Publications in collaboration with researchers from Eindhoven University of Technology (66)

2024

  1. A comprehensive approach for doping selection and assessment in porous materials for hydrogen storage: CNTs study case

    Chemical Engineering Journal, Vol. 489

  2. A simulation study of linker vacancy distribution and its effect on UiO-66 stability

    Microporous and Mesoporous Materials, Vol. 366

  3. Adapted thermodynamical model for the prediction of adsorption in nanoporous materials

    Chemical Engineering Journal, Vol. 496

  4. Computing solubility and thermodynamic properties of H2O2 in water

    Journal of Molecular Liquids, Vol. 401

  5. Equivariant Parameter Sharing for Porous Crystalline Materials

    Lecture Notes in Computer Science (including subseries Lecture Notes in Artificial Intelligence and Lecture Notes in Bioinformatics)

  6. Halogen-Decorated Metal-Organic Frameworks for Efficient and Selective CO2 Capture, Separation, and Chemical Fixation with Epoxides under Mild Conditions

    ACS Applied Materials and Interfaces

  7. Hydrogen recovery from steam methane reforming using the ITQ-12 zeolite

    Separation and Purification Technology, Vol. 350

  8. Improving the Water Resistance of Bi-Based Perovskite-Inspired Materials for Vapor-Phase Photocatalytic Overall Water Splitting

    Solar RRL

  9. Mixing I and Br in Inorganic Perovskites: Atomistic Insights from Reactive Molecular Dynamics Simulations

    Journal of Physical Chemistry C, Vol. 128, Núm. 9, pp. 4111-4118

  10. The impact of metal centers in the M-MOF-74 series on carbon dioxide and hydrogen separation

    Separation and Purification Technology, Vol. 339

  11. Understanding the role of open metal sites in MOFs for the efficient separation of benzene/cyclohexane mixtures

    Separation and Purification Technology, Vol. 348