Dataset

Replication Data for: Strong impact of spin fluctuations on the antiphase boundaries of weak itinerant ferromagnetic Ni3Al

Data for the publication " Strong impact of spin fluctuations on the antiphase boundaries of weak itinerant ferromagnetic Ni3Al", Acta Materialia, 255, doi: 10.1016/j.actamat.2023.118986.

This data set contains

the training sets (VASP files), the utilized moment-tensor-potentials (MTP) and the final thermodynamic database (properties) for the three structures with PBE potential: 100APB, 111APB, bulk Ni3Al.

The used parameter settings are provided in the Supplementary Information of the publication, and a short method in its main text, for the reproduction of the results.

Chemical Info

Data and Resources

Metadata Information

Field Value
DOI https://doi.org/10.18419/DARUS-3579
License URL
Source https://doi.org/10.18419/DARUS-3579
Version
Author Xu, Xiang
Maintainer DaRUS
Language
MetadataPublished
Related Molecule
Field Value
No additional information available for this Dataset.
Data-Source Molecule ID Data-Source
The data in this table is sourced from UniChem at EBI.