The Journal of Chemical Physics · 2011 · 20 citations · 7 references
Natural SciencesChemistryPhysicsCondensed Matter PhysicsPhysical ChemistrySpectroscopyAb Initio MethodsElectronic SpectroscopyElectronic StructureFine StructureMolecular Orbital TheoryPrecision SpectroscopyElectronic Structure DeterminationFine Structure ConstantsFundamental Physical ConstantsSpectroscopic CharacterizationSpectroscopic Constants
The properties of the HfF(+) cation are thought to be well-suited for investigations of the electron electric dipole moment (eEDM) and temporal variations of the fine structure constant. Precision spectroscopic measurements involving the X(1)Σ(+) and low-lying (3)Δ(1) states have been proposed to measure both. Due to the lack of data for HfF(+), the design of these experiments has relied entirely on the predictions of electronic structure calculations. Spectroscopic characterizations of the X(1)Σ(+), (3)Δ(1), (3)Δ(2) and (3)Δ(3) states are reported. The results further support the contention that HfF(+) is a viable candidate for eEDM measurements. The spacings between adjacent X(1)Σ(+) and (3)Δ(1) levels are found to be less favorable for the proposed studies of the fine structure constant.
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