Achieving DFT accuracy with a machine-learning interatomic potential: thermomechanics and defects in bcc ferromagnetic iron D Dragoni, TD Daff, G Csanyi, N Marzari
Physical Review Materials 2 (1), 013808, 2017
264 2017 Screw dislocation structure and mobility in body centered cubic Fe predicted by a Gaussian Approximation Potential F Maresca, D Dragoni, G Csányi, N Marzari, WA Curtin
npj Computational Materials 4 (1), 69, 2018
85 2018 Thermoelastic properties of α-iron from first-principles D Dragoni, D Ceresoli, N Marzari
PHYSICAL REVIEW B 91 (10), 104105, 2015
48 2015 Interfacial Layering of a Room‐Temperature Ionic Liquid Thin Film on Mica: A Computational Investigation D Dragoni, N Manini, P Ballone
ChemPhysChem 13 (7), 1772-1780, 2012
38 2012 Interplay between Structural and Thermoelectric Properties in Epitaxial Sb2+ x Te3 Alloys S Cecchi, D Dragoni, D Kriegner, E Tisbi, E Zallo, F Arciprete, V Holý, ...
Advanced functional materials 29 (2), 1805184, 2019
31 2019 Mechanism of amorphous phase stabilization in ultrathin films of monoatomic phase change material D Dragoni, J Behler, M Bernasconi
Nanoscale 13 (38), 16146-16155, 2021
29 2021 Metal-semiconductor transition in the supercooled liquid phase of the and GeTe compounds M Cobelli, D Dragoni, S Caravati, M Bernasconi
Physical Review Materials 5 (4), 045004, 2021
16 2021 Statics and dynamics of multivalley charge density waves in Sb (111) A Tamtögl, P Kraus, M Mayrhofer-Reinhartshuber, G Benedek, ...
npj Quantum Materials 4 (1), 28, 2019
14 2019 Vibrational and thermoelastic properties of bcc iron from selected EAM potentials D Dragoni, D Ceresoli, N Marzari
Computational Materials Science 152, 99-106, 2018
12 2018 Density functional simulations of decomposition pathways of Ge-rich GeSbTe alloys for phase change memories O Abou El Kheir, D Dragoni, M Bernasconi
Physical Review Materials 5 (9), 095004, 2021
10 2021 First-principles study of the liquid and amorphous phases of D Dragoni, S Gabardi, M Bernasconi
Physical Review Materials 1 (3), 035603, 2017
10 2017 Structure and Crystallization Kinetics of As‐Deposited Films of the GeTe Phase Change Compound from Atomistic Simulations S Perego, D Dragoni, S Gabardi, D Campi, M Bernasconi
physica status solidi (RRL)–Rapid Research Letters 17 (8), 2200433, 2023
7 2023 Structural and electronic properties of liquid, amorphous, and supercooled liquid phases of In2Te5 from first-principles D Dragoni, M Bernasconi
The Journal of Chemical Physics 151 (13), 2019
7 2019 Evolution of Low‐Frequency Vibrational Modes in Ultrathin GeSbTe Films E Zallo, D Dragoni, Y Zaytseva, S Cecchi, NI Borgardt, M Bernasconi, ...
physica status solidi (RRL)–Rapid Research Letters 15 (3), 2000434, 2021
6 2021 First‐Principles Calculation of Transport and Thermoelectric Coefficients in Liquid Ge2 Sb2 Te5 D Baratella, D Dragoni, M Bernasconi
physica status solidi (RRL)–Rapid Research Letters 16 (9), 2100470, 2022
4 2022 A first-principles study of the switching mechanism in GeTe/InSbTe superlattices C Ribaldone, D Dragoni, M Bernasconi
Nanoscale Advances 2 (11), 5209-5218, 2020
4 2020 Structural and electronic properties of the Te-Si (111) surface from first principles D Dragoni
Physical Review B 106 (19), 195427, 2022
2 2022 First‐Principles Study on the Crystalline Ga4 Sb6 Te3 Phase Change Compound D Baratella, D Dragoni, D Ceresoli, M Bernasconi
physica status solidi (RRL)–Rapid Research Letters 15 (3), 2000382, 2021
2 2021 Beyond Theory: Evaluating the Practicality of Quantum Optimization Algorithms for Prototypical Industrial Applications M Vandelli, A Lignarolo, C Cavazzoni, D Dragoni
arXiv preprint arXiv:2311.11621, 2023
1 2023 Energetics and thermodynamics of α-iron from first-principles and machine-learning potentials D Dragoni
Università degli Studi di Milano-Bicocca, 2016
1 2016