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Extension of a regularizing algorithm for the determination of equilibrium geometry and force field of free molecules from joint use of electron diffraction, molecular spectroscopy and ab initio data on systems with large-amplitude oscillatory motion

Regularizing AlgorithmEngineeringPhysicsEquilibrium GeometryNatural SciencesApplied PhysicsElectron DiffractionComputational ChemistryMolecular MechanicQuantum ChemistryMolecular SpectroscopyAb-initio Method