Journal of Computational and Theoretical Nanoscience · 2013 · 10 citations · 1 references
Natural SciencesChemistryPhysicsPhysical ChemistrySpectroscopyTheoretical ChemistryInfrared SpectroscopyMolecular SymmetryMolecular VibrationTransition Metal ChemistryTransition Metal ComplexesVibrational SpectroscopyCasimir EffectEffective Hamiltonian TheoryHamiltonian OperatorsInfrared Absorption SpectraInfrared SpectraMolecular Vibrational ModesSpectroscopy Of Transition Metal ComplexesVibrational Energy Levels
In this paper, we report the vibrational infrared spectra of transition metal compounds Copper (II) Chloride dehydrate and Cobalt (II) Chloride hexahydrate by using standard chemical procedure. To analyse these spectra we use the U(2) algebraic model based on the dynamic symmetry of the molecules. By applying algebraic techniques, an effective model Hamiltonian is obtained which conveniently describes the rovibrational degrees of freedom of the physical system. In this framework, the Hamiltonian is constructed considering the interacting Casimir and Majorana operators replacing every interatomic bond of the molecules by a corresponding Lie algebra. Finally the fundamental stretching vibrational energy levels of the transition metal compounds are calculated using this model Hamiltonian in one dimensional algebraic framework.
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