Paolo Giannozzi
Paolo Giannozzi
DMIF, University of Udine, and IOM-CNR, Trieste
Verified email at - Homepage
Cited by
Cited by
QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials
P Giannozzi, S Baroni, N Bonini, M Calandra, R Car, C Cavazzoni, ...
Journal of physics: Condensed matter 21 (39), 395502, 2009
Phonons and related crystal properties from density-functional perturbation theory
S Baroni, S De Gironcoli, A Dal Corso, P Giannozzi
Reviews of modern Physics 73 (2), 515, 2001
Advanced capabilities for materials modelling with Quantum ESPRESSO
P Giannozzi, O Andreussi, T Brumme, O Bunau, MB Nardelli, M Calandra, ...
Journal of physics: Condensed matter 29 (46), 465901, 2017
Green’s-function approach to linear response in solids
S Baroni, P Giannozzi, A Testa
Physical review letters 58 (18), 1861, 1987
Ab initio calculation of phonon dispersions in semiconductors
P Giannozzi, S De Gironcoli, P Pavone, S Baroni
Physical Review B 43 (9), 7231, 1991
Reproducibility in density functional theory calculations of solids
K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ...
Science 351 (6280), aad3000, 2016
Quantum ESPRESSO toward the exascale
P Giannozzi, O Baseggio, P Bonfà, D Brunato, R Car, I Carnimeo, ...
The Journal of chemical physics 152 (15), 2020
Gas adsorption on graphene doped with B, N, Al, and S: A theoretical study
J Dai, J Yuan, P Giannozzi
Applied Physics Letters 95 (23), 2009
Ab initio lattice dynamics of diamond
P Pavone, K Karch, O Schütt, D Strauch, W Windl, P Giannozzi, S Baroni
Physical Review B 48 (5), 3156, 1993
Noncovalent functionalization of carbon nanotubes by aromatic organic molecules
J Zhao, JP Lu, J Han, CK Yang
Applied physics letters 82 (21), 3746-3748, 2003
Oxygen adsorption on graphite and nanotubes
P Giannozzi, R Car, G Scoles
The Journal of chemical physics 118 (3), 1003-1006, 2003
Density-functional perturbation theory for quasi-harmonic calculations
S Baroni, P Giannozzi, E Isaev
Reviews in Mineralogy and Geochemistry 71 (1), 39-57, 2010
Coverage-Dependent Adsorption of CH3S and (CH3S)2 on Au(111):  a Density Functional Theory Study
MC Vargas, P Giannozzi, A Selloni, G Scoles
The Journal of Physical Chemistry B 105 (39), 9509-9513, 2001
Reaction pathways for oxygen evolution promoted by cobalt catalyst
G Mattioli, P Giannozzi, A Amore Bonapasta, L Guidoni
Journal of the American Chemical Society 135 (41), 15353-15363, 2013
Vibrational and dielectric properties of C60 from density‐functional perturbation theory
P Giannozzi, S Baroni
The Journal of chemical physics 100 (11), 8537-8539, 1994
First-principles codes for computational crystallography in the Quantum-ESPRESSO package
S Scandolo, P Giannozzi, C Cavazzoni, S de Gironcoli, A Pasquarello, ...
Zeitschrift für Kristallographie-Crystalline Materials 220 (5-6), 574-579, 2005
Towards very large-scale electronic-structure calculations
S Baroni, P Giannozzi
Europhysics Letters 17 (6), 547, 1992
Structure and thermodynamics of alloys from ab initio Monte Carlo simulations
S De Gironcoli, P Giannozzi, S Baroni
Physical review letters 66 (16), 2116, 1991
Calculation of near-edge x-ray-absorption fine structure at finite temperatures: Spectral signatures of hydrogen bond breaking in liquid water
B Hetényi, F De Angelis, P Giannozzi, R Car
The Journal of chemical physics 120 (18), 8632-8637, 2004
Thirteen‐atom clusters: Equilibrium geometries, structural transformations, and trends in Na, Mg, Al, and Si
U Röthlisberger, W Andreoni, P Giannozzi
The Journal of chemical physics 96 (2), 1248-1256, 1992
The system can't perform the operation now. Try again later.
Articles 1–20