Hyperbond

class emmet.core.molecules.orbitals.Hyperbond(index, atom1_index, atom2_index, atom3_index, fraction_12, fraction_23, occupancy, bond_index_12, lp_index_3, hybrid_index_1, hybrid_index_2, hybrid_index_3)

Bases: MSONable

Parameters:

• index (int)

• atom1_index (int)

• atom2_index (int)

• atom3_index (int)

• fraction_12 (float)

• fraction_23 (float)

• occupancy (float)

• bond_index_12 (int)

• lp_index_3 (int)

• hybrid_index_1 (int)

• hybrid_index_2 (int)

• hybrid_index_3 (int)