The coupled 3D wave packet approach for triatomic reactive scattering in hyperspherical coordinates

DOI10.1016/J.CPC.2012.09.001zbMath1304.81157OpenAlexW2075037129WikidataQ57966359 ScholiaQ57966359MaRDI QIDQ483818

António J. C. Varandas, Satrajit Adhikari

Publication date: 17 December 2014

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

Full work available at URL: http://hdl.handle.net/10316/80811

zbMATH Keywords

parallel computationhyperspherical coordinatesreaction cross-sectiontriatomic reaction

Mathematics Subject Classification ID

Software, source code, etc. for problems pertaining to quantum theory (81-04) Molecular physics (81V55)

Related Items (1)

Coriolis coupling effects in the dynamics of the \(\mathrm D(^2\mathrm S)\ +\mathrm{NH}(\mathrm{X}^3{\Sigma}^-) \rightarrow \mathrm{N}(^4\mathrm{S})\ + \mathrm{HD}(\mathrm{X}^1\Sigma_g^+)\) reaction and its kinetic isotope effect

This page was built for publication: The coupled 3D wave packet approach for triatomic reactive scattering in hyperspherical coordinates