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arXiv:0907.2959 · Physics Essays

New reflections on electron’s energy and wave function in the hydrogen atom

Ezzat G. Bakhoum

Published Dec 1, 2010• 1 citation
arXivHTMLPDF

Abstract

Schrodinger's equation predicts something very peculiar about the electron in the Hydrogen atom: its total energy must be equal to zero. Unfortunately, an analysis of a zero-energy wavefunction for the electron in the Hydrogen atom has not been attempted in the published literature. This paper provides such an analysis for the first time and uncovers a few interesting facts, including the fact that a "zero-energy wavefunction" is actually a quantized version of the classical wavefunction that has been known for decades.

DOI
10.4006/1.3507036

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Schrodinger's equation predicts something very peculiar about the electron in the Hydrogen atom: its total energy must be equal to zero. Unfortunately, an analysis of a zero-energy wavefunction for the electron in the Hydrogen atom has not been attempted in the published literature. This paper provides such an analysis for the first time and uncovers a few interesting facts, including the fact that a "zero-energy wavefunction" is actually a quantized version of the classical wavefunction that has been known for decades.
Even after nine decades of successful run of the Quantum Mechanics (QM), different viewpoints on foundational problems of Quantum Physics are still being actively debated. That is because mathematical logic of QM often defies the physical intuition which constitutes the main spirit of Physics. De Broglie’s hypothesis of matter waves implied that the dynamic characteristics of a micro particle in motion, can be ascribed to the wave characteristics of the wavelet accompanying the particle. The Schrödinger equation models the matter-wave interactions through wavefunction ψ and effectively serves as the foundation of QM. Even though mathematical structure of the Schrödinger equation is sound and elegant, here we show a conceptual mistake in the development of this equation wherein the physical situation has not been correctly modeled in the equation. The Coulomb potential energy of the proton electron pair in Hydrogen atom is essentially the negative interaction energy between their superposed electrostatic fields which is inversely proportional to their instantaneous separation distance. Assuming the proton to be relatively fixed at the origin of an appropriate coordinate system, the potential energy of the orbiting electron will be a function of instantaneous position coordinates of the electron. This has not been properly modeled in the Schrödinger equation. The resulting errors in the solution have been quantitatively demonstrated in this paper. We have stressed the necessity of incorporating a specific correction in the potential energy term of the Schrödinger equation, after which it may facilitate the adoption of Bohmian QM.
Abstract This chapter reiterates the quantum numbers for atomic orbitals, known from general chemistry, and places them into the context developed so far. It is sketched how the Schrodinger equation (SE) for the hydrogen atom hydrogen-like systems (one electron plus a nucleus of charge Z) is set up. When the nucleus is treated as a fixed point charge, the SE is only for the electron. The solutions of the SE can be obtained by switching to spherical polar coordinates, such that the variables are separable in terms of the electron distance from the nucleus, r, and two angles. The kinetic energy of the electron then has a radial component, and an angular component. The latter is associated with the angular momentum quantum number, which is codified by the letters s, p, d, f, and so forth. A step by step solution of the SE is provided later, in chapter 19.
The fine structure of hydrogen energy was calculated by using the usual momentum-wavefunction relation directly, rather than establishing the well-known Dirac wave equation. As the results, the energy levels are completely the same as that of the Dirac wave equation, while the wavefunction is single component that is quite different from Dirac's four component wavefunction, the most important thing is that the present calculation brings out electronic spin in a new way which has never been reported and indicates that the electronic spin is a kind of orbital motion.
The Schrödinger equation is the cornerstone of quantum mechanics and is used to determine the energy levels of the hydrogen atom. However, in the teaching of Quantum Chemistry, many students tend to regard the solutions of the Schrödinger equation as purely mathematical results without fully understanding the physical origin of quantum energy levels. In this paper, an approximate model of the hydrogen atom is first developed based on the Heisenberg uncertainty principle and the Coulomb potential. This model is then used to derive the Bohr radius and the ground-state energy by minimizing the total energy function. Subsequently, the time-independent Schrödinger equation is formulated and solved by the method of separation of variables in spherical coordinates to obtain the exact energy spectrum of the hydrogen atom. The results demonstrate that both the approximate model and the exact solution predict the same ground-state energy, E1 = −13.6 eV, while the Schrödinger equation further generalizes this result to the quantized energy spectrum, En = −13.6/n2. These findings indicate that the solutions of the Schrödinger equation are not "miraculous" mathematical outcomes but rather the inevitable consequences of the fundamental principles of quantum mechanics. This approach provides a clearer physical interpretation of quantum energy levels and offers significant pedagogical value for the teaching of Quantum Chemistry.
Wigner has calculated the ground-state energy of the hydrogen atom with second-order perturbation theory, the whole electrostatic potential being considered as the perturbation. Though his result is finite, it does not agree with the known energy for hydrogen. A fact implicit in the literature, but not usually appreciated in this connection, is pointed out---that if part of the electrostatic energy is retained in the zero-order problem, a correct result is obtained, even if the part of the energy retained is given a zero magnitude after the calculation is carried out. It is also shown that if the calculation is carried out in an Einstein hypersphere, the entire "electrostatic potential" can be regarded as the perturbation and the correct result is obtained. Perturbation theory leads to the exact energy eigenvalue in all approximations higher than the first, but the expansion of the eigenfunction converges slowly if the perturbation is made large.
This study conducted a detailed study on the wave function characteristics of the hydrogen atom model and explored its potential applications in quantum computing, atomic spectral analysis and quantum information processing based on the Schrödinger equation. By solving the Schrödinger equation of the hydrogen atom, the form of the wave function was clearly obtained, and the distribution law of electrons at various energy levels was demonstrated. The study constructed a quantum theoretical model of the hydrogen atom, derived the regulatory effect of quantum numbers on the wave function, and solved the Schrödinger equation with the help of numerical analysis technology to ensure the accuracy and robustness of the wave function evaluation. The study conducted a detailed analysis of the energy level, wave function profile and electron probability density distribution of the hydrogen atom. The simulation results show that with the increase of energy level, the oscillation frequency of the wave function increases significantly, and the distribution space of electrons also expands accordingly. In addition, this study also explored the practical application of the hydrogen atom model. In the field of quantum computing, the wave function characteristics provide theoretical support for the initialization and manipulation of quantum bits; in atomic spectral analysis, accurately calculated energy levels and wave functions help to improve the accuracy of spectral measurement; in quantum information processing, the simulation of quantum entangled networks based on the hydrogen atom model provides new ideas for quantum communication and quantum computing. These applications demonstrate that the hydrogen atom model is not only of great significance in theoretical physics, but also has broad application prospects in emerging technology fields.