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ICAMSDr. Matteo Rinaldi
Postdoctoral Researcher
Department: Atomistic Modelling and Simulation
Group: Data-Driven Methods for Atomistic Simulations
ICAMS
ICAMS
Ruhr-Universität Bochum
IC 02/705
Universitätsstr. 150
44801 Bochum
Tel.: 0234 32 29381
E-Mail: matteo.rinaldi@rub.de
Competences
Density functional theory
- M. Rinaldi
Modelling magnetism from the electronic structure to continuum for iron and its alloys. PhD Thesis, Ruhr-Univerisität Bochum, (2022) - M. Rinaldi, M. Mrovec, M. Fähnle, R. Drautz
Determination of spin-wave stiffness in the Fe-Si system using first-principles calculations. Physical Review B, 104, 064413, (2021) - Y. Lysogorskiy, C. van der Oord, A. Bochkarev, S. Menon, et al.
Performant implementation of the atomic cluster expansion (PACE) and application to copper and silicon. npj Computational Materials, 7, 97, (2021)
- 29.08.2022
Yury Lysogorskiy, Anton Bochkarev, Matteo Rinaldi, Minaam Qamar, et al.
Atomic cluster expansion for materials modeling invited
Materials Chain International Conference on Future Energy Materials and Systems 2022, Ruhr-Universität Bochum, Germany - 25.06.2018
Matteo Rinaldi, Matous Mrovec, Ralf Drautz
Atomistic methods for calculation of micromagnetic parameters
10 Years ICAMS - International Symposium, Ruhr-Universität Bochum, Germany
- PACE
Performant implementation of Atomic Cluster Expansion in LAMMPS
https://docs.lammps.org/pair_pace.html