activity
19922018
most citedExtracting convergent surface energies from slab calculations

328 citations · 804 across the 5 of their papers we have counts for

collaborators

5 papers

cond-mat.supr-con2018★ 1 cited

Singling out the effect of quenched disorder in the phase diagram of cuprates

R. De Renzi, F. Coneri, F. Mezzadri +7

We investigate the specific influence of structural disorder on the suppression of antiferromagnetic order and on the emergence of cuprate superconductivity. We single out pure dis…

cond-mat.mtrl-sci2000★ 4 cited

Roughening of close-packed singular surfaces

F. Trudu, V. Fiorentini, P. Ruggerone +1

An upper bound to the roughening temperature of a close-packed singular surface, fcc Al (111), is obtained via free energy calculations based on thermodynamic integration using the…

cond-mat.mtrl-sci1996★ 328 cited

Extracting convergent surface energies from slab calculations

V. Fiorentini, M. Methfessel

The formation energy of a solid surface can be extracted from slab calculations if the bulk energy per atom is known. It has been pointed out previously that the resulting surface…

cond-mat1993★ 276 cited

Reconstruction Mechanism of FCC Transition-Metal (001) Surfaces

Vincenzo Fiorentini, Michael Methfessel, Matthias Scheffler

The reconstruction mechanism of (001) fcc transition metal surfaces is investigated using a full-potential all-electron electronic structure method within density-functional theory…

cond-mat1992★ 195 cited

Electronic and structural properties of GaN by the full-potential LMTO method : the role of the electrons

Vincenzo Fiorentini, Michael Methfessel, Matthias Scheffler

The structural and electronic properties of cubic GaN are studied within the local density approximation by the full-potential linear muffin-tin orbitals method. The Ga electr…