A self-consistent field for the H2 molecule |
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Authors: | G. Berthier |
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Affiliation: | Laboratoire de Chimie Théorique de la Faculté des Sciences , 34 rue d'Ulm, Paris (Vè) |
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Abstract: | We investigate the simple harmonic oscillator in a 1D box, and the 2D isotropic harmonic oscillator problem in a circular cavity with perfectly reflecting boundary conditions. The energy spectrum has been calculated as a function of the self-adjoint extension parameter. For sufficiently negative values of the self-adjoint extension parameter, there are bound states localized at the wall of the box or the cavity that resonate with the standard bound states of the simple harmonic oscillator or the isotropic oscillator. A free particle in a circular cavity has been studied for the sake of comparison. This work represents an application of the recent generalization of the Heisenberg uncertainty relation related to the theory of self-adjoint extensions in a finite volume. |
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Keywords: | vibrational spectrum in finite volume cavity resonance self-adjoint extensions |
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