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Update citation info and add zenodo doi
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PhilippRue committed Jun 23, 2023
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2 changes: 1 addition & 1 deletion CITATION.cff
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given-names: "Stefan"
orcid: "https://orcid.org/0000-0001-9987-4733"
doi: "10.3389/fmats.2022.825043"
journal: "npj Computational Materials"
journal: "Front. Mater."
month: 2
title: "The AiiDA-Spirit Plugin for Automated Spin-Dynamics Simulations and Multi-Scale Modeling Based on First-Principles Calculations"
volume: 9
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9 changes: 9 additions & 0 deletions README.md
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[![Coverage Status](https://codecov.io/gh/JuDFTteam/aiida-spirit/branch/main/graph/badge.svg?token=F7ISM4558S)](https://codecov.io/gh/JuDFTteam/aiida-spirit)
[![Docs status](https://readthedocs.org/projects/aiida-spirit/badge)](http://aiida-spirit.readthedocs.io/)
[![PyPI version](https://badge.fury.io/py/aiida-spirit.svg)](https://badge.fury.io/py/aiida-spirit)
[![DOI](https://zenodo.org/badge/364820045.svg)](https://zenodo.org/badge/latestdoi/364820045)

# aiida-spirit

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export PATH
```

## Citation

If you use AiiDA-Spirit please cite the method paper
- P. Rüßmann, J. Ribas Sobreviela, M. Sallermann, M. Hoffmann, F. Rhiem, and S. Blügel, *The AiiDA-Spirit Plugin for Automated Spin-Dynamics Simulations and Multi-Scale Modeling Based on First-Principles Calculations*, Front. Mater. **9**, 825043 (2022). [doi: 10.3389/fmats.2022.825043](https://doi.org/10.3389/fmats.2022.825043),

and the latest code release
- P. Rüßmann, J. Ribas Sobreviela, M. Sallermann, M. Hoffmann, F. Rhiem, and S. Blügel. JuDFTteam/aiida-spirit. Zenodo. [doi: 10.5281/zenodo.8070770](https://doi.org/10.5281/zenodo.8070770).

## License

The AiiDA-Spirit code is under the [MIT license](LICENSE).
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