Do we really need machine learning interatomic potentials for modeling amorphous metal oxides? Case study on amorphous alumina by recycling an existing ab initio database

Simon Gramatte, Vladyslav Turlo, Olivier Politano

Open source

DOI
10.1088/1361-651x/ad39ff
Published
2024-04-16
Container
Modelling and Simulation in Materials Science and Engineering
Publisher
IOP Publishing
Open access
unknown

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BibTeX

@article{allodium:10.1088/1361-651x/ad39ff,
  title = {Do we really need machine learning interatomic potentials for modeling amorphous metal oxides? Case study on amorphous alumina by recycling an existing ab initio database},
  author = {Simon Gramatte and Vladyslav Turlo and Olivier Politano},
  year = {2024},
  journal = {Modelling and Simulation in Materials Science and Engineering},
  doi = {10.1088/1361-651x/ad39ff},
  url = {https://doi.org/10.1088/1361-651x/ad39ff}
}

RIS

TY  - JOUR
TI  - Do we really need machine learning interatomic potentials for modeling amorphous metal oxides? Case study on amorphous alumina by recycling an existing ab initio database
AU  - Simon Gramatte
AU  - Vladyslav Turlo
AU  - Olivier Politano
PY  - 2024
JO  - Modelling and Simulation in Materials Science and Engineering
DO  - 10.1088/1361-651x/ad39ff
UR  - https://doi.org/10.1088/1361-651x/ad39ff
ER  - 

APA

Gramatte, S., Turlo, V., & Politano, O. (2024). Do we really need machine learning interatomic potentials for modeling amorphous metal oxides? Case study on amorphous alumina by recycling an existing ab initio database. Modelling and Simulation in Materials Science and Engineering. https://doi.org/10.1088/1361-651x/ad39ff

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