2003

1. Assessment of the reliability of the Perdew-Burke-Ernzerhof functionals in the determination of torsional potentials in π-conjugated molecules

   Chemical Physics Letters, Vol. 377, Núm. 1-2, pp. 63-68

2. Effect of an external electric field on the charge transport parameters in organic molecular semiconductors

   Journal of Chemical Physics, Vol. 119, Núm. 23, pp. 12563-12568

3. Electronic and optical properties of polyfluorene and fluorene-based copolymers: A quantum-chemical characterization

   Journal of Chemical Physics, Vol. 118, Núm. 14, pp. 6615-6623