Disclosing gate-opening/closing events inside a flexible metal-organic framework loaded with CO


Journal

Nanoscale
ISSN: 2040-3372
Titre abrégé: Nanoscale
Pays: England
ID NLM: 101525249

Informations de publication

Date de publication:
14 Sep 2023
Historique:
medline: 23 8 2023
pubmed: 23 8 2023
entrez: 23 8 2023
Statut: epublish

Résumé

We have combined reactive molecular dynamics simulations with principal component analysis to provide a clearer view of the interactions and motion of the CO

Identifiants

pubmed: 37609787
doi: 10.1039/d3nr02760k
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

14505-14513

Auteurs

Susanna Monti (S)

CNR-ICCOM, Institute of Chemistry of Organometallic Compounds, Pisa 56124, Italy. sapeptides@gmail.com.

Cheherazade Trouki (C)

CNR-IPCF, Institute of Chemical and Physical Processes, Pisa 56124, Italy.
Department of Pharmacy, University of Pisa, Pisa 56126, Italy.

Giovanni Barcaro (G)

CNR-IPCF, Institute of Chemical and Physical Processes, Pisa 56124, Italy.

Classifications MeSH