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Open Access Journal of Science

Oscillations through a barrier tunneling potential for a particle in a central potential (double potential well)

Hasan Hüseyin Erbil, Ahmet Saim Selvi

Published Jan 23, 2024• 0 citations
Publisher

Abstract

In some molecules such as ammonia, double vibrations are observed at small energies. These small vibrations are thought to arise from double well potentials. To explain these small energy gaps, double potential wells are investigated, and complex calculations are made. Until recently, since the exact solution of the Schrödinger equation was not known, approximate solutions were always obtained. The exact solution of the Schrödinger equation is now known. In previous studies, a simple procedure for the general solution of the radial Schrödinger Equation has been found for spherical symmetric potentials without making any approximation. In this article, the Schrodinger equation was solved with this new solution method. It has been applied to the oscillations through a barrier tunneling potential for a particle in a central quadratic deformed potential well (double potential well). It is seen that there is no need to look for complex potentials to explain the double wells observed in small vibrations in ammonia and similar molecules, they were compared with experimentally measured energies. The results were found to be fully compatible. It has been seen that there can always be double well potentials at small energies for all molecules, atomic nuclei, and similar particles with angular momentum other than zero.

DOI
10.15406/oajs.2024.07.00208

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In some molecules such as ammonia, double vibrations are observed at small energies. These small vibrations are thought to arise from double well potentials. To explain these small energy gaps, double potential wells are investigated, and complex calculations are made. Until recently, since the exact solution of the Schrödinger equation was not known, approximate solutions were always obtained. The exact solution of the Schrödinger equation is now known. In previous studies, a simple procedure for the general solution of the radial Schrödinger Equation has been found for spherical symmetric potentials without making any approximation. In this article, the Schrodinger equation was solved with this new solution method. It has been applied to the oscillations through a barrier tunneling potential for a particle in a central quadratic deformed potential well (double potential well). It is seen that there is no need to look for complex potentials to explain the double wells observed in small vibrations in ammonia and similar molecules, they were compared with experimentally measured energies. The results were found to be fully compatible. It has been seen that there can always be double well potentials at small energies for all molecules, atomic nuclei, and similar particles with angular momentum other than zero.
Scanning tunneling microscopy is introduced as an analytic tool for characterizing nanostructures and dynamics on the nanoscale. To analyze the underlying tunneling phenomenon, the Schrödinger equation is solved for a particle confined between finite potential energy steps. For a single potential energy well, the proper solutions to the Schrödinger equation are similar to those of a particle in an infinite box, except for the emerging “tails” of the stationary wave functions in the “classically forbidden” regions of the external confining potentials. For a symmetric double well potential, wave function penetration of the stationary solutions manifests in their even distribution among the wells. An attempt to localize the particle in one of them would lead to periodic oscillations between the wells, as if the particle can “tunnel” under the separating energy barrier. The wave function penetration and tunneling phenomena are discussed also in relation to energy band formation in periodic lattices.
By using a simple procedure the general solution of the time-independent radial Schrodinger Equation for spherical symmetric potentials was made without making any approximation. The wave functions are always periodic. It appears two diffucilties: one of them is the solution of the equation E= U(r), where E and U(r) are the total an effective potential energies, respectively, and the other is the calculation of the integral of the square root of U(r). If analytical calculations are not possible, one must apply numerical methods. To find the energy wave function of the ground state, there is no need for the calculation of this integral, it is sufficient to find the classical turning points, that is to solve the equation E=U(r).
Ammonia is a well-known example of a two-state system and must be described in quantum-mechanical terms. In this article, we will explain the tunneling phenomenon that occurs in ammonia molecules from the perspective of trajectory-based quantum dynamics, rather than the usual quantum probability perspective. The tunneling of the nitrogen atom through the potential barrier in ammonia is not merely a probability problem; there are underlying reasons and mechanisms explaining why and how the tunneling in ammonia can happen. Under the framework of quantum Hamilton mechanics, the tunneling motion of the nitrogen atom in ammonia can be described deterministically in terms of the quantum trajectories of the nitrogen atom and the quantum forces applied. The vibrations of the nitrogen atom about its two equilibrium positions are analyzed in terms of its quantum trajectories, which are solved from the Hamilton equations of motion. The vibration periods are then computed by the quantum trajectories and compared with the experimental measurements.
The ground-state energies and wave functions of a particle moving in one-dimensional potentials of the form V(x)=x2p, p=1,2,..., are obtained nearly exactly by iterative solution of the Schrödinger equation. These solutions are used as the ‘‘experimental benchmark’’ against which approximate solutions for the general case are tested. Both finite depth wells and infinitely deep wells are studied, as is the three-dimensional version (spherical symmetry, angular momentum quantum number l=0). The approach is aimed at student exploration of the physics of the family of potential wells, with emphasis upon connecting the familiar extreme cases, V(x)=x2 (simple harmonic oscillator) and the limiting case xk, k→∞ (square well).
A simple procedure has been found for the general solution of the time-independent Schrödinger equation (SE) with the help of quantization of potential area in one dimension without making any approximation. Energy values are not dependent on wave functions. So, to find the energy values, it is enough to find the classic turning points of the potential function. Two different solutions were obtained, namely, symmetric and antisymmetric in bound states. These normalized wave functions are always periodic. It is enough to take the integral of the square root of the potential energy function to find the normalized wave functions. If these calculations cannot be made analytically, they should then be performed by numerical methods. The SE has been solved for a particle in many one-dimension and the spherical symmetric central potential wells as examples. Their energies and normalized wave functions were found as examples. These solutions were also applied to the theories of scattering and alpha decay. The results obtained with the experimental values were compared with the calculated values. One was seen to be very fit.