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nomad-coe / nomad-schema-plugin-simulation-data / 8645961087 / 1
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Ran 11 Apr 2024 11:32AM UTC
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11 Apr 2024 11:29AM UTC coverage: 93.069% (+22.5%) from 70.588%
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`PhysicalProperty` definition (#43)

* Initial try defining Variables and PhysicalProperty

Added extraction of full_shape of the PhyiscalProperty.value from variables and tensor rank

* Reorganized in 3 modules

* Added normalization for Variables.n_grid_points

* Moved sfc refs and boolean to PhysicalProperty

Added functionality to see if a property is_scf_converged

* Added testing for Variables

* Added testing for PhysicalProperty

* Fixed variables dimensions

* Added name to PhysicalProperty for custom properties

* Added testing for outputs.py

* Defined value as a placeholder_quantity default

* Improved descriptions

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Co-authored-by: jrudz <rudzinski@mpip-mainz.mpg.de>

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