Giacomo Miceli
Title
Cited by
Cited by
Year
Neural network interatomic potential for the phase change material GeTe
GC Sosso, G Miceli, S Caravati, J Behler, M Bernasconi
Physical Review B 85 (17), 174103, 2012
1242012
Fast crystallization of the phase change compound GeTe by large-scale molecular dynamics simulations
GC Sosso, G Miceli, S Caravati, F Giberti, J Behler, M Bernasconi
The journal of physical chemistry letters 4 (24), 4241-4246, 2013
1052013
Self-compensation due to point defects in Mg-doped GaN
G Miceli, A Pasquarello
Physical Review B 93 (16), 165207, 2016
752016
Isobaric first-principles molecular dynamics of liquid water with nonlocal van der Waals interactions
G Miceli, S de Gironcoli, A Pasquarello
The Journal of chemical physics 142 (3), 034501, 2015
582015
Nuclear quantum effects in ab initio dynamics: Theory and experiments for lithium imide
M Ceriotti, G Miceli, A Pietropaolo, D Colognesi, A Nale, M Catti, ...
Physical Review B 82 (17), 174306, 2010
482010
Ab initio Electronic Structure of Liquid Water
W Chen, F Ambrosio, G Miceli, A Pasquarello
Physical review letters 117 (18), 186401, 2016
392016
Redox levels in aqueous solution: Effect of van der Waals interactions and hybrid functionals
F Ambrosio, G Miceli, A Pasquarello
The Journal of chemical physics 143 (24), 244508, 2015
362015
Nonempirical hybrid functionals for band gaps and polaronic distortions in solids
G Miceli, W Chen, I Reshetnyak, A Pasquarello
Physical Review B 97 (12), 121112, 2018
342018
Nonempirical dielectric-dependent hybrid functional with range separation for semiconductors and insulators
W Chen, G Miceli, GM Rignanese, A Pasquarello
Physical Review Materials 2 (7), 073803, 2018
332018
First Principles Study of the LiNH2/Li2NH Transformation
G Miceli, CS Cucinotta, M Bernasconi, M Parrinello
The Journal of Physical Chemistry C 114 (35), 15174-15183, 2010
322010
Energetics of native point defects in GaN: A density-functional study
G Miceli, A Pasquarello
Microelectronic Engineering 147, 51-54, 2015
312015
Structural, dynamical, and electronic properties of liquid water: A hybrid functional study
F Ambrosio, G Miceli, A Pasquarello
The Journal of Physical Chemistry B 120 (30), 7456-7470, 2016
282016
Fermi-level pinning through defects at GaAs/oxide interfaces: A density functional study
D Colleoni, G Miceli, A Pasquarello
Physical Review B 92 (12), 125304, 2015
262015
Electronic levels of excess electrons in liquid water
F Ambrosio, G Miceli, A Pasquarello
The Journal of Physical Chemistry Letters 8 (9), 2055-2059, 2017
222017
Liquid water through density-functional molecular dynamics: Plane-wave vs atomic-orbital basis sets
G Miceli, J Hutter, A Pasquarello
Journal of Chemical Theory and Computation 12 (8), 3456-3462, 2016
222016
Origin of Fermi-level pinning at GaAs surfaces and interfaces
D Colleoni, G Miceli, A Pasquarello
Journal of Physics: Condensed Matter 26 (49), 492202, 2014
222014
Superionic conduction in substoichiometric LiAl alloy: an ab initio study
CS Cucinotta, G Miceli, P Raiteri, M Krack, TD Kühne, M Bernasconi, ...
Physical review letters 103 (12), 125901, 2009
192009
First principles study of As 2p core-level shifts at GaAs/Al2O3 interfaces
G Miceli, A Pasquarello
Applied Physics Letters 102 (20), 201607, 2013
172013
Band alignment and chemical bonding at the GaAs/Al2O3 interface: A hybrid functional study
D Colleoni, G Miceli, A Pasquarello
Applied Physics Letters 107 (21), 211601, 2015
162015
Arsenic related defect states resonant with the semiconductor conduction band at the In0. 53Ga0. 47As/oxide interface: A density functional study
D Colleoni, G Miceli, A Pasquarello
Microelectronic Engineering 147, 260-263, 2015
132015
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Articles 1–20