Hydrogen diffusion in magnesium using machine learning potentials: a comparative study
Abstract Understanding and accurately predicting hydrogen diffusion in materials is challenging due to the complex interactions between hydrogen defects and the crystal lattice. These interactions span large length and time scales, making them difficult to address with standard ab-initio techniques....
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| Main Authors: | Andrea Angeletti, Luca Leoni, Dario Massa, Luca Pasquini, Stefanos Papanikolaou, Cesare Franchini |
|---|---|
| Format: | Article |
| Language: | English |
| Published: |
Nature Portfolio
2025-03-01
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| Series: | npj Computational Materials |
| Online Access: | https://doi.org/10.1038/s41524-025-01555-z |
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