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| # This CITATION.cff file was generated with cffinit. | ||
| # Visit https://bit.ly/cffinit to generate yours today! | ||
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| cff-version: 1.2.0 | ||
| message: "If you use this software, please cite it as below." | ||
| title: AiiDA-KKR | ||
| message: 'If you use this software, please cite it as below.' | ||
| type: software | ||
| authors: | ||
| - family-names: "Rüßmann" | ||
| given-names: "Philipp" | ||
| orcid: "0000-0002-6196-2700" | ||
| - family-names: "Bertoldo" | ||
| given-names: "Fabian" | ||
| - family-names: "Bröder" | ||
| given-names: "Jens" | ||
| orcid: "0000-0001-7939-226X" | ||
| - family-names: "Wasmer" | ||
| given-names: "Johannes" | ||
| orcid: "0000-0001-5113-3119" | ||
| - family-names: "Mozumder" | ||
| given-names: "Rubel" | ||
| - family-names: "Chico" | ||
| given-names: "Jonathan" | ||
| orcid: "0000-0001-5034-159X" | ||
| - family-names: "Blügel" | ||
| given-names: "Stefan" | ||
| orcid: "0000-0001-9987-4733" | ||
| title: "AiiDA-KKR" | ||
| version: 1.10 | ||
| doi: 10.5281/zenodo.3663525 | ||
| date-released: 2020-01-27 | ||
| url: "https://github.com/JuDFTteam/aiida-kkr" | ||
| - family-names: Rüßmann | ||
| given-names: Philipp | ||
| orcid: 'https://orcid.org/0000-0002-6196-2700' | ||
| - family-names: Bertoldo | ||
| given-names: Fabian | ||
| - family-names: Bröder | ||
| given-names: Jens | ||
| orcid: 'https://orcid.org/0000-0001-7939-226X' | ||
| - family-names: Wasmer | ||
| given-names: Johannes | ||
| orcid: 'https://orcid.org/0000-0001-5113-3119' | ||
| - family-names: Mozumder | ||
| given-names: Rubel | ||
| - family-names: Chico | ||
| given-names: Jonathan | ||
| orcid: 'https://orcid.org/0000-0001-5034-159X' | ||
| - family-names: Blügel | ||
| given-names: Stefan | ||
| orcid: 'https://orcid.org/0000-0001-9987-4733' | ||
| url: 'https://github.com/JuDFTteam/aiida-kkr' | ||
| license: MIT | ||
| version: 2.3.1 | ||
| date-released: '2020-01-27' | ||
| doi: 10.5281/zenodo.3628250 | ||
| preferred-citation: | ||
| type: article | ||
| authors: | ||
| - family-names: "Rüßmann" | ||
| given-names: "Philipp" | ||
| orcid: "0000-0002-6196-2700" | ||
| - family-names: "Bertoldo" | ||
| given-names: "Fabian" | ||
| - family-names: "Blügel" | ||
| given-names: "Stefan" | ||
| orcid: "0000-0001-9987-4733" | ||
| doi: "10.1038/s41524-020-00482-5" | ||
| journal: "npj Computational Materials" | ||
| - family-names: Rüßmann | ||
| given-names: Philipp | ||
| orcid: 'https://orcid.org/0000-0002-6196-2700' | ||
| - family-names: Bertoldo | ||
| given-names: Fabian | ||
| - family-names: Blügel | ||
| given-names: Stefan | ||
| orcid: 'https://orcid.org/0000-0001-9987-4733' | ||
| doi: 10.1038/s41524-020-00482-5 | ||
| journal: npj Computational Materials | ||
| month: 1 | ||
| title: "The AiiDA-KKR plugin and its application to high-throughput impurity embedding into a topological insulator" | ||
| title: >- | ||
| The AiiDA-KKR plugin and its application to high-throughput impurity | ||
| embedding into a topological insulator | ||
| volume: 7 | ||
| year: 2021 |