
Publikationen von F. Bonafé
Alle Typen
Zeitschriftenartikel (10)
2025
Zeitschriftenartikel
Full minimal coupling Maxwell-TDDFT: An ab initio framework for light-matter interaction beyond the dipole approximation
Physical Review B 111 (8), 085114 (2025)
2023
Zeitschriftenartikel
Tunable Tesla-Scale Magnetic Attosecond Pulses through Ring-Current Gating ,
The Journal of Physical Chemistry Letters 14 (49), 11160–11167 (2023)
Zeitschriftenartikel
Time-resolved plasmon-assisted generation of optical-vortex pulses
Scientific Reports 13 (1), 14748 (2023)
Zeitschriftenartikel
First-Principles Simulations of Tip Enhanced Raman Scattering Reveal Active Role of Substrate on High-Resolution Images
The Journal of Physical Chemistry Letters 14 (30), 6850–6859 (2023)
2022
Zeitschriftenartikel
Dynamical evolution of the Schottky barrier as a determinant contribution to electron–hole pair stabilization and photocatalysis of plasmon-induced hot carriers
F. Bonafé, , , ,
, , Nanoscale 14 (7), 2816–2825 (2022)
Zeitschriftenartikel
Fano Resonance and Incoherent Interlayer Excitons in Molecular van der Waals Heterostructures
F. Bonafé, , , ,
, Nano Letters 22 (3), 911–917 (2022)
2021
Zeitschriftenartikel
Quantitative sampling of atomic-scale electromagnetic waveforms , , , , , ,
Nature Photonics 15 (2), 143–147 (2021)
2020
Zeitschriftenartikel
A Real-Time Time-Dependent Density Functional Tight-Binding Implementation for Semiclassical Excited State Electron–Nuclear Dynamics and Pump–Probe Spectroscopy Simulations
F. Bonafé, , , , , ,
Journal of Chemical Theory and Computation 16 (7), 4454–4469 (2020)
Zeitschriftenartikel
DFTB+, a software package for efficient approximate density functional theory based atomistic simulations
F. Bonafé, , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , , ,
, , , The Journal of Chemical Physics 152 (12), 124101 (2020)