PEREGO, SIMONE
PEREGO, SIMONE
DIPARTIMENTO DI SCIENZA DEI MATERIALI
Adsorption and decomposition of ammonia on Fe surfaces
2024 Perego, S; Bonati, L; Parrinello, M
Adsorption and decomposition of ammonia on Fe surfaces: a molecular dynamics study
2024 Perego, S; Bonati, L; Parrinello, M
Adsorption and decomposition of ammonia on Fe surfaces: a molecular dynamics study
2024 Perego, S; Bonati, L; Parrinello, M
Data efficient machine learning potentials for modeling catalytic reactivity via active learning and enhanced sampling
2024 Perego, S; Bonati, L
How Dynamics Changes Ammonia Cracking on Iron Surfaces
2024 Perego, S; Bonati, L; Tripathi, S; Parrinello, M
How Poisoning Is Avoided in a Step of Relevance to the Haber–Bosch Catalysis
2024 Tripathi, S; Bonati, L; Perego, S; Parrinello, M
Iron Nitride Formation and Decomposition during Ammonia Decomposition over a Wustite-Based Bulk Iron Catalyst
2024 Purcel, M; Berendts, S; Bonati, L; Perego, S; Müller, A; Lerch, M; Parrinello, M; Muhler, M
Structure and Crystallization Kinetics of As-Deposited Films of the GeTe Phase Change Compound from Atomistic Simulations
2023 Perego, S; Dragoni, D; Gabardi, S; Campi, D; Bernasconi, M
Key role of polar nanoregions in the cubic-to-tetragonal phase transition of potassium-based perovskites
2022 Parravicini, J; Delre, E; Perego, S; Acciarri, M; Binetti, S; Garcia, Y; Parapelitsa, G; Agranat, A; Parravicini, G