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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Similarity transformed equation of motion coupled-cluster theory based on an unrestricted Hartree-Fock reference for

Lee M J Huntington1, Martin Krupička2, Frank Neese1

  • 1Max-Planck-Institut für Chemische Energiekonversion, Stiftstr. 34-36, 45470 Mülheim an der Ruhr, Germany.

The Journal of Chemical Physics
|November 10, 2017
PubMed

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