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American Journal of Physics

One-dimensional hydrogen atom and hydrogen molecule ion in momentum space

I. Richard Lapidus

Published Jul 1, 1983• 7 citations
Publisher

Abstract

The momentum-space wave functions have been obtained for the one-dimensional hydrogen atom and the symmetric and antisymmetric states of the one-dimensional hydrogen molecule ion with δ-function interactions between the particles. The uncertainty relation has been evaluated as a function of the distance between the nuclei in the molecule ion. For the symmetric state this is finite for the collapsed molecule. For the antisymmetric state the energy is positive for a nuclear separation less than a0=ℏ2/me2 and the uncertainty in the position of the electron is infinite.

DOI
10.1119/1.13176

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The momentum-space wave functions have been obtained for the one-dimensional hydrogen atom and the symmetric and antisymmetric states of the one-dimensional hydrogen molecule ion with δ-function interactions between the particles. The uncertainty relation has been evaluated as a function of the distance between the nuclei in the molecule ion. For the symmetric state this is finite for the collapsed molecule. For the antisymmetric state the energy is positive for a nuclear separation less than a0=ℏ2/me2 and the uncertainty in the position of the electron is infinite.
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The coordinate-space wave function ψ(x)ψ(x)ψ(x) of quasi-one-dimensional atoms is defined in the x≥0x\geq 0x≥0 region only. This poses a typical problem to write a physically acceptable momentum-space wave function ϕ(p)ϕ(p)ϕ(p) from the Fourier transform of ψ(x)ψ(x)ψ(x). We resolve the problem with special attention to the behavior of real and imaginary parts of the complex-valued function ϕ(p)ϕ(p)ϕ(p) as a function of ppp and confirm that ϕi(p)ϕ_i(p)ϕi​(p) (the imaginary part of ϕ(p)ϕ(p)ϕ(p)) represents the correct momentum-space wave function. We make use of the results for ψ(x)ψ(x)ψ(x) and ϕi(p)ϕ_i(p)ϕi​(p) to express the position- and momentum-space Fisher information in terms of the principal quantum number and energy eigen value of the system and provide some useful checks on the result presented with particular attention on the information theoretic uncertainty relation.
This paper presents a comprehensive analysis of the generalized radial uncertainty product for the d-dimensional non-relativistic Hydrogen atom in position space. Utilizing the framework of quantum mechanics in d-dimensional spherical coordinates, the study extends the standard radial uncertainty relation to higher dimensions. Taking the solution of the radial Schrodinger equation, the normalized radial wave functions, expectation values, and uncertainties in both position and momentum space are rigorously evaluated. The analytical derivations reveal the dependence of the uncertainty product on the principal and angular quantum numbers, as well as the dimensional parameter d. The results provide deeper insight into the role of dimensionality in quantum uncertainty relations and their implications for higher-dimensional quantum systems
The problem of the motion of a particle attracted by two fixed centers of force according to the Coulomb force law can be treated by classical mechanics and has been used in quantum theory by Pauli and Messen for a theory of the hydrogen molecule ion.1 In the quantum mechanics, where the energy levels are determined as the “eigenwerte” of Schrodinger’s equation, the variables are separable and the boundary value problem is easily set up. But thus far a satisfactory treatment of the differential equations involved is lacking. Burrau2 has recently carried out a numerical integration of the problem for the lowest energy level of an electron moving under the influence of two fixed centers of Coulomb attraction as a function of the distance apart of these centers. In this paper, Burrau’s data are used to give a semi-quantitative discussion of the neutral hydrogen molecule. His values are: Nuclear separation 1.0 1.3 1.6 1.8 2.0 2.2 2.4 2.95 Electronic energy 2.896 2.648 2.436 2.309 2.204 2.109 2.025 1.836 The unit of separation is the Bohr l1 orbit radius of hydrogen atom, that of energy is the ionization potential of atomic hydrogen.