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Intrinsic local constituents of molecular electronic wave functions. I. Exact representation of the density matrix in terms of chemically deformed and oriented atomic minimal basis set orbitals

Localized Excited StateEngineeringPhysicsExact RepresentationNatural SciencesIntrinsic Local ConstituentsPhysical ChemistryComputational ChemistryChemistryQuantum ChemistryElectronic StructureSpectra-structure CorrelationAb-initio MethodDensity Matrix