Evaluation of the Gaunt Coefficients by Using Recurrence Relations for Spherical Harmonics

Author:

ÖZAY Selda1ORCID

Affiliation:

1. ONDOKUZ MAYIS ÜNİVERSİTESİ

Abstract

The Gaunt coefficient is one of the important coefficients to be known for calculating molecular integrals in quantum theory of coupling of three angular momenta. Generally, these coefficients are calculated analytically by using the properties of the associated Legendre polynomials. In this study, Gaunt coefficients were calculated algebraically by using the recurrence relations and orthogonality conditions of spherical harmonics and different mathematical expressions were obtained from known analytical expressions for Gaunt coefficients in terms of factorial functions or binomial coefficients. By using the program written in the Mathematica programming language, both the analytical expressions and the algebraic expressions were calculated, and the numerical results obtained were compared. Numerical results are in quite agreement with the literature and each other.

Publisher

Suleyman Demirel Universitesi Fen Edebiyat Fakultesi Fen Dergisi

Subject

General Economics, Econometrics and Finance

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4. A. Bandzaitis and A. Yutsis, “Once more on the formulas for the Clebsch-Gordan coefficients”, Lietuvos Fiz. Rinkinys, 4, 45-49, 1964.

5. V. A. Fock, “New deduction of the vector model”, JETP 10, 383-393, 1940.

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