Publicaciones en las que colabora con EMILIO SAN FABIAN MAROTO (21)

2024

  1. Long-Range Effects in Topologically Defective Arm-Chair Graphene Nanoribbons

    Nanomaterials, Vol. 14, Núm. 9

2019

  1. Electron enrichment of zigzag edges of armchair–oriented graphene nano–ribbons increases their stability and induces pinning of Fermi level

    Carbon, Vol. 154, pp. 211-218

  2. Transport and optical gaps in amorphous organic molecular materials

    Molecules, Vol. 24, Núm. 3

2018

  1. Conductance through the armchair graphene nanoribbons 9-AGNR: Strong dependence on contact to leads

    Physical Review B, Vol. 98, Núm. 15

2017

  1. Are Electron Affinity and Ionization Potential Intrinsic Parameters to Predict the Electron or Hole Acceptor Character of Amorphous Molecular Materials?

    Journal of Physical Chemistry Letters

2016

  1. Herringbone Pattern and CH–π Bonding in the Crystal Architecture of Linear Polycyclic Aromatic Hydrocarbons

    ChemPhysChem, Vol. 17, Núm. 21, pp. 3548-3557

2015

  1. Can model Hamiltonians describe the electron-electron interaction in π-conjugated systems?: PAH and graphene

    Journal of Physics Condensed Matter, Vol. 27, Núm. 46

  2. Modeling nanocontacts and nanowires with molecular dynamics

    Recent advances within the field of materials science in Spain (Servicio de Publicaciones), pp. 237

2014

  1. Role of potassium orbitals in the metallic behavior of K3 picene

    Physical Review B - Condensed Matter and Materials Physics, Vol. 90, Núm. 3

2013

  1. Exponential decay of spin-spin correlation between distant defect states produced by contour hydrogenation of polycyclic aromatic hydrocarbon molecules

    Physical Review B - Condensed Matter and Materials Physics, Vol. 87, Núm. 12

2012

  1. Spin alignment of extra electrons in K-phenanthrene clusters taken from the crystalline tripotassium-intercalated phenanthrene structure

    Physical Review B - Condensed Matter and Materials Physics, Vol. 85, Núm. 16

2011

  1. Abnormal stress drop at the yield point of aluminum nanowires: A molecular dynamics study

    Physical Review B - Condensed Matter and Materials Physics, Vol. 83, Núm. 16

  2. PPP Hamiltonian for polar polycyclic aromatic hydrocarbons

    European Physical Journal B, Vol. 81, Núm. 2, pp. 253-262

2010

  1. Erratum: Hubbard hamiltonian for the hydrogen molecule (Physical Review B - Condensed Matter and Materials Physics (2007) 75 (195104))

    Physical Review B - Condensed Matter and Materials Physics

  2. Fit of pariser-parr-pople and hubbard model Hamiltonians to charge and spin states of polycyclic aromatic hydrocarbons

    Physical Review B - Condensed Matter and Materials Physics, Vol. 81, Núm. 8

2009

  1. Magnetic molecules created by hydrogenation of polycyclic aromatic hydrocarbons

    Physical Review B - Condensed Matter and Materials Physics, Vol. 79, Núm. 9

  2. Magnetism in hydro- and dehydrogenated benzene

    Physica Status Solidi (C) Current Topics in Solid State Physics

  3. Non-Gaussian tails in the probability distribution function of heat exchanged during isothermal stretching of aluminum and gold nanowires

    Physical Review E - Statistical, Nonlinear, and Soft Matter Physics, Vol. 80, Núm. 3

  4. On the stress-strain curves in gold and aluminum nanowires

    Physica Status Solidi (C) Current Topics in Solid State Physics

2008

  1. Stress-strain curves of aluminum nanowires: Fluctuations in the plastic regime and absence of hardening

    Physical Review B - Condensed Matter and Materials Physics, Vol. 78, Núm. 15