Publicacións nas que colabora con HADRIAN MONTES CAMPOS (13)

2024

  1. Size Matters: A Computational Study of Hydrogen Absorption in Ionic Liquids

    Journal of Chemical Information and Modeling, Vol. 64, Núm. 1, pp. 164-177

2023

  1. Effect of Isomeric Alcohols on the Thermophysical Properties of Cyano-Based Ionic Liquids: Experimental and Simulation Studies

    Journal of Chemical and Engineering Data, Vol. 68, Núm. 8, pp. 1940-1952

  2. Interfacial structure of protic and aprotic ionic liquid-DMSO-Li salt mixtures near charged and neutral electrodes: A Molecular Dynamics study

    Journal of Molecular Liquids, Vol. 386

  3. Ionic liquid/metal salt mixtures at the graphene interface: A density functional theory approach

    Journal of Molecular Liquids, Vol. 392

  4. Mixtures of ethylammonium nitrate and ethylene carbonate: Bulk and interfacial analysis

    Journal of Molecular Liquids, Vol. 385

2022

  1. Density functional theory of alkali metals at the IL/graphene electrochemical interface

    Journal of Chemical Physics, Vol. 156, Núm. 1

  2. Evaluation of hydrogen storage ability of hydroquinone clathrates using molecular simulations

    Journal of Molecular Liquids, Vol. 360

  3. Role of Anions in 5-Hydroxymethylfurfural Solvation in Ionic Liquids from Molecular Dynamics Simulations

    Advanced Theory and Simulations, Vol. 5, Núm. 12

2020

  1. Ionic liquids nanoconfined in zeolite-templated carbon: A computational study

    Journal of Molecular Liquids, Vol. 318

2017

  1. Nanostructured solvation in mixtures of protic ionic liquids and long-chained alcohols

    Journal of Chemical Physics, Vol. 146, Núm. 12

  2. Two-dimensional pattern formation in ionic liquids confined between graphene walls

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 36, pp. 24505-24512

2016

  1. Molecular dynamics analysis of the effect of electronic polarization on the structure and single-particle dynamics of mixtures of ionic liquids and lithium salts

    Journal of Chemical Physics, Vol. 145, Núm. 20

  2. Molecular dynamics simulation of the behaviour of water in nano-confined ionic liquid-water mixtures

    Journal of Physics Condensed Matter, Vol. 28, Núm. 46