Journal
MENDELEEV COMMUNICATIONS
Volume 33, Issue 3, Pages 353-356Publisher
ELSEVIER
DOI: 10.1016/j.mencom.2023.04.018
Keywords
topological atom; bonding interaction; molecular crystals; topological analysis; molecular vibrations
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Research suggests that the electronic virial-based correlation should be utilized for estimating bonding contributions to molecular vibrations in crystals.
It is shown that the electronic virial-based correlation should be used to estimate bonding contributions to the rigidity of molecular vibrations in crystals.
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