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Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron density

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https://hal.univ-reims.fr/hal-02505160
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Submitted on : Thursday, October 14, 2021 - 7:23:25 AM
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Corentin Lefebvre, Gaëtan Rubez, Hassan Khartabil, Jean-Charles Boisson, Julia Contreras-García, et al.. Accurately extracting the signature of intermolecular interactions present in the NCI plot of the reduced density gradient versus electron density. Physical Chemistry Chemical Physics, Royal Society of Chemistry, 2017, 19 (27), pp.17928-17936. ⟨10.1039/C7CP02110K⟩. ⟨hal-02505160⟩

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