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Merged
jan-janssen merged 3 commits into from
May 29, 2025
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Create CITATION.cff #120

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2f65954
Create CITATION.cff
jan-janssen May 29, 2025
c263dd9
Update README.md
jan-janssen May 29, 2025
f871eb7
Update README.md
jan-janssen May 29, 2025
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40 changes: 40 additions & 0 deletions CITATION.cff
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cff-version: "1.2.0"
authors:
- family-names: Janssen
given-names: Jan
orcid: "https://orcid.org/0000-0001-9948-7119"
- family-names: George
given-names: Janine
orcid: "https://orcid.org/0000-0001-8907-0336"
- family-names: Geiger
given-names: Julian
orcid: "https://orcid.org/0000-0003-0023-1960"
- family-names: Bercx
given-names: Marnik
orcid: "https://orcid.org/0000-0001-8470-1012"
- family-names: Wang
given-names: Xing
- family-names: Ertural
given-names: Christina
orcid: "https://orcid.org/0000-0002-7696-5824"
- family-names: Schaarschmidt
given-names: Joerg
orcid: "https://orcid.org/0000-0002-4389-2366"
- family-names: Ganose
given-names: Alex
orcid: "https://orcid.org/0000-0002-4486-3321"
- family-names: Pizzi
given-names: Giovanni
orcid: "https://orcid.org/0000-0002-3583-4377"
- family-names: Hickel
given-names: Tilmann
orcid: "https://orcid.org/0000-0003-0698-4891"
- family-names: Neugebauer
given-names: Joerg
orcid: "https://orcid.org/0000-0002-7903-2472"
title: "A Python workflow definition for computational materials design"
version: 0.1.1
doi: 10.5281/zenodo.15516180
date-released: 2025-05-26
license: bsd-3-clause
url: "https://github.com/pythonworkflow/python-workflow-definition"
2 changes: 2 additions & 0 deletions README.md
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# Python Workflow Definition
[![Pipeline](https://github.com/pythonworkflow/python-workflow-definition/actions/workflows/pipeline.yml/badge.svg)](https://github.com/pythonworkflow/python-workflow-definition/actions/workflows/pipeline.yml)
[![Binder](https://mybinder.org/badge_logo.svg)](https://mybinder.org/v2/gh/pythonworkflow/python-workflow-definition/HEAD)
[![arXiv](https://img.shields.io/badge/arXiv-2505.20366-b31b1b.svg)](https://arxiv.org/abs/2505.20366)
[![DOI](https://zenodo.org/badge/945869529.svg)](https://doi.org/10.5281/zenodo.15516179)

## Definition
In the Python Workflow Definition (PWD) each node represents a Python function, with the edges defining the connection
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