Studies on Vibrational Structure of Diatomic Molecular States
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Graphical Abstract
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Abstract
Alternative expressions for vibrational and rotational spectrum constants and energies of diatomic molecular electronic states are suggested based on the perturbation theory. An algebraic method (AM) is proposed to generate converged full vibrational spectrum from limited energy data, and a potential variational method (PVM) is suggested to produce the vibrational force constants f n s and rotational spectrum constants using the perturbation formulae and the AM vibrational constants. Applying this method...
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