Although the Hertz-Knudsen (HK) relation is often used to correlate evaporation data, the
relation contains two empirical parameters (the evaporation and condensation coefficients) …

Given the importance of water and its welldiscussed anomalies, there are a large number of
monographs, 1-4 reviews, 5, 6 and even popular literature7 that cover a much broader …

Over the last forty years many computer simulations of water have been performed using
rigid non-polarizable models. Since these models describe water interactions in an …

We consider the calculation of the surface tension from simulations of several models of
water, such as the traditional TIP3P, SPC, SPC/E, and TIP4P models, and the new …

Due to its ubiquity in our environment (near or far remote) water is the most investigated
liquid of the literature. Since the advent of molecular simulations in the sixties the key point …

The performance of several popular water models (TIP3P, TIP4P, TIP5P and TIP4P/2005) is
analyzed. For that purpose the predictions for ten different properties of water are …

We present an overview of progress in understanding the behavior of water in porous
carbons at the molecular level. We survey experimental investigations, semi-empirical …

Page 1 Molecular Simulation of Fluids Theory, Algorithms and Object-Orientation Simulation
Monte Carlo Ensemble {abstract} 2.0 1.5 ab C 1.0- 0.5 u* NVE_Ensemble 0.0 -0.5 T Atom …

The melting temperature of ice I h for several commonly used models of water (SPC, SPC/E,
TIP3P, TIP4P, TIP4P/Ew, and TIP5P) is obtained from computer simulations at p= 1 bar⁠ …

This article presents an overview of Monte Carlo methods for simulations of the phase
behaviour of fluids. The Gibbs ensemble method and histogram-reweighting Monte Carlo …