Critical behavior of a water monolayer under hydrophobic confinement


Autoria(s): Bianco, Valentino; Franzese, Giancarlo
Contribuinte(s)

Universitat de Barcelona

Resumo

The properties of water can have a strong dependence on the confinement. Here, we consider a water monolayer nanoconfined between hydrophobic parallel walls under conditions that prevent its crystallization. We investigate, by simulations of a many-body coarse-grained water model, how the properties of the liquid are affected by the confinement. We show, by studying the response functions and the correlation length and by performing finite-size scaling of the appropriate order parameter, that at low temperature the monolayer undergoes a liquid-liquid phase transition ending in a critical point in the universality class of the two-dimensional (2D) Ising model. Surprisingly, by reducing the linear size L of the walls, keeping the walls separation h constant, we find a 2D-3D crossover for the universality class of the liquid-liquid critical point for L/h=~50, i.e. for a monolayer thickness that is small compared to its extension. This result is drastically different from what is reported for simple liquids, where the crossover occurs for , and is consistent with experimental results and atomistic simulations. We shed light on these findings showing that they are a consequence of the strong cooperativity and the low coordination number of the hydrogen bond network that characterizes water.

Identificador

http://hdl.handle.net/2445/65592

Idioma(s)

eng

Publicador

Nature Publishing Group

Direitos

cc-by-nc-nd (c) Bianco, Valentino et al., 2014

info:eu-repo/semantics/openAccess

<a href="http://creativecommons.org/licenses/by-nc-nd/3.0/es">http://creativecommons.org/licenses/by-nc-nd/3.0/es</a>

Palavras-Chave #Termodinàmica #Transformacions de fase (Física estadística) #Fenòmens crítics (Física) #Thermodynamics #Phase transformations (Statistical physics) #Critical phenomena (Physics)
Tipo

info:eu-repo/semantics/article

info:eu-repo/semantics/publishedVersion