Publikationen in Zusammenarbeit mit Forschern von International Centre for Theoretical Physics (4)

2023

  1. The Oxygen Evolution Reaction at MoS2 Edge Sites: The Role of a Solvent Environment in DFT-Based Molecular Simulations

    Molecules, Vol. 28, Núm. 13

2020

  1. Why are MoS2 monolayers not a good catalyst for the oxygen evolution reaction?

    Applied Surface Science, Vol. 528

2017

  1. Hydrogen divacancy diffusion: A new perspective on H migration in MgH2 materials for energy storage

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 2, pp. 1174-1180

2016

  1. Improvement of Hydrogen Vacancy Diffusion Kinetics in MgH2 by Niobium- and Zirconium-Doping for Hydrogen Storage Applications

    Journal of Physical Chemistry C, Vol. 120, Núm. 9, pp. 4806-4812