5.21.3. tools.check_ortho

eminus.tools.check_ortho(obj, func, eps=1e-9)[source]

Check the orthogonality condition for a set of functions.

Parameters:

  • obj – Atoms or SCF object.

  • func – A discretized set of functions.

Keyword Arguments:

eps – Tolerance for the condition.

Returns:

Orthogonality status for the set of functions.