Papers
Neighbors Map: an Efficient Atomic Descriptor for Structural Analysis
Arnaud Allera, Alexandra M. Goryaeva, Paul Lafourcade, Jean-Bernard Maillet, Mihai-Cosmin Marinica. Computational Materials Science 231, 5 Jan. 2024, 112535 -
arXiv:2307.00978 — GithubRobust crystal structure identification at extreme conditions using a density-independent spectral descriptor and supervised learning
Paul Lafourcade, Jean-Bernard Maillet, Christophe Denoual, Eléonore Duval, Arnaud Allera, Alexandra M. Goryaeva, Mihai-Cosmin Marinica. Computational Materials Science 230, 25 Oct. 2023, 112534 -
arXiv:2307.01560 — Github
- Carbon-induced strengthening of bcc iron at the atomic scale
Arnaud Allera, Fabienne Ribeiro, Michel Perez, and David Rodney. Phys. Rev. Materials 6, 013608 – 2022 – EAM interatomic potential for Fe-C
PhD Thesis
Atomistic modelling of dislocation glide and pinning in iron and carbon steel