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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
12:11

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry

Published on: April 8, 2020

The calculated infrared spectrum of Cl-H2O using a new full dimensional ab initio potential surface and dipole moment

Jaime Rheinecker1, Joel M Bowman

  • 1Cherry L. Emerson Center for Scientific Computation, Emory University, Atlanta, Georgia 30322, USA.

The Journal of Chemical Physics
|October 13, 2006
PubMed

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