Sometimes called the resonance integral, Hmn is approximated using the overlap integral, Smn . Note that this violates the NDO approximation, but since resonance integrals are large, this integral is retained. This is the origin of Modified in the name of the method. With Slater atomic orbitals of type
fm = Nrn-1e-xr
the overlap integral is given by:
Smn = <fmfn>.
Hmn is approximated by:
Hmn = Smn1/2(bm + bn);