Parallel calculations of molecular properties

DOI10.1016/S0010-4655(00)00068-0zbMath0983.81501OpenAlexW2096657948WikidataQ59613890 ScholiaQ59613890MaRDI QIDQ1578199

Kenneth Ruud, Peter R. Taylor, Dan Jonsson

Publication date: 15 April 2002

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

Full work available at URL: https://doi.org/10.1016/s0010-4655(00)00068-0

zbMATH Keywords

parallelizationDalton quantum chemistry programlarge molecules

Mathematics Subject Classification ID

Computational methods for problems pertaining to quantum theory (81-08) Molecular physics (81V55)

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An single program multiple data strategy for calculation of anharmonic vibrations

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