Roadmap to spline-fitting potentials in high dimensions

DOI10.1007/s10910-013-0173-4zbMath1312.65016WikidataQ57966358 ScholiaQ57966358MaRDI QIDQ364631

Mohammad Hasan, M. Dambrine

Publication date: 9 September 2013

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: http://hdl.handle.net/10316/44348

zbMATH Keywords

splines; potential energy surfaces; shape-preserving splines

Mathematics Subject Classification ID

65D07: Numerical computation using splines

65L05: Numerical methods for initial value problems involving ordinary differential equations