pyFM.optimize.base_functions.oplist_commutation

pyFM.optimize.base_functions.oplist_commutation(C, op_list)

Compute the operator commutativity constraint for a list of pairs of operators.

Can be used with a list of descriptor multiplication operators.

Parameters:

• C ((K2, K1) np.ndarray) – Functional map.

• op_list (list of tuple) – Each element is a tuple ((K1, K1) np.ndarray, (K2, K2) np.ndarray) of operators on the first and second basis.

Returns:

energy – Sum of the operators commutativity squared norms.

Return type:

float