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)
Hengge, K.: Investigation of alternative catalyst and support materials and their effect on degradation in high-temperature polymer-electrolyte-membrane fuel cells. Dissertation, RWTH Aachen University, Aachen, Germany (2017)
Morsdorf, L.: Fundamentals of ferrous low-carbon lath martensite: from the as-quenched, to tempered and deformed states. Dissertation, RWTH Aachen, Aachen, Germany (2017)
Diehl, M.: High Resolution Crystal Plasticity Simulations. Dissertation, Aachen Institute for Advanced Study in Computational Engineering Science (AICES), RWTH Aachen University, Aachen, Germany (2015)
Hill, B.: Scanning electron microscopy study of the microscale degradation mechanisms in polymer electrolyte fuel cells. Master, Heinrich-Heine-Universität Düsseldorf (2021)
Bueno Villoro, R.: Microstructure, thermal stability and defect phonon scattering in AgSbTe2 thermoelectrics. Master, Universitat Autònoma de Barcelona, Spain (2019)
Aymerich Armengol, R.: Structure-property relationship studies of Pt/TiO2 nanomaterials for electrochemical applications. Master, Universitat Autònoma de Barcelona, Spain (2019)
Gänsler, T.: Synthesis Approaches to Nb3O7(OH) Nanostructures and New Studies on Their Growth Mechanism. Master, Ludwig-Maximilians-Universität, München, Germany (2018)
Vega-Paredes, M.: Degradation mechanisms during operation of high temperature polymer electrolyte membrane fuel cells. Bachelor, Universitat Autònoma de Barcelona, Spain (2020)
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
Within this project, we will use an infra-red laser beam source based selective powder melting to fabricate copper alloy (CuCrZr) architectures. The focus will be on identifying the process parameter-microstructure-mechanical property relationships in 3-dimensional CuCrZr alloy lattice architectures, under both quasi-static and dynamic loading…
We simulate the ionization contrast in field ion microscopy arising from the electronic structure of the imaged surface. For this DFT calculations of the electrified surface are combined with the Tersoff-Hamann approximation to electron tunneling. The approach allows to explain the chemical contrast observed for NiRe alloys.
Decarbonisation of the steel production to a hydrogen-based metallurgy is one of the key steps towards a sustainable economy. While still at the beginning of this transformation process, with multiple possible processing routes on different technological readiness, we conduct research into the related fundamental scientific questions at the MPIE.
In this project we developed a phase-field model capable of describing multi-component and multi-sublattice ordered phases, by directly incorporating the compound energy CALPHAD formalism based on chemical potentials. We investigated the complex compositional pathway for the formation of the η-phase in Al-Zn-Mg-Cu alloys during commercial…
The project HyWay aims to promote the design of advanced materials that maintain outstanding mechanical properties while mitigating the impact of hydrogen by developing flexible, efficient tools for multiscale material modelling and characterization. These efficient material assessment suites integrate data-driven approaches, advanced…
It is very challenging to simulate within DFT extreme electric fields (a few 1010 V/m) at a surface, e.g. for studying field evaporation, the key mechanism in atom probe tomography (APT). We have developed a straight-forward scheme to incorporate an ideal plate counter-electrode in a nominally charged repeated-slab calculation by means of a generalized dipole correction of the standard electrostatic potential obtained from fully periodic FFT.