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@@ -60,11 +60,16 @@ The corresponding Jupyter notebooks demonstrate this functionality:
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| Example | Explanation |
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|--------------------------------------------------------------------------------|------------------------------------------------------------------------------|
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| [universal_simple_to_aiida.ipynb](universal_simple_to_aiida.ipynb) | Execute workflow defined in the Python Workflow Definition with aiida. |
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| [universal_simple_to_jobflow.ipynb](universal_simple_to_jobflow.ipynb) | Execute workflow defined in the Python Workflow Definition with jobflow. |
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| [universal_simple_to_pyiron_base.ipynb](universal_simple_to_pyiron_base.ipynb) | Execute workflow defined in the Python Workflow Definition with pyrion_base. |
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| [universal_simple_to_python.ipynb](universal_simple_to_python.ipynb) | Execute workflow defined in the Python Workflow Definition with Python. |
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| [universal_simple_to_executorlib.ipynb](universal_simple_to_executorlib.ipynb) | Execute workflow defined in the Python Workflow Definition with executorlib. |
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| [aiida_to_jobflow_simple.ipynb](aiida_to_jobflow_simple.ipynb) | Define Workflow with aiida and execute it with jobflow. |
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| [aiida_to_pyiron_base_simple.ipynb](aiida_to_pyiron_base_simple.ipynb) | Define Workflow with aiida and execute it with pyiron_base. |
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| [jobflow_to_aiida_simple.ipynb](jobflow_to_aiida_simple.ipynb) | Define Workflow with jobflow and execute it with aiida. |
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| [jobflow_to_pyiron_base_simple.ipynb](jobflow_to_pyiron_base_simple.ipynb) | Define Workflow with jobflow and execute it with pyiron_base. |
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| [pyiron_base_to_aiida_simple.ipynb](pyiron_base_to_aiida_simple.ipynb) | Define Workflow with pyiron_base and execute it with aiida. |
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| [pyiron_base_to_jobflow_simple.ipynb](pyiron_base_to_jobflow_simple.ipynb) | Define Workflow with pyiron_base and execute it with jobflow. |
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### Quantum Espresso Workflow
@@ -76,9 +81,14 @@ initial structure is relaxed, afterwards it is strained and the total energy is
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| Example | Explanation |
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|------------------------------------------------------------------------|------------------------------------------------------------------------------|
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| [universal_qe_to_aiida.ipynb](universal_qe_to_aiida.ipynb) | Execute workflow defined in the Python Workflow Definition with aiida. |
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| [universal_qe_to_jobflow.ipynb](universal_qe_to_jobflow.ipynb) | Execute workflow defined in the Python Workflow Definition with jobflow. |
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| [universal_qe_to_pyiron_base.ipynb](universal_qe_to_pyiron_base.ipynb) | Execute workflow defined in the Python Workflow Definition with pyrion_base. |
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| [universal_qe_to_python.ipynb](universal_qe_to_python.ipynb) | Execute workflow defined in the Python Workflow Definition with Python. |
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| [universal_qe_to_executorlib.ipynb](universal_qe_to_executorlib.ipynb) | Execute workflow defined in the Python Workflow Definition with executorlib. |
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| [aiida_to_jobflow_qe.ipynb](aiida_to_jobflow_qe.ipynb) | Define Workflow with aiida and execute it with jobflow. |
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| [aiida_to_pyiron_base_qe.ipynb](aiida_to_pyiron_base_qe.ipynb) | Define Workflow with aiida and execute it with pyiron_base. |
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| [jobflow_to_aiida_qe.ipynb](jobflow_to_aiida_qe.ipynb) | Define Workflow with jobflow and execute it with aiida. |
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| [jobflow_to_pyiron_base_qe.ipynb](jobflow_to_pyiron_base_qe.ipynb) | Define Workflow with jobflow and execute it with pyiron_base. |
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| [pyiron_base_to_aiida_qe.ipynb](pyiron_base_to_aiida_qe.ipynb) | Define Workflow with pyiron_base and execute it with aiida. |
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| [pyiron_base_to_jobflow_qe.ipynb](pyiron_base_to_jobflow_qe.ipynb) | Define Workflow with pyiron_base and execute it with jobflow. |

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