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Hydrogen Bond Dynamics and Phase Transitions of Water inside Carbon Nanotubes

Water dynamics in nanochannels are altered by confinement, particularly in small carbon nanotubes (CNTs). However, the mechanisms behind these effects remain unclear. To address these issues, we carried out extensive molecular dynamics (MD) simulations to investigate the structure and dynamics of wa...

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Detalles Bibliográficos
Autores principales: Srivastava, Amit, Hassan, Jamal, Homouz, Dirar
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9866512/
https://www.ncbi.nlm.nih.gov/pubmed/36678038
http://dx.doi.org/10.3390/nano13020284