Amorphous ices are usually classified as belonging to low-density or high-density
amorphous ice (LDA and HDA) with densities ρ LDA≈ 0.94 g/cm3 and ρ HDA≈ 1.15− 1.17 …

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 …

Multiple numerical studies have unambiguously shown the existence of a liquid–liquid
critical point in supercooled states for different numerical models of water, and various …

Water glasses have attracted considerable attention due to their potential connection to a
liquid–liquid transition in supercooled water. Here we use molecular simulations to …

We present in this paper a computational approach based on molecular dynamics
simulations and graph theory to characterize the structure of liquid water considering not …

Aqueous solution experiences either crystallization or vitrification as being cooled, yet the
mechanism of this bifurcation is confused. Since the glass-transition temperature T g is much …

In this paper, we apply a theoretical model for fluid state thermodynamics to investigate
simulated water in supercooled conditions. This model, which we recently proposed and …

The most accepted origin for the water anomalous behavior is the phase transition between
two liquids (LLPT) in the supercooled regime connected to the glassy first order phase …

Despite its ubiquitous nature, the atomic structure of water in its liquid state is still
controversially debated. We use a combination of X-ray Raman scattering spectroscopy in …

We investigate the link between topology of the hydrogen bond network (HBN) and large-
scale density fluctuations in water from ambient conditions to the glassy state. We observe a …