Why pay more? QTAIM descriptors of non-covalent interactions in S22 from promolecular electron density Full article
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Mendeleev Communications
ISSN: 1364-551X , E-ISSN: 0959-9436 |
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| Output data | Year: 2023, Volume: 33, Number: 6, Pages: 806-808 Pages count : 3 DOI: 10.1016/j.mencom.2023.10.022 | ||
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Abstract:
Based on the comparative analysis of electron density topological features obtained by different methods for the model set of bimolecular associates it is shown that the simplest promolecule model can be an efficient tool in studies of non-covalent interactions.
Cite:
Ananyev I.V.
, Fershtat L.L.
Why pay more? QTAIM descriptors of non-covalent interactions in S22 from promolecular electron density
Mendeleev Communications. 2023. V.33. N6. P.806-808. DOI: 10.1016/j.mencom.2023.10.022 WOS Scopus OpenAlex
Why pay more? QTAIM descriptors of non-covalent interactions in S22 from promolecular electron density
Mendeleev Communications. 2023. V.33. N6. P.806-808. DOI: 10.1016/j.mencom.2023.10.022 WOS Scopus OpenAlex
Identifiers:
| Web of science: | WOS:001128193400001 |
| Scopus: | 2-s2.0-85183621531 |
| OpenAlex: | W4389123595 |