ABSTRACT: 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 supercooled region. In a previous paper (Corradini, D.; Rovere,M.; Gallo, P. J. Chem. Phys. 2010, 132, 134508) we found in both systems the presence of a liquid-liquid critical point (LLCP). The LLCP is believed to be the end point of the coexistence line be-tween a high density liquid (HDL) and a low density liquid (LDL) phase of water. In the present paper we study the different features of water-water structure in HDL and LDL both in bulk water and in the solution.We find that the ions are able tomodify the bulk LDL structure, rendering water-water s...
In this paper we investigate the possibility to detect the hypothesized liquid-liquid critical point...
In this paper we compare recent results obtained by means of molecular dynamics computer simulations...
In this paper we compare recent results obtained by means of molecular dynamics computer simulation...
"We consider and compare the structural properties of bulk TIP4P water and of a sodium chloride aque...
The polymorphic nature of supercooled water is a topic of wide interest where many open questions ar...
summary:The progress in investigation of ordinary water in several last years is discussed in the ar...
We present the results of a molecular dynamics simulation study of thermodynamic and structural prop...
We present the results of a molecular dynamics simulation study of thermodynamic and structural prop...
Abstract Solutions at sub- or supercritical conditions receive much attention due to its significanc...
It has long been appreciated that water, the most important of all liquids, defies description in te...
We investigate using molecular dynamics simulations the dynamical and structural properties of LiCl:...
The complex behavior of liquid water, along with its anomalies and their crucial role in the existen...
"Molecular dynamics results are presented for bulk TIP4P water and for aqueous solutions of sodium c...
This dissertation addresses the anomalous properties of water at high temperatures near the vapor-li...
A longstanding question in water research is the possibility that supercooled liquid water can under...
In this paper we investigate the possibility to detect the hypothesized liquid-liquid critical point...
In this paper we compare recent results obtained by means of molecular dynamics computer simulations...
In this paper we compare recent results obtained by means of molecular dynamics computer simulation...
"We consider and compare the structural properties of bulk TIP4P water and of a sodium chloride aque...
The polymorphic nature of supercooled water is a topic of wide interest where many open questions ar...
summary:The progress in investigation of ordinary water in several last years is discussed in the ar...
We present the results of a molecular dynamics simulation study of thermodynamic and structural prop...
We present the results of a molecular dynamics simulation study of thermodynamic and structural prop...
Abstract Solutions at sub- or supercritical conditions receive much attention due to its significanc...
It has long been appreciated that water, the most important of all liquids, defies description in te...
We investigate using molecular dynamics simulations the dynamical and structural properties of LiCl:...
The complex behavior of liquid water, along with its anomalies and their crucial role in the existen...
"Molecular dynamics results are presented for bulk TIP4P water and for aqueous solutions of sodium c...
This dissertation addresses the anomalous properties of water at high temperatures near the vapor-li...
A longstanding question in water research is the possibility that supercooled liquid water can under...
In this paper we investigate the possibility to detect the hypothesized liquid-liquid critical point...
In this paper we compare recent results obtained by means of molecular dynamics computer simulations...
In this paper we compare recent results obtained by means of molecular dynamics computer simulation...