Publicaciones en colaboración con investigadores/as de Uppsala University (5)

2011

  1. A theoretical study of semiclassic models: Toward a quantum mechanical representation of chemical processes

    International Journal of Quantum Chemistry, Vol. 111, Núm. 2, pp. 263-271

2007

  1. Electronic excitations of 1,4-disilyl-substituted 1,4-disilabicycloalkanes: A MS-CASPT2 study of the influence of cage size

    Journal of Physical Chemistry A, Vol. 111, Núm. 14, pp. 2804-2810

  2. Scope and limitations of Baird's theory on triplet state aromaticity: Application to the tuning of singlet-triplet energy gaps in fulvenes

    Chemistry - A European Journal, Vol. 13, Núm. 24, pp. 6998-7005

2005

  1. Z/E-photoisomerizations of olefins with 4nπ- or (4n + 2)π-electron substituents: Zigzag variations in olefin properties along the T1 state energy surfaces

    Journal of Organic Chemistry, Vol. 70, Núm. 23, pp. 9495-9504

2004

  1. Fulvenes, fulvalenes, and azulene: Are they aromatic chameleons?

    Journal of the American Chemical Society, Vol. 126, Núm. 43, pp. 13938-13939