Insight into the Relationship between Negative Thermal Expansion and Structure Flexibility: The Case of Zn(CN)
Journal
Inorganic chemistry
ISSN: 1520-510X
Titre abrégé: Inorg Chem
Pays: United States
ID NLM: 0366543
Informations de publication
Date de publication:
29 Aug 2022
29 Aug 2022
Historique:
pubmed:
17
8
2022
medline:
17
8
2022
entrez:
16
8
2022
Statut:
ppublish
Résumé
High structure flexibility can lead to large negative thermal expansion (NTE), but the reason is not clear. In this work, first-principles calculations have been carried out to investigate the relationship between NTE and structure flexibility in Zn(CN)
Identifiants
pubmed: 35972905
doi: 10.1021/acs.inorgchem.2c01722
doi:
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM