Molecular Rotations, Multiscale Order, Hyperuniformity, and Signatures of Metastability during the Compression/Decompression Cycles of Amorphous Ices.
Journal
The journal of physical chemistry. B
ISSN: 1520-5207
Titre abrégé: J Phys Chem B
Pays: United States
ID NLM: 101157530
Informations de publication
Date de publication:
04 May 2023
04 May 2023
Historique:
medline:
12
4
2023
pubmed:
12
4
2023
entrez:
11
4
2023
Statut:
ppublish
Résumé
We model, via large-scale molecular dynamics simulations, the isothermal compression of low-density amorphous ice (LDA) to generate high-density amorphous ice (HDA) and the corresponding decompression extending to negative pressures to recover the low-density amorphous phase (LDA
Identifiants
pubmed: 37039650
doi: 10.1021/acs.jpcb.3c00611
doi:
Types de publication
Journal Article
Langues
eng
Sous-ensembles de citation
IM