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siesta-project / aiida_siesta_plugin

Source code for the AiiDA-Siesta package (plugin and workflows). See wiki
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Plugin, workflow and docs #17

Closed garsua closed 5 years ago

garsua commented 5 years ago

Modified/included the following files:

aiida_siesta.calculations.vibra.py aiida_siesta.docs.plugins.vibra.rst aiida_siesta.docs.workflows.vibra.rst aiida_siesta.examples.plugins.vibra.test_vibra.py aiida_siesta.examples.workflows.test_vibra_wk.py aiida_siesta.parsers.vibra.py aiida_siesta.workflows.builsc.py aiida_siesta.workflows.vibrawf.py setup.json