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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Implementation of the self-consistent phonons method with ab initio potentials (AI-SCP)

Colin Schiltz1, Dmitrij Rappoport1, Vladimir A Mandelshtam1

  • 1Department of Chemistry, University of California, Irvine, California 92697, USA.

The Journal of Chemical Physics
|May 15, 2023
PubMed

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