Publications by the researcher in collaboration with Inés Corral Pérez (2)

2019

  1. Nonadiabatic scattering of NO off Au3 clusters: A simple and robust diabatic state manifold generation method for multiconfigurational wavefunctions

    Journal of Computational Chemistry, Vol. 40, Núm. 6, pp. 794-810

2018

  1. Molecular Modelling of the H2-Adsorptive Properties of Tetrazolate-Based Metal−Organic Frameworks: From the Cluster Approach to Periodic Simulations

    ChemPhysChem, Vol. 19, Núm. 11, pp. 1349-1357