Changizi, R.: Structural Analysis and Correlative Cathodoluminescence Investigations of Pr (doped) Niobates. Dissertation, Georessourcen und Materialtechnik, RWTH Aachen (2022)
Gomell, L.: Advancing the understanding of the microstructure-property relationship in non-toxic and cost-effective thermoelectric Heusler compounds. Dissertation, Fakultät für Georessourcen und Materialtechnik der RWTH Aachen, Germany (2022)
Abdellaoui, L.: Correlation of microstructures and thermal conductivity of the thermoelectric material Ag16.7Sb30Te53.3. Dissertation, Ruhr-Universität Bochum (2019)
Sysoltseva, M.: Characterization of aerosols and nanoparticles released during various indoor and outdoor human activities. Dissertation, RWTH Aachen University (2018)
Folger, A.: The Influence of Post-Growth Heat Treatments and Etching on the Nanostructure and Properties of Rutile TiO2 Nanowires. Dissertation, RWTH Aachen, Aachen, Germany (2017)
Gleich, S.: Investigation of Sputtered Mo2BC Hard Coatings: Correlation of Nanostructure and Mechanical Properties. Dissertation, RWTH Aachen, Aachen, Germany (2017)
Max Planck scientists design a process that merges metal extraction, alloying and processing into one single, eco-friendly step. Their results are now published in the journal Nature.
Scientists of the Max-Planck-Institut für Eisenforschung pioneer new machine learning model for corrosion-resistant alloy design. Their results are now published in the journal Science Advances
The Atom Probe Tomography group in the Microstructure Physics and Alloy Design department is developing integrated protocols for ultra-high vacuum cryogenic specimen transfer between platforms without exposure to atmospheric contamination.
Here, we aim to develop machine-learning enhanced atom probe tomography approaches to reveal chemical short/long-range order (S/LRO) in a series of metallic materials.
While Density Functional Theory (DFT) is in principle exact, the exchange functional remains unknown, which limits the accuracy of DFT simulation. Still, in addition to the accuracy of the exchange functional, the quality of material properties calculated with DFT is also restricted by the choice of finite bases sets.
Complex simulation protocols combine distinctly different computer codes and have to run on heterogeneous computer architectures. To enable these complex simulation protocols, the CM department has developed pyiron.
In order to estimate the kinetics of thermally activated processes, one must determine the energy of the transition state. This transition state is a first-order saddle point on the potential energy surface, i.e., it is a maximum along the reaction coordinate, but a minimum with respect to all other directions in configurational space. We have…
The structures of grain boundaries (GBs) have been investigated in great detail. However, much less is known about their chemical features, owing to the experimental difficulties to probe these features at the near-atomic scale inside bulk material specimens. Atom probe tomography (APT) is a tool capable of accomplishing this task, with an ability…