Changes in Structure and Reactivity of Ng
density functional theory
encapsulation
fullerene
information-theoretic approach
noble gas dimer
Journal
Frontiers in chemistry
ISSN: 2296-2646
Titre abrégé: Front Chem
Pays: Switzerland
ID NLM: 101627988
Informations de publication
Date de publication:
2020
2020
Historique:
received:
24
02
2020
accepted:
02
06
2020
entrez:
29
7
2020
pubmed:
29
7
2020
medline:
29
7
2020
Statut:
epublish
Résumé
Noble gas can be no noble in certain situations from the perspective of structure, bonding, and reactivity. These situations could be extreme experimental conditions or others. In this contribution, we systematically investigate the impact of fullerene encapsulation on molecular structure and chemical reactivity of noble gas dimers (Ng
Identifiants
pubmed: 32719776
doi: 10.3389/fchem.2020.00566
pmc: PMC7350904
doi:
Types de publication
Journal Article
Langues
eng
Pagination
566Informations de copyright
Copyright © 2020 Li, He, Wang, Zhao, Rong, Chattaraj and Liu.
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