Articles with "generation qtaim" as a keyword



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The Cis-Effect Explained Using Next-Generation QTAIM

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Published in 2022 at "Molecules"

DOI: 10.3390/molecules27186099

Abstract: We used next-generation QTAIM (NG-QTAIM) to explain the cis-effect for two families of molecules: C2X2 (X = H, F, Cl) and N2X2 (X = H, F, Cl). We explained why the cis-effect is the exception… read more here.

Keywords: generation qtaim; cis effect; next generation; qtaim ... See more keywords