Publicacions en col·laboració amb investigadors/es de University of Vienna (3)

2020

  1. Competing ultrafast photoinduced electron transfer and intersystem crossing of [Re(CO) 3 (Dmp)(His124)(Trp122)] + in Pseudomonas aeruginosa azurin: a nonadiabatic dynamics study

    Theoretical Chemistry Accounts, Vol. 139, Núm. 3

2017

  1. Ab initio molecular dynamics of thiophene: The interplay of internal conversion and intersystem crossing

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 37, pp. 25662-25670

2016

  1. Benzophenone Ultrafast Triplet Population: Revisiting the Kinetic Model by Surface-Hopping Dynamics

    Journal of Physical Chemistry Letters, Vol. 7, Núm. 4, pp. 622-626