FELIPE JIMENEZ BLAS-rekin lankidetzan egindako argitalpenak (43)

2024

  1. Rotationally invariant local bond order parameters for accurate determination of hydrate structures

    Molecular Physics

  2. Three-phase equilibria of hydrates from computer simulation. I. Finite-size effects in the methane hydrate

    The Journal of chemical physics, Vol. 160, Núm. 16

  3. Three-phase equilibria of hydrates from computer simulation. II. Finite-size effects in the carbon dioxide hydrate

    The Journal of chemical physics, Vol. 160, Núm. 16

  4. Three-phase equilibria of hydrates from computer simulation. III. Effect of dispersive interactions in the methane and carbon dioxide hydrates

    The Journal of chemical physics, Vol. 160, Núm. 16

2023

  1. Effect of pressure on the carbon dioxide hydrate-water interfacial free energy along its dissociation line

    The Journal of chemical physics, Vol. 158, Núm. 19

  2. Homogeneous nucleation rate of methane hydrate formation under experimental conditions from seeding simulations

    Journal of Chemical Physics, Vol. 158, Núm. 11

  3. Interfacial properties of square-well chains from molecular dynamics simulation

    Molecular Physics, Vol. 121, Núm. 19-20

  4. Solubility of carbon dioxide in water: Some useful results for hydrate nucleation

    Journal of Chemical Physics, Vol. 158, Núm. 18

2022

  1. Density functional theory for the prediction of interfacial properties of molecular fluids within the SAFT-γ coarse-grained approach

    RSC Advances, Vol. 12, Núm. 29, pp. 18821-18833

  2. Molecular dynamics of liquid-liquid equilibrium and interfacial properties of aqueous solutions of methyl esters

    Physical Chemistry Chemical Physics, Vol. 24, Núm. 9, pp. 5371-5382

  3. Simulation of the CO2 hydrate-water interfacial energy: The mold integration-guest methodology

    The Journal of chemical physics, Vol. 157, Núm. 13, pp. 134709

  4. Simulation of the carbon dioxide hydrate-water interfacial energy

    Journal of Colloid and Interface Science, Vol. 623, pp. 354-367

  5. Solubility of Methane in Water: Some Useful Results for Hydrate Nucleation

    The journal of physical chemistry. B, Vol. 126, Núm. 42, pp. 8553-8570

2021

  1. Phase equilibria and interfacial properties of selected methane + n-alkane binary mixtures

    Journal of Molecular Liquids, Vol. 341

2020

  1. Molecular modelling techniques for predicting liquid-liquid interfacial properties of methanol plus alkane (: N-hexane, n-heptane, n-octane) mixtures

    Physical Chemistry Chemical Physics, Vol. 22, Núm. 46, pp. 27121-27133

  2. Preferential Orientations and Anomalous Interfacial Tensions in Aqueous Solutions of Alcohols

    Journal of Physical Chemistry B, Vol. 124, Núm. 38, pp. 8388-8401

  3. Vapour-liquid phase equilibria and interfacial properties of fatty acid methyl esters from molecular dynamics simulations

    Physical Chemistry Chemical Physics, Vol. 22, Núm. 9, pp. 4974-4983

2019

  1. An accurate density functional theory for the vapor-liquid interface of chain molecules based on the statistical associating fluid theory for potentials of variable range for Mie chainlike fluids

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 22, pp. 11937-11948

  2. 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

  3. 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