Prediction of self-diffusion coefficient and shear viscosity of water and its binary mixtures with methanol and ethanol by molecular simulation

The shear viscosity of rigid water models

(2010) Miguel Angel González et al.   JOURNAL OF CHEMICAL PHYSICS

Are pressure fluctuation-based equilibrium methods really worse than nonequilibrium methods for calculating viscosities?

(2009) Ting Chen et al.   JOURNAL OF CHEMICAL PHYSICS

Anomalies in water as obtained from computer simulations of the TIP4P/2005 model: density maxima, and density, isothermal compressibility and heat capacity minima

(2009) Helena L. Pi et al.   MOLECULAR PHYSICS

What ice can teach us about water interactions: a critical comparison of the performance of different water models

(2008) C. Vega et al.   FARADAY DISCUSSIONS

Prediction of binary intermolecular potential parameters for use in modelling fluid mixtures

(2008) Andrew J. Haslam et al.   FLUID PHASE EQUILIBRIA

The importance of polarizability in the modeling of solubility: Quantifying the effect of solute polarizability on the solubility of small nonpolar solutes in popular models of water

(2008) Peter J. Dyer et al.   JOURNAL OF CHEMICAL PHYSICS

Clustering Dynamics in Water/Methanol Mixtures: A Nuclear Magnetic Resonance Study at 205 K

(2008) Carmelo Corsaro et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Prediction of Transport Properties by Molecular Simulation: Methanol and Ethanol and Their Mixture

(2008) Gabriela Guevara-Carrion et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Thermodynamic and structural properties of methanol–water solutions using nonadditive interaction models

(2007) Yang Zhong et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY