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Constructing atom-molecule potential surfaces from ab initio data: A method combining quadrature and interpolation

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Publication:1581135
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DOI10.1016/S0010-4655(99)00523-8zbMath0963.65017OpenAlexW2093752321MaRDI QIDQ1581135

Robert J. Hinde

Publication date: 19 June 2001

Published in: Computer Physics Communications (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/s0010-4655(99)00523-8


zbMATH Keywords

interpolationnumerical experimentspotential energy surfacequadratureatom-molecule potential surfaces


Mathematics Subject Classification ID

Numerical interpolation (65D05) Atomic physics (81V45) Numerical quadrature and cubature formulas (65D32) Molecular physics (81V55)


Related Items (1)

Computational aspects of Cui-Freeden statistics for equidistribution on the sphere







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