Electron delocalization in defect-containing graphene and its influence on tetrel bond formation.


Journal

Physical chemistry chemical physics : PCCP
ISSN: 1463-9084
Titre abrégé: Phys Chem Chem Phys
Pays: England
ID NLM: 100888160

Informations de publication

Date de publication:
20 Sep 2023
Historique:
medline: 6 9 2023
pubmed: 6 9 2023
entrez: 6 9 2023
Statut: epublish

Résumé

Using the advanced analyses of electron density and fermionic potential, we show how electron delocalization influences the ability of defect-containing graphene to form tetrel bonds. The C

Identifiants

pubmed: 37672065
doi: 10.1039/d3cp03127f
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

24342-24354

Auteurs

Ekaterina V Bartashevich (EV)

South Ural State University, 454080 Chelyabinsk, Russia. bartashevichev@susu.ru.

Elena O Levina (EO)

South Ural State University, 454080 Chelyabinsk, Russia. bartashevichev@susu.ru.
N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, 119071 Moscow, Russia.

Irina D Yushina (ID)

South Ural State University, 454080 Chelyabinsk, Russia. bartashevichev@susu.ru.

Sergey A Sozykin (SA)

South Ural State University, 454080 Chelyabinsk, Russia. bartashevichev@susu.ru.

Vladimir G Tsirelson (VG)

South Ural State University, 454080 Chelyabinsk, Russia. bartashevichev@susu.ru.
D.I. Mendeleev University of Chemical Technology, 125047 Moscow, Russia.

Classifications MeSH