Publikationen in Zusammenarbeit mit Forschern von University of Ferrara (3)

2019

  1. OpenMolcas: From Source Code to Insight

    Journal of Chemical Theory and Computation, Vol. 15, Núm. 11, pp. 5925-5964

2014

  1. Shape of multireference, equation-of-motion coupled-cluster, and density functional theory potential energy surfaces at a conical intersection

    Journal of Chemical Theory and Computation, Vol. 10, Núm. 8, pp. 3074-3084

2010

  1. Modeling, preparation, and characterization of a dipole moment switch driven by Z/E photoisomerization

    Journal of the American Chemical Society, Vol. 132, Núm. 27, pp. 9310-9319