176 citations · 602 across the 9 of their papers we have counts for
9 papers
Fragile to strong crossover coupled to liquid-liquid transition in hydrophobic solutions
D. Corradini, P. Gallo, S. V. Buldyrev +1
Using discrete molecular dynamics simulations we study the relation between the thermodynamic and diffusive behaviors of a primitive model of aqueous solutions of hydrophobic solut…
Structural Properties of High and Low Density Water in a Supercooled Aqueous Solution of Salt
D. Corradini, M. Rovere, P. Gallo
We consider and compare the structural properties of bulk TIP4P water and of a sodium chloride aqueous solution in TIP4P water with concentration c = 0.67 mol/kg, in the metastable…
Thermodynamic behaviour and structural properties of an aqueous sodium chloride solution upon supercooling
D. Corradini, P. Gallo, M. Rovere
We present the results of a molecular dynamics simulation study of thermodynamic and structural properties upon supercooling of a low concentration sodium chloride solution in TIP4…
Confined water in the low hydration regime
P. Gallo, M. Rapinesi, M. Rovere
Molecular dynamics results on water confined in a silica pore in the low hydration regime are presented. Strong layering effects are found due to the hydrophilic character of the s…
Stretched exponential relaxation in a diffusive lattice model
C. Fusco, P. Gallo, A. Petri +1
We studied the single dimer dynamics in a lattice diffusive model as a function of particle density in the high densification regime. The mean square displacement is found to be su…
Layer Analysis of the Structure of Water Confined in Vycor Glass
P. Gallo, M. A. Ricci, M. Rovere
A Molecular Dynamics simulation of the microscopic structure of water confined in a silica pore is presented. A single cavity in the silica glass has been modeled as to reproduce t…
Random sequential adsorption and diffusion of dimers and k-mers on a square lattice
C. Fusco, P. Gallo, A. Petri +1
We have performed extensive simulations of random sequential adsorption and diffusion of -mers, up to in two dimensions with particular attention to the case . We foc…
Glass transition and layering effects in confined water: a computer simulation study
P. Gallo, M. Rovere, E. Spohr
Single particle dynamics of water confined in a nanopore is studied through Computer Molecular Dynamics. The pore is modeled to represent the average properties of a pore of Vycor…
Non-exponential kinetic behavior of confined water
P. Gallo, M. Rovere, M. A. Ricci +2
We present the results of molecular dynamics simulations of SPC/E water confined in a realistic model of a silica pore. The single-particle dynamics have been studied at ambient te…