Invited talk, Multi-Scale Condensed Phase Simulations: Methods and Applications, Telluride, CO, USA
Invited talk at the Telluride Science workshop Multi-Scale Condensed Phase Simulations: Methods and Applications (13–17 July 2026), on active-learning strategies that select only the configurations worth computing when training machine-learning interatomic potentials.
Invited talk, VISPEC Conference 2026, Pavia, Italy
Invited talk at the VISPEC Conference on vibrational spectroscopies from first principles.
Contributed talk, APS March Meeting 2025, Anaheim, CA, USA
Contributed talk presenting aiida-hubbard, an automated and reproducible framework for the self-consistent calculation of onsite and intersite Hubbard parameters from first principles.
Invited talk, African MRS Conference 2024, Kigali, Rwanda
Invited talk on the turnkey, all-functional prediction of phonons, infrared, and Raman spectra from first principles.
Contributed talk, ICORS Conference 2024, Rome, Italy
Contributed talk at the International Conference on Raman Spectroscopy, presenting the automated all-functional workflows implemented in aiida-vibroscopy.
Contributed talk, APS March Meeting 2024, Minneapolis, MN, USA
Contributed talk on the finite-field, finite-displacement approach that enables infrared and Raman spectra with any exchange-correlation functional, and on its applications to materials design.
Talk, MARVEL Retreat, Grindelwald, Switzerland
Talk at the annual retreat of the NCCR MARVEL, on automated all-functional infrared and Raman spectra.
Invited seminar, Sorbonne University, Paris, France
Seminar given to Prof. Antonio Marco Saitta’s group at Sorbonne University, on the automation of infrared and Raman spectra calculations for complex materials.
Contributed talk, DPG Spring Meeting, Regensburg, Germany
Contributed talk at the Spring Meeting of the German Physical Society.
Talk, NCCR Catalysis Meeting, Lausanne, Switzerland (virtual)
Talk at the NCCR Catalysis meeting, on the fully automated path from a crystal structure to its Raman spectrum.
Contributed talk, Conference on Computational Physics (CCP2022), Austin, TX, USA (virtual)
Contributed talk on the automated Raman workflow and its application to the characterization of Martian regolith.
Contributed talk, Hike & Science Workshop, Gosau, Austria
Contributed talk at the Hike & Science workshop.
Poster, "Humans on Mars" Meeting, Bremen, Germany
Poster on the construction of corrosion and stability phase diagrams for metal electrowinning in molten-salt electrolytes, a key step towards the in-situ extraction of metals from Martian regolith.
Poster, Psi-k Conference 2025, Lausanne, Switzerland
Poster on active-learning strategies that make first-principles thermodynamics and phase transitions affordable through on-the-fly machine-learning interatomic potentials.
Poster, MARVEL Retreat, Lausanne, Switzerland
Poster presented at the annual retreat of the NCCR MARVEL.
Poster, Psi-k Conference 2022, Lausanne, Switzerland
Poster presented at the Psi-k conference, the largest gathering of the electronic-structure community.
Poster, "Humans on Mars" Meeting, Bremen, Germany
Poster on the first-principles characterization of the mineral phases composing Martian regolith.