53 citations · 108 across the 3 of their papers we have counts for
3 papers
cond-mat.mtrl-sci2021★ 53 cited
Quasi-harmonic temperature dependent elastic constants: applications to silicon, aluminum, and silver
Cristiano Malica, Andrea Dal Corso
We present ab-initio calculations of the quasi-harmonic temperature dependent elastic constants. The isothermal elastic constants are calculated at each temperature as second deriv…
physics.comp-ph2019★ 16 cited
Density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials: the magnetic case
Andrea Urru, Andrea Dal Corso
We extend density functional perturbation theory for lattice dynamics with fully relativistic ultrasoft pseudopotentials to magnetic materials. Our approach is based on the applica…
cond-mat.mtrl-sci2018★ 39 cited
Lattice dynamics and thermophysical properties of h.c.p. Os and Ru from the quasi-harmonic approximation
Mauro Palumbo, Andrea Dal Corso
We report first-principles phonon frequencies and anharmonic thermodynamic properties of h.c.p. Os and Ru calculated within the quasi-harmonic approximation, including Gruneisen pa…