Publicaciones en las que colabora con Duncan John Mowbray (23)

2016

  1. Disentangling Vacancy Oxidation on Metallicity-Sorted Carbon Nanotubes

    Journal of Physical Chemistry C, Vol. 120, Núm. 32, pp. 18316-18322

  2. Photoinduced absorption within single-walled carbon nanotube systems

    Journal of Physical Chemistry C, Vol. 120, Núm. 3, pp. 1926-1935

2015

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

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

2014

  1. Gas sensing and thermal transport through carbon-nanotube-based nanodevices

    Challenges and Advances in Computational Chemistry and Physics (Springer), pp. 99-136

  2. Modelling the effect of nuclear motion on the attosecond time-resolved photoelectron spectra of ethylene

    Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 47, Núm. 12

  3. PFO-BPy solubilizers for SWNTs: Modelling of polymers from oligomers

    Physica Status Solidi (B) Basic Research, Vol. 251, Núm. 12, pp. 2407-2412

  4. Photoinduced C-C reactions on insulators toward photolithography of graphene nanoarchitectures

    Journal of the American Chemical Society, Vol. 136, Núm. 12, pp. 4651-4658

  5. Quasiparticle level alignment for photocatalytic interfaces

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

  6. Revealing the adsorption mechanisms of nitroxides on ultrapure, metallicity-sorted carbon nanotubes

    ACS Nano, Vol. 8, Núm. 2, pp. 1375-1383

  7. Time-dependent density-functional theory of strong-field ionization of atoms by soft x rays

    Physical Review A - Atomic, Molecular, and Optical Physics, Vol. 90, Núm. 3

2013

  1. Direct imaging of covalent bond structure in single-molecule chemical reactions

    Science, Vol. 340, Núm. 6139, pp. 1434-1437

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

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

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

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

  4. Understanding energy-level alignment in donor-acceptor/metal interfaces from core-level shifts

    ACS Nano, Vol. 7, Núm. 8, pp. 6914-6920

2012

  1. Anomalous insulator-metal transition in boron nitride-graphene hybrid atomic layers

    Physical Review B - Condensed Matter and Materials Physics, Vol. 86, Núm. 7

  2. Channeling of charge carrier plasmons in carbon nanotubes

    Physical Review B - Condensed Matter and Materials Physics, Vol. 85, Núm. 8

  3. Supramolecular environment-dependent electronic properties of metal-Organic interfaces

    Journal of Physical Chemistry C, Vol. 116, Núm. 7, pp. 4780-4785

  4. Understanding charge transfer in donor-acceptor/metal systems: A combined theoretical and experimental study

    Journal of Physical Chemistry C, Vol. 116, Núm. 34, pp. 17991-18001

2011

  1. Tailoring electronic and optical properties of TiO2: Nanostructuring, doping and molecular-oxide interactions

    Computational Studies of New Materials II: From Ultrafast Processes and Nanostructures to Optoelectronics, Energy Storage and Nanomedicine (World Scientific Publishing Co.), pp. 301-330

2010

  1. A combined photoemission and ab initio study of the electronic structure of (6,4)/(6,5) enriched single wall carbon nanotubes

    Physica Status Solidi (B) Basic Research, Vol. 247, Núm. 11-12, pp. 2875-2879