qp.analyze.molden.translate_to_origin¶

qp.analyze.molden.translate_to_origin(coordinates, center_of_mass)[source]¶

Translate coordinates so a reference point is at the origin.

Parameters:

coordinates (numpy.ndarray of shape (N, 3)) – Atomic coordinates to translate.
center_of_mass (array-like of shape (3,)) – Reference point to move to the origin.

Returns:

Translated coordinates.

Return type:

numpy.ndarray of shape (N, 3)