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Database builder for surface properties. Will combine raw data from oriented unit cell calculations and slab calculations of different facets to generate a Wulff shape and obtained related properties such as the weighted_surface_energy, weighted_work_function, shape_factor, etc.
The text was updated successfully, but these errors were encountered:
Hi @richardtran415, this doesn't seem to be a proper issue as much as a heads up that you may open up a WIP PR soon for such a builder. so I'm closing.
Database builder for surface properties. Will combine raw data from oriented unit cell calculations and slab calculations of different facets to generate a Wulff shape and obtained related properties such as the weighted_surface_energy, weighted_work_function, shape_factor, etc.
The text was updated successfully, but these errors were encountered: