Publicaciones en las que colabora con Miguel Alvarez Blanco (23)

2008

  1. Buckling in wurtzite-like AlN nanostructures and crystals: Why nano can be different

    CMES - Computer Modeling in Engineering and Sciences, Vol. 24, Núm. 2-3, pp. 143-156

  2. Theoretical simulation of AlN nanocrystals

    Journal of Physical Chemistry C, Vol. 112, Núm. 17, pp. 6667-6676

2007

  1. Comparison of direct and flow integration based charge density population analyses

    Journal of Physical Chemistry A, Vol. 111, Núm. 48, pp. 12146-12151

  2. Topology and Properties of the Electron Density in Solids

    The Quantum Theory of Atoms in Molecules: From Solid State to DNA and Drug Design (Wiley-VCH Verlag GmbH & Co. KGaA), pp. 207-229

2006

  1. First principles study of neutral and anionic (medium-size) aluminum nitride clusters: AlnNn, n = 7-16

    Journal of Physical Chemistry B, Vol. 110, Núm. 9, pp. 4092-4098

2005

  1. Energetics and migration of point defects in Ga2O3

    Physical Review B - Condensed Matter and Materials Physics, Vol. 72, Núm. 18

  2. Evolution of the properties of AlnNn clusters with size

    Journal of Physical Chemistry B, Vol. 109, Núm. 51, pp. 24352-24360

2004

  1. Effect of dielectric polarization on the properties of charged point defects in insulating crystals: The nitrogen vacancy in AlN

    Journal of Physics Condensed Matter, Vol. 16, Núm. 20, pp. 3371-3378

  2. Theoretical study of the group-IV antisite acceptor defects in CdGeAs 2

    Applied Physics Letters

  3. Topological properties of the electron density of solids and molecules. Recent developments in Oviedo

    Acta Crystallographica Section A: Foundations of Crystallography, Vol. 60, Núm. 5, pp. 434-437

  4. Universal Features of the Topological Bond Properties of the Electron Density

    Journal of Physical Chemistry A, Vol. 108, Núm. 14, pp. 2794-2801

2003

  1. Non-nuclear maxima of the electron density on alkaline metals

    Journal of Chemical Physics, Vol. 119, Núm. 12, pp. 6341-6350

2002

  1. Chemical bonding in group III nitrides

    Journal of the American Chemical Society, Vol. 124, Núm. 15, pp. 4116-4123

2000

  1. First Principles Study of Polyatomic Clusters of AlN, GaN, and InN. 1. Structure, Stability, Vibrations, and Ionization

    Journal of Physical Chemistry B, Vol. 104, Núm. 18, pp. 4361-4367

  2. First Principles Study of Polyatomic Clusters of AlN, GaN, and InN. 2. Chemical Bonding

    Journal of Physical Chemistry B, Vol. 104, Núm. 18, pp. 4368-4374

  3. Ions in crystals: The topology of the electron density in ionic materials. V. The B1-B2 phase transition in alkali halides

    Physical Review B - Condensed Matter and Materials Physics, Vol. 62, Núm. 18, pp. 12028-12039

  4. Local compressibilities in crystals

    Physical Review B - Condensed Matter and Materials Physics, Vol. 62, Núm. 21, pp. 13970-13978

  5. Theoretical characterization of the high-pressure phases

    Physical Review B - Condensed Matter and Materials Physics, Vol. 61, Núm. 17, pp. 11359-11362

  6. Theoretical study of native and rare-earth defect complexes in β

    Physical Review B - Condensed Matter and Materials Physics, Vol. 62, Núm. 2, pp. 803-809

  7. Transition path for the B3⇌B1 phase transformation in semiconductors

    Physical Review B - Condensed Matter and Materials Physics, Vol. 62, Núm. 16, pp. R10599-R10602