Small Basis Set Allowing the Recovery of Dispersion Interactions with Double-Hybrid Functionals

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https://hal.archives-ouvertes.fr/hal-02236844
Contributor : Ilaria Ciofini <>
Submitted on : Thursday, August 1, 2019 - 12:15:40 PM
Last modification on : Saturday, August 3, 2019 - 1:41:19 AM

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Juan Sanz Garcı́a, Eric Brémond, Marco Campetella, Ilaria Ciofini, Carlo Adamo. Small Basis Set Allowing the Recovery of Dispersion Interactions with Double-Hybrid Functionals. Journal of Chemical Theory and Computation, American Chemical Society, 2019, 15 (5), pp.2944-2953. ⟨10.1021/acs.jctc.8b01203⟩. ⟨hal-02236844⟩

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