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point group of a cluster#43

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seshasaibehara wants to merge 12 commits intoprisms-center:2.Xprisms-center/CASMcode_crystallography:2.Xfrom seshasaibehara:ClusterPointGroupseshasaibehara/CASMcode_crystallography:ClusterPointGroupCopy head branch name to clipboard

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Commits on Jul 29, 2024

• point group of a cluster

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• cluster point group: return list of xtal.Symops

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Commits on Jul 30, 2024

• default properties arg for xtal.AtomComponent

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• doc update

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• doc update

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• xtal.Occupant.from_xyz_string() with tests; also fix test_prim.py shared_datadir fixture

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• add test_occupants.py

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• add molecule input files

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• add tests for cluster_point_group

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• added pybind doc for xtal.Occupant.from_xyz_string()

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Commits on Aug 9, 2024

• revert unnecessary changes

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• resolved conflicts?

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