On interfacial tension calculation from the test-area methodology in the grand canonical ensemble

Surface tension of water–alcohol mixtures from Monte Carlo simulations

(2011) F. Biscay et al.   JOURNAL OF CHEMICAL PHYSICS

An Examination of the Ternary Methane + Carbon Dioxide + Water Phase Diagram using the SAFT-VR Approach

(2011) J. M. Míguez et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Simultaneous Application of the Gradient Theory and Monte Carlo Molecular Simulation for the Investigation of Methane/Water Interfacial Properties

(2011) Christelle Miqueu et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Simulation of binary fluids exposed to selectively adsorbing walls: a method to estimate contact angles and line tensions

(2011) Subir K. Das et al.   MOLECULAR PHYSICS

Classical density functional theory for the prediction of the surface tension and interfacial properties of fluids mixtures of chain molecules based on the statistical associating fluid theory for potentials of variable range

(2010) Fèlix Llovell et al.   JOURNAL OF CHEMICAL PHYSICS

Calculation of interfacial properties using molecular simulation with the reaction field method: Results for different water models

(2010) J. M. Míguez et al.   JOURNAL OF CHEMICAL PHYSICS

Interfacial Properties of Water/CO2: A Comprehensive Description through a Gradient Theory−SAFT-VR Mie Approach

(2010) Thomas Lafitte et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Subtleties in the calculation of the pressure and pressure tensor of anisotropic particles from volume-perturbation methods and the apparent asymmetry of the compressive and expansive contributions

(2010) Paul E. Brumby et al.   MOLECULAR PHYSICS

Interfacial properties of the Mie n−6 fluid: Molecular simulations and gradient theory results

(2009) Guillaume Galliero et al.   JOURNAL OF CHEMICAL PHYSICS

Monte Carlo calculation of the methane-water interfacial tension at high pressures

(2009) F. Biscay et al.   JOURNAL OF CHEMICAL PHYSICS

Calculation of the surface tension from Monte Carlo simulations: Does the model impact on the finite-size effects?

(2009) F. Biscay et al.   JOURNAL OF CHEMICAL PHYSICS

Vapor-liquid interfacial properties of fully flexible Lennard-Jones chains

(2008) Felipe J. Blas et al.   JOURNAL OF CHEMICAL PHYSICS

Computation of Surface Tensions Using Expanded Ensemble Simulations

(2008) Enrique de Miguel   JOURNAL OF PHYSICAL CHEMISTRY B

Some universal trends of the Mie() fluid thermodynamics

(2008) Pedro Orea et al.   PHYSICS LETTERS A