Integral coalescence conditions
- 1 January 1967
- journal article
- research article
- Published by Taylor & Francis in Molecular Physics
- Vol. 13 (6) , 577-582
- https://doi.org/10.1080/00268976700101501
Abstract
The general coalescence conditions of Pack and Byers Brown for spatial eigenfunctions are used to derive integral coalescence conditions for exact wavefunctions Ψ for atoms and molecules with definite spin quantum numbers. These conditions for the special case of nodeless Ψ are equivalent to the cusp conditions for the electron and spin densities of Steiner and Bingel. Finally, the integral coalescence conditions are applied to approximate wavefunctions.Keywords
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