Soldán, P. and Hutson, J.M. (2000) 'On the long-range and short-range behavior of potentials from reproducing kernel Hilbert space interpolation.', Journal of chemical physics., 112 (9). pp. 4415-4416.
The short-range and long-range asymptotic behavior of potential functions obtained from the reciprocal power reproducing kernel Hilbert spaceinterpolation procedure [Ho and Rabitz, J. Chem. Phys. 104, 2584 (1996)] is analyzed. In the short-range region, the potential functions are polynomial in form: the method should not be used for extrapolation in this region. General formulae for the short-range and long-range expansion coefficients are presented. Potentials for He-Ar+ are discussed as examples.
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|Publisher Web site:||http://dx.doi.org/10.1063/1.480988|
|Publisher statement:||© 2000 American Institute of Physics. This article may be downloaded for personal use only. Any other use requires prior permission of the author and the American Institute of Physics. The following article appeared in The Journal of Chemical Physics 112, 4415 (2000) and may be found at http://dx.doi.org/10.1063/1.480988|
|Date accepted:||No date available|
|Date deposited:||19 August 2015|
|Date of first online publication:||March 2000|
|Date first made open access:||No date available|
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