Structure documentation

prisms-center / CASMcode_crystallography

CASM crystallography

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Open bpuchala opened 4 months ago

bpuchala commented 4 months ago

In Usage / Structure Manipulation here:

Example applying SymOp to Structure
Example comparing make_superstructure with doing it manually
Highlight:
- lattice_vectors rows vs columns
- apply isometry on right
- apply transformation_matrix_to_supercell on left