Publicaciones en las que colabora con Manuel Martínez Piñeiro (18)

2019

  1. Estudio de la compresibilidad de los hidratos de CH4 y CO2 mediante simulación molecular

    La investigación del Grupo Especializado de Termodinámica de las Reales Sociedades Españolas de Física y Química. Vol. 8, Año 2017

  2. Estudio del tetrahidrofurano mediante dinámica molecular: modelado y propiedades interfaciales

    La investigación del Grupo Especializado de Termodinámica de las Reales Sociedades Españolas de Física y Química. Vol. 8, Año 2017

  3. La investigación del Grupo Especializado de Termodinámica de las Reales Sociedades Españolas de Física y Química. Vol. 8, Año 2017

    Universidad de Huelva

  4. On the Physical Insight into the Barotropic Effect in the Interfacial Behavior for the H2O + CO2 Mixture

    Journal of Physical Chemistry C, Vol. 123, Núm. 46, pp. 28123-28130

2018

  1. Adsorption and interfacial phenomena of a Lennard-Jones fluid adsorbed in slit pores: DFT and GCMC simulations

    Molecular Physics, Vol. 116, Núm. 21-22, pp. 3417-3424

2017

  1. Computational study of the interplay between intermolecular interactions and CO2 orientations in type i hydrates

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 4, pp. 3384-3393

  2. Measurement and modeling of high pressure density and interfacial tension of carbon dioxide + tetrahydrofuran mixture

    Journal of Supercritical Fluids, Vol. 128, pp. 359-369

2016

  1. On interfacial properties of tetrahydrofuran: Atomistic and coarse-grained models from molecular dynamics simulation

    Journal of Chemical Physics, Vol. 144, Núm. 14

2015

  1. Molecular dynamics simulation of CO2 hydrates: Prediction of three phase coexistence line

    Journal of Chemical Physics, Vol. 142, Núm. 12

  2. Understanding the Phase Behavior of Tetrahydrofuran + Carbon Dioxide, + Methane, and + Water Binary Mixtures from the SAFT-VR Approach

    Journal of Physical Chemistry B, Vol. 119, Núm. 44, pp. 14288-14302

2014

  1. Comprehensive characterization of interfacial behavior for the mixture CO2 + H2O + CH4: Comparison between atomistic and coarse grained molecular simulation models and density gradient theory

    Journal of Physical Chemistry C, Vol. 118, Núm. 42, pp. 24504-24519

  2. Nonlocal density functional theory and grand canonical monte carlo molecular simulations of water adsorption in confined media

    Journal of Physical Chemistry C, Vol. 118, Núm. 43, pp. 24905-24914

2013

  1. Influence of the long-range corrections on the interfacial properties of molecular models using Monte Carlo simulation

    Journal of Chemical Physics, Vol. 138, Núm. 3

2012

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

    Journal of Chemical Physics, Vol. 136, Núm. 11

  2. Vapor-liquid interfacial properties of rigid-linear Lennard-Jones chains

    Journal of Chemical Physics, Vol. 137, Núm. 8

2011

  1. An examination of the ternary methane + carbon dioxide + water phase diagram using the SAFT-VR approach

    Journal of Physical Chemistry B, Vol. 115, Núm. 31, pp. 9604-9617

  2. Simultaneous application of the gradient theory and Monte Carlo molecular simulation for the investigation of methane/water interfacial properties

    Journal of Physical Chemistry B, Vol. 115, Núm. 31, pp. 9618-9625

2010

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

    Journal of Chemical Physics, Vol. 132, Núm. 18