molsysmt.pbc.get_lengths_from_box#
- molsysmt.pbc.get_lengths_from_box(box, skip_digestion=False)[source]#
Extracting box edge lengths from a box matrix.
- Parameters:
box (quantity) – Box matrix (single or array), shape (3, 3) or (n, 3, 3).
skip_digestion (bool, default False) – Whether to skip argument digestion.
- Returns:
quantity – Edge lengths (a, b, c) in the same units as the input.
.. versionadded:: 1.0.0