Publikationen in Zusammenarbeit mit Forschern von Consejo Superior de Investigaciones Científicas (6)

2015

  1. Comparing Quasiparticle H2O Level Alignment on Anatase and Rutile TiO2

    ACS Catalysis, Vol. 5, Núm. 7, pp. 4242-4254

2014

  1. Quasiparticle level alignment for photocatalytic interfaces

    Journal of Chemical Theory and Computation, Vol. 10, Núm. 5, pp. 2103-2113

2013

  1. Gold and methane: A noble combination for delicate oxidation

    Journal of Physical Chemistry Letters, Vol. 4, Núm. 17, pp. 3006-3012

  2. Level alignment of a prototypical photocatalytic system: Methanol on TiO2(110)

    Journal of the American Chemical Society, Vol. 135, Núm. 31, pp. 11429-11432

2005

  1. Differential virial theorem in relation to a sum rule for the exchange-correlation force in density-functional theory

    Journal of Chemical Physics, Vol. 123, Núm. 19

2003

  1. Band structure of boron doped carbon nanotubes

    MOLECULAR NANOSTRUCTURES