Publicaciones (12) Publicaciones de ALEJANDRA GRANJA DEL RIO

2024

  1. Exploring the hydrogen and methane storage capacities of novel DUT MOFs at room temperature: A Grand Canonical Monte Carlo simulation study

    International Journal of Hydrogen Energy, Vol. 54, pp. 665-677

  2. Grand Canonical Monte Carlo simulations of hydrogen and methane storage capacities of two novel Al-nia MOFs at room temperature

    International Journal of Hydrogen Energy, Vol. 50, pp. 685-696

  3. Grand Canonical Monte Carlo simulations of the hydrogen and methane storage capacities of JLU-MOF120 and JLU-MOF121

    International Journal of Hydrogen Energy, Vol. 61, pp. 57-72

  4. Insights into hydrogen and methane storage capacities: Grand canonical Monte Carlo simulations of SIGSUA

    Journal of Chemical Physics, Vol. 160, Núm. 15

2021

  1. Absence of spillover of hydrogen adsorbed on small palladium clusters anchored to graphene vacancies

    Applied Surface Science, Vol. 559

2019

  1. DFT-Based Global Optimization of Sub-nanometer Ni-Pd Clusters

    Journal of Physical Chemistry C, Vol. 123, Núm. 43, pp. 26583-26596

  2. Dynamics of Cluster Isomerization Induced by Hydrogen Adsorption

    Journal of Physical Chemistry C, Vol. 123, Núm. 24, pp. 15236-15243

2017

  1. Adsorption and growth of palladium clusters on graphdiyne

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 29, pp. 19094-19102

  2. Competition between Palladium Clusters and Hydrogen to Saturate Graphene Vacancies

    Journal of Physical Chemistry C, Vol. 121, Núm. 20, pp. 10843-10850

  3. Steric and chemical effects on the hydrogen adsorption and dissociation on free and graphene–supported palladium clusters

    Computational and Theoretical Chemistry, Vol. 1107, pp. 23-29

2015

  1. Competition between molecular and dissociative adsorption of hydrogen on palladium clusters deposited on defective graphene

    RSC Advances, Vol. 5, Núm. 59, pp. 47945-47953

  2. Interaction of hydrogen with palladium clusters deposited on graphene

    AIP Conference Proceedings