Publicaciones en colaboración con investigadoras/es de Weizmann Institute of Science (6)

2024

  1. Spin-Orbit Torque in Single-Molecule Junctions from ab Initio

    Journal of Physical Chemistry Letters, Vol. 15, Núm. 21, pp. 5747-5753

  2. Strongly Bound Excitons and Anisotropic Linear Absorption in Monolayer Graphullerene

    Nano Letters, Vol. 24, Núm. 23, pp. 7033-7039

2023

  1. Introducing Novel Materials with Diffuse Electrons for Applications in Redox Catalysis and Quantum Computing via Theoretical Calculations

    Journal of Physical Chemistry C

  2. Optical absorption spectra of metal oxides from time-dependent density functional theory and many-body perturbation theory based on optimally-tuned hybrid functionals

    Physical Review Materials, Vol. 7, Núm. 12

  3. Transferable screened range-separated hybrid functionals for electronic and optical properties of van der Waals materials

    Physical Review Materials, Vol. 7, Núm. 10

2020

  1. Mechanically Tunable Quantum Interference in Ferrocene-Based Single-Molecule Junctions

    Nano Letters, Vol. 20, Núm. 9, pp. 6381-6386