Workflow interoperability for workflows in materials science, currently supported workflow engines:
The main components of the Python Workflow Definition are:
The Python Workflow Definition is demonstrated on three example workflows:
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- quantum-espresso-bulk-modulus-workflow Public
Workflow to calculate the equilibrium bulk modulus with the quantum ESPRESSO density functional theory simulation code
pythonworkflow/quantum-espresso-bulk-modulus-workflow’s past year of commit activity - python-workflow-definition Public
Python Workflow Definition - workflow interoperability for aiida, jobflow and pyiron
pythonworkflow/python-workflow-definition’s past year of commit activity - NFDI4Ing-workflow Public Forked from BAMresearch/NFDI4IngScientificWorkflowRequirements
This is a repository to discuss, collect and store the requirements for scientific workflow systems
pythonworkflow/NFDI4Ing-workflow’s past year of commit activity - example-workflow Public template
Template repository for publishing an interoperable workflow based on the Python Workflow Definition
pythonworkflow/example-workflow’s past year of commit activity - pythonworkflow.github.io Public
Redirect to https://pythonworkflow.github.io/python-workflow-definition
pythonworkflow/pythonworkflow.github.io’s past year of commit activity
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