Abstract
A short review on special functions and solution of the Coulomb problems in quantum mechanics is given. Multiparameter wave functions of linear harmonic oscillator, which cannot be obtained by the standard separation of variables, are discussed. Expectation values in relativistic Coulomb problems are studied by computer algebra methods.
Dedicated to the memory of Professor Arnold F. Nikiforov and Professor Vasilii B. Uvarov
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Acknowledgements
We are very grateful to the organizers of the AIMS-Volkswagen Stiftung Workshop on Introduction to Orthogonal Polynomials and Applications held in Douala, Cameroon, in October 2018, without their help this publication would be impossible. Sincere thanks to our co-authors Christoph Koutschan, Sergey Kryuchkov, Raquel M. López, Peter Paule and Erwin Suazo; some of our joint results were included in this chapter. We are very grateful to the referee for an outstanding job, her/his numerous comments helped us to improve the manuscript. Special thanks are directed to Jeremy Alm, Valentin Andreev, Al Boggess and Michael Laidacker for support and continuous encouragement. This work was partially supported by the National Institute of General Medical Sciences (NIGMS) at the National Institutes of Health (NIH; Grant # K12GM102778) and by the Lamar University Research Enhancement Grant (REG # 420266).
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Appendices
Appendix A: Evaluation of an Integral
Let us compute the following integral
where n ≥ m and α − β = 0, ±1, ±2, … . Similar integrals were evaluated in [28, 49] and [113], see also references therein, but an important relation with the Hahn polynomials seems to be missing.
It is convenient to assume at the beginning that parameter s takes some continuous values such that α + s > −1 for convergence of the integral. Using the Rodrigues formula for the Laguerre polynomials [138, 139, 184]
see the proof in Sect. 1 of the present chapter, and integrating by parts
However, in view of (B.1),
and with the help of Euler’s integral representation for the gamma function [8, 138]
see also (B.10) below, one gets
See [16] or Eq. (1.12) for the definition of the generalized hypergeometric series \({ }_{3}F_{2}\left ( 1\right ) .\) Thomae’s transformation (B.8), see also [16] or [79], results in [183]
where parameter s may take some integer values. This establishes a connection with the Hahn polynomials given by Eq. (B.6) below; one can also rewrite this integral in terms of the dual Hahn polynomials [139].
Letting s = 0 and α = β in (A.5) results in the orthogonality relation for the Laguerre polynomials. Two special cases
and
are convenient for normalization of the wave functions of the discrete spectra in the nonrelativistic and relativistic Coulomb problems [28, 138].
Two other special cases of a particular interest in this chapter are
and
The Chebyshev polynomials of a discrete variable \(t_{k}\left ( x\right ) \) are special case of the Hahn polynomials \(t_{k}\left ( x,N\right ) =h_{k}^{\left ( 0,\ 0\right ) }\left ( x,N\right ) \) [185, 186] and [187]. Thus from (A.8)–(A.9) and (B.6) one finally gets
and
for 0 ≤ k < α. One can see that the positivity of these integrals is related to a nonstandard orthogonality relation for the corresponding Chebyshev polynomials of a discrete variable \(t_{k}\left ( x,N\right ) \) when the parameter takes negative integer values N = −α. Indeed, according to the method of [139] and [138], these polynomials are orthogonal with the discrete uniform distribution on the interval \(\left [ -\alpha ,-1\right ] \) which contains all their zeros and, therefore, they are positive for all nonnegative values of their argument. The explicit representation (B.6) gives also a positive sum for all positive x and negative N.
Appendix B: Hypergeometric Series, Discrete Orthogonal Polynomials, and Useful Relations
This section contains some relations involving the generalized hypergeometric series, the Laguerre and Hahn polynomials, the spherical harmonics and Clebsch–Gordan coefficients, which are used throughout the paper.
The Laguerre polynomials are defined as [8, 138, 139, 184]
(It is a consequence of Theorem 1.1.) The differentiation formulas [138, 139]
imply a recurrence relation
The simplest case of the connecting relation (c.f. [8] and [9]) is
The Hahn polynomials are [138, 139]
(We usually omit the argument of the hypergeometric series 3F 2 if it is equal to one.) An asymptotic relation with the Jacobi polynomials is
where \(\widetilde {N}=N+\left ( \alpha +\beta \right ) /2\) and N →∞; see [139] for more details.
Thomae’s transformation [16, 79] is
with n = 0, 1, 2, … .
The summation formula of Gauss [8, 16, 79]
The gamma function is defined as [8, 66, 138]
It can be continued analytically over the whole complex plane except the points z = 0, −1, −2, … at which it has simple poles. Functional equations are
The generating function for the Legendre polynomials and the addition theorem for spherical harmonics give rise to the following expansion formula [138, 189]
where \(r_{<}=\min \left ( r_{1},r_{2}\right ) \) and \(r_{>}=\max \left ( r_{1},r_{2}\right ) .\)
The Clebsch–Gordan series for the spherical harmonics is [139, 148, 189]
where \(C_{l_{1}m_{1}l_{2}m_{2}}^{lm}\) are the Clebsch–Gordan coefficients. The special case l 2 = 1 reads [71],
where
These relations allow to prove (3.34) by a direct calculation.
The required identity (5.12) can be derived from the theory of classical polynomials in the following fashion. Let us start from the difference equation for the Hahn polynomials \(y_{m}=h_{m}^{\left ( \alpha ,\ \beta \right ) }\left ( x,N\right ) \) [139]:
where \(\Delta f\left ( x\right ) =\nabla f\left ( x+1\right ) =f\left ( x+1\right ) -f\left ( x\right ) \) and
and use the familiar difference-differentiation formula:
As a result,
Letting α = β and β →−1, one gets
by (5.11). The last identity takes the form (5.12), if the Chebyshev polynomials of a discrete variable \(h_{m-1}^{\left ( 0,\;0\right ) }\left ( x,N-1\right ) \) are replaced by the corresponding generalized hypergeometric functions. (Use of (B.22) in (B.24) gives the special 3F 2 transformation.)
Appendix C: Dirac Matrices and Inner Product
We use the standard representations of the Dirac and Pauli matrices (3.3) and (3.4). The inner product of two Dirac (bispinor) wave functions
is defined as a scalar quantity
and the raised asterisk is used to denote the complex conjugate. The corresponding expectation values of a matrix operator A are given by
From this definition one gets
where the integrals A p, B p, and C p are given by (5.1)–(5.3), respectively.
Indeed, the first relation is derived, for example, in [183] and the second one can be obtained by integrating the identity
(we leave details to the reader) in a similar fashion.
In the last case, we start from the matrix identity
and use the Ansatz [183]
where n = r∕r and \(\mathcal {Y}=\mathcal {Y}_{jm}^{\pm }\left ( \mathbf {n}\right ) \) are the spinor spherical harmonics given by (3.12). As a result,
with the help of the familiar identity \(\left ( \boldsymbol {\sigma } \mathbf {n}\right ) ^{2}= {\mathbf {n}}^{2}=\boldsymbol {1}.\) Integration over \({\mathbb {R}}^{3}\) in the spherical coordinates completes the proof.
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Suslov, S.K., Vega-Guzmán, J.M., Barley, K. (2020). An Introduction to Special Functions with Some Applications to Quantum Mechanics. In: Foupouagnigni, M., Koepf, W. (eds) Orthogonal Polynomials. AIMSVSW 2018. Tutorials, Schools, and Workshops in the Mathematical Sciences . Birkhäuser, Cham. https://doi.org/10.1007/978-3-030-36744-2_21
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