esipy.make_aoms

Module Contents

Functions

make_aoms(mol, mf, partition[, myhf, save])

Build the Atomic Overlap Matrices (AOMs) in the Molecular Orbitals basis.

esipy.make_aoms.make_aoms(mol, mf, partition, myhf=None, save=None)

Build the Atomic Overlap Matrices (AOMs) in the Molecular Orbitals basis.