Publications by the researcher in collaboration with Massimo Olivucci (13)

2019

  1. OpenMolcas: From Source Code to Insight

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

2016

  1. Molcas 8: New capabilities for multiconfigurational quantum chemical calculations across the periodic table

    Journal of Computational Chemistry, Vol. 37, Núm. 5, pp. 506-541

  2. Probing the Photodynamics of Rhodopsins with Reduced Retinal Chromophores

    Journal of Chemical Theory and Computation, Vol. 12, Núm. 2, pp. 839-850

2015

  1. Directionality of double-bond photoisomerization dynamics induced by a single stereogenic center

    Journal of Physical Chemistry Letters, Vol. 6, Núm. 4, pp. 599-604

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

2008

  1. Relationship between the excited state relaxation paths of rhodopsin and isorhodopsin

    Journal of the American Chemical Society, Vol. 130, Núm. 11, pp. 3382-3388

2007

  1. The role of intersection space segments in photochemical reactions

    AIP Conference Proceedings

  2. The role of the intersection space in the photochemistry of tricyclo[3.3.0.02,6]octa-3,7-diene

    Journal of Physical Chemistry A, Vol. 111, Núm. 15, pp. 2830-2838

  3. Tracking the excited-state time evolution of the visual pigment with multiconfigurational quantum chemistry

    Proceedings of the National Academy of Sciences of the United States of America, Vol. 104, Núm. 19, pp. 7764-7769

2002

  1. Cyclooctatetraene computational photo- and thermal chemistry: A reactivity model for conjugated hydrocarbons

    Journal of the American Chemical Society, Vol. 124, Núm. 46, pp. 13770-13789