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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Full triples contribution in coupled-cluster and equation-of-motion coupled-cluster methods for atoms and molecules

Florian Hampe1, Niklas Gross2, Stella Stopkowicz2

  • 1Department für Chemie, Johannes Gutenberg-Universität Mainz, D-55099 Mainz, Germany. stella.stopkowicz@uni-mainz.de and Department of Chemistry, University of Southern California, Los Angeles, California 99089, USA. fhampe@usc.edu.

Physical Chemistry Chemical Physics : PCCP
|October 20, 2020
PubMed

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