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Test of the interaction potential energy for Na⁺-H₂ by gaseous ion transport data
Larry A Viehland1, Alexei A Buchachenko2
1Science Department, Chatham University, Pittsburgh, Pennsylvania 15232, USA.
Abstract:
Transport properties of Na(+) ions in gaseous hydrogen are calculated using the recently developed "beyond Monchick-Mason" (BMM) approximation and an ab initio Na(+)-H2 potential energy surface. Good agreement with the experimental data on the reduced mobility and longitudinal diffusion coefficient proves the accuracy of the surface and the adequacy of the BMM method, allowing for its optimal parameterization.
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