tomography & Microscopy (APT&M) 2023, Leuven, Belgium (2023)
Lee, C.-G.; Nallathambi, V.; Kang, T.; Aota, L. S.; Reichenberger, S.; El-Zoka, A.; Choi, P.-P.; Gault, B.; Kim, S.-H.: Magnetocaloric effect of Fe47.5Ni37.5Mn15 bulk and nanoparticles: A cost-efficient alloy for room temperature magnetic refrigeration. arXiv (2024)
Kim, S.-H.; Yoo, Su, S.-H.; Aota, L. S.; El-Zoka, A.; Kang, P. W.; Lee, Y.; Gault, B.: B dopant evolution in Pd catalysts after H evolution/oxidation reaction in alkaline environment. arXiv (2023)
Oxides find broad applications as catalysts or in electronic components, however are generally brittle materials where dislocations are difficult to activate in the covalent rigid lattice. Here, the link between plasticity and fracture is critical for wide-scale application of functional oxide materials.
In this project we conduct together with Dr. Sandlöbes at RWTH Aachen and the department of Prof. Neugebauer ab initio calculations for designing new Mg – Li alloys. Ab initio calculations can accurately predict basic structural, mechanical, and functional properties using only the atomic composition as a basis.