vibeqc.aiccm2026dev_b_mayer_bond_orders

vibeqc.aiccm2026dev_b_mayer_bond_orders(result, system, basis, *, threshold=0.05, max_bonds=40)

Return primitive-cell Mayer bond orders from a χ-CCM SCF result.

Parameters:

• result (object)

• system (vibeqc._vibeqc_core.PeriodicSystem)

• basis (vibeqc._vibeqc_core.BasisSet)

• threshold (float)

• max_bonds (int | None)

Return type:

AICCM2026DevBBondAnalysis