General form of the quantum-defect theory
- 1 April 1979
- journal article
- research article
- Published by American Physical Society (APS) in Physical Review A
- Vol. 19 (4) , 1485-1509
- https://doi.org/10.1103/physreva.19.1485
Abstract
The quantum-defect-theory (QDT) treatment of an electron in the Coulomb field surrounding an ionic core is recast in a form largely independent of field characteristics and thus applicable, e.g., to square wells or to the Morse fields of diatomic molecules. The reformulation parallels Seaton's classification of alternative Coulomb-field wave functions, and makes it applicable to other fields. Wronskians of alternative pairs of base functions have an important role in the theory. For electron energies in a Coulomb field these Wronskians reduce to trigonometric functions of , familiar in the QDT; other fields lead to trigonometric functions of different arguments. Quantum defects are generalized to eigenvalues of a reaction matrix, as in Seaton's work, but this matrix can now be calculated even below threshold energies with the introduction of a "smooth" Green's function appropriate to QDT applications.
Keywords
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