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Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
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Exact parameterization of fermionic wave functions via unitary coupled cluster theory

Francesco A Evangelista1, Garnet Kin-Lic Chan2, Gustavo E Scuseria3

  • 1Department of Chemistry and Cherry Emerson Center for Scientific Computation, Emory University, Atlanta, Georgia 30322, USA.

The Journal of Chemical Physics
|January 3, 2020
PubMed

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