Publication - Journal Article Guest–Host Interactions in Clathrate Hydrates: Benchmark MP2 and CCSD(T)/CBS Binding Energies of CH₄, CO₂, and H₂S in (H₂O)₂₀ Cages

Journal Article

The Journal of Physical Chemistry Letters, vol. 12, iss. 31, pp. 7574-7582, 2021

Authors

Joseph P. Heindel, Kristina M. Herman, Edoardo Aprà, Sotiris S. Xantheas

Language English

Publication - Journal Article Guest–Host Interactions in Clathrate Hydrates: Benchmark MP2 and CCSD(T)/CBS Binding Energies of CH4, CO2, and H2S in (H2O)20 Cages