Publicaciones en colaboración con investigadoras/es de Donostia International Physics Center (126)

2024

  1. Two-dimensional heavy fermions in the van der Waals metal CeSiI

    Nature, Vol. 625, Núm. 7995, pp. 483-488

2023

  1. Electronic Descriptors for Supervised Spectroscopic Predictions

    Journal of Chemical Theory and Computation, Vol. 19, Núm. 6, pp. 1818-1826

2022

  1. Spin-orbit induced equilibrium spin currents in materials

    Physical Review B, Vol. 105, Núm. 2

2019

  1. Orbital magneto-optical response of periodic insulators from first principles

    npj Computational Materials, Vol. 5, Núm. 1

2016

  1. Imaging single-molecule reaction intermediates stabilized by surface dissipation and entropy

    Nature Chemistry, Vol. 8, Núm. 7, pp. 678-683

  2. Noncovalent Dimerization after Enediyne Cyclization on Au(111)

    Journal of the American Chemical Society, Vol. 138, Núm. 34, pp. 10963-10967

2014

  1. First-principles description of charge transfer in donor-acceptor compounds from self-consistent many-body perturbation theory

    Physical Review B - Condensed Matter and Materials Physics, Vol. 90, Núm. 8

  2. High-energy collective electronic excitations in layered transition-metal dichalcogenides

    Physical Review B - Condensed Matter and Materials Physics, Vol. 90, Núm. 12

  3. Stable two-dimensional dumbbell stanene: A quantum spin Hall insulator

    Physical Review B - Condensed Matter and Materials Physics, Vol. 90, Núm. 12

2013

  1. Atomic and electronic properties of quasi-one-dimensional MoS2 nanowires

    Journal of Materials Research, Vol. 28, Núm. 2, pp. 240-249

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

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

  3. Dynamics of charge-transfer processes with time-dependent density functional theory

    Journal of Physical Chemistry Letters, Vol. 4, Núm. 5, pp. 735-739

  4. Explicit form of Pauli potential for direct derivation of pair density from a two-particle differential equation for the quintet state of four electrons with harmonic interparticle interactions

    Journal of Mathematical Chemistry, Vol. 51, Núm. 5, pp. 1462-1466

  5. Influence of axial and peripheral ligands on the electronic structure of titanium phthalocyanines

    Journal of Physical Chemistry C, Vol. 117, Núm. 9, pp. 4410-4420

  6. Long-lived oscillatory incoherent electron dynamics in molecules: Trans-polyacetylene oligomers

    New Journal of Physics, Vol. 15

  7. Metallicity retained by covalent functionalization of graphene with phenyl groups

    Nanoscale, Vol. 5, Núm. 16, pp. 7537-7543

  8. Phonon softening and direct to indirect band gap crossover in strained single-layer MoSe2

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

  9. Stark ionization of atoms and molecules within density functional resonance theory

    Journal of Physical Chemistry Letters, Vol. 4, Núm. 16, pp. 2734-2738

  10. Time evolution of excitations in normal Fermi liquids

    Physical Review B - Condensed Matter and Materials Physics, Vol. 87, Núm. 20

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

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