Argitalpenak (85) ANDRES AGUADO RODRIGUEZ argitalpenak

2020

  1. Incorporating charge transfer effects into a metallic empirical potential for accurate structure determination in (ZnMg): N nanoalloys

    Nanoscale, Vol. 12, Núm. 39, pp. 20432-20448

  2. Modeling the Electronic and Geometric Structure of Nanoalloys

    Nanoalloys: From Fundamentals to Emergent Applications, Second Edition (Elsevier), pp. 75-113

2019

  1. Computational characterisation of structure and metallicity in small neutral and singly-charged cadmium clusters

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 23, pp. 12321-12334

2016

  1. Nanoparticles: Neither solid nor liquid

    Nature Materials, Vol. 15, Núm. 9, pp. 931-933

2015

  1. A new magnetic superatom: Cr@Zn17

    Physical Chemistry Chemical Physics, Vol. 17, Núm. 42, pp. 28033-28043

  2. Insulating or metallic: Coexistence of different electronic phases in zinc clusters

    Angewandte Chemie - International Edition, Vol. 54, Núm. 7, pp. 2111-2115

  3. Structural, vibrational, and magnetic properties of FeCoOn0/+ (n = 1-6) bimetallic oxide clusters

    Journal of Physical Chemistry C, Vol. 119, Núm. 20, pp. 11200-11209

  4. Zn17 Superatom Cage Doped with 3d Transition-Metal (TM) Impurities (TM = Sc, Ti, V, Cr, Mn, Fe, Co, Ni, and Cu)

    Journal of Physical Chemistry C, Vol. 119, Núm. 49, pp. 27838-27847

2013

  1. An Orbital Free ab initio Method: Applications to Liquid Metals and Clusters

    Recent Progress in Orbital-free Density Functional Theory (World Scientific Publishing Co.), pp. 55-145

  2. Electronic shell and dynamical coexistence effects in the melting of aluminum clusters: An interpretation of the calorimetric experiments through computer simulation

    Journal of Physical Chemistry Letters, Vol. 4, Núm. 14, pp. 2397-2403

  3. Modeling the electronic and geometric structure of nanoalloys

    Nanoalloys (Elsevier Inc.), pp. 75-111

  4. Modeling the electronic and geometric structure of nanoalloys

    Nanoalloys: From Fundamentals to Emergent Applications (Elsevier), pp. 75-111

  5. Structures, relative stabilities, and electronic properties of potassium clusters Kn (13≤n≤80)

    Computational and Theoretical Chemistry, Vol. 1021, pp. 135-143