24 citations · 44 across the 4 of their papers we have counts for
4 papers
QE-CONVERSE: An open-source package for the Quantum ESPRESSO distribution to compute non-perturbatively orbital magnetization from first principles, including NMR chemical shifts and EPR parameters
Simone Fioccola, Luigi Giacomazzi, Davide Ceresoli +3
Orbital magnetization, a key property arising from the orbital motion of electrons, plays a crucial role in determining the magnetic behavior of molecules and solids. Despite its s…
Infrared spectra in amorphous alumina: a combined ab initio and experimental study
L. Giacomazzi, N. S. Shcheblanov, M. E. Povarnitsyn +5
We present a combined study based on experimental measurements of infrared (IR) dielectric function and first-principles calculations of IR spectra and vibrational density of state…
Localization properties of vibrational modes in -Si3N4
Luigi Giacomazzi
We present a first-principles investigation of the localization properties of vibrational modes in amorphous silicon nitride (-SiN). Our investigation further confirms t…
Dynamics of liquid He-4 in confined geometries from Time-Dependent Density Functional calculations
Luigi Giacomazzi, Flavio Toigo, Francesco Ancilotto
We present numerical results obtained from Time-Dependent Density Functional calculations of the dynamics of liquid He-4 in different environments characterized by geometrical conf…