Federico Zipoli
TitelCiteras avÅr
Simulation of structural phase transitions by metadynamics
MP Roman Martoňák, Alessandro Laio, Marco Bernasconi
Zeitschrift für Kristallographie - Crystalline Materials 220 (5-6 …, 2005
1262005
Multilevel ultrafast flexible nanoscale nonvolatile hybrid graphene oxide–titanium oxide memories
VK Nagareddy, MD Barnes, F Zipoli, KT Lai, AM Alexeev, MF Craciun, ...
ACS nano 11 (3), 3010-3021, 2017
332017
Constant pressure reactive molecular dynamics simulations of phase transitions under pressure: The graphite to diamond conversion revisited
F Zipoli, M Bernasconi, R Martoňák
The European Physical Journal B-Condensed Matter and Complex Systems 39 (1 …, 2004
292004
Simulation of electrocatalytic hydrogen production by a bioinspired catalyst anchored to a pyrite electrode
F Zipoli, R Car, MH Cohen, A Selloni
Journal of the American Chemical Society 132 (25), 8593-8601, 2010
272010
Structural origin of resistance drift in amorphous GeTe
F Zipoli, D Krebs, A Curioni
Physical Review B 93 (11), 115201, 2016
262016
Oxidation State Changes and Electron Flow in Enzymatic Catalysis and Electrocatalysis through Wannier‐Function Analysis
PHL Sit, F Zipoli, J Chen, R Car, MH Cohen, A Selloni
Chemistry–A European Journal 17 (43), 12136-12143, 2011
222011
Thermal-hydrogen promoted selective desorption and enhanced mobility of adsorbed radicals in silicon film growth
S Cereda, F Zipoli, M Bernasconi, L Miglio, F Montalenti
Physical review letters 100 (4), 046105, 2008
222008
Electron-phonon coupling in halogen-doped carbon clathrates from first principles
F Zipoli, M Bernasconi, G Benedek
Physical Review B 74 (20), 205408, 2006
222006
First principles study of Ge∕Si exchange mechanisms at the Si(001) surface
F Zipoli, S Cereda, M Ceriotti, M Bernasconi, L Miglio, F Montalenti
Applied physics letters 92 (19), 191908-191908-3, 2008
212008
Improved coarse-grained model for molecular-dynamics simulations of water nucleation
F Zipoli, T Laino, S Stolz, E Martin, C Winkelmann, A Curioni
The Journal of Chemical Physics 139 (9), 094501, 2013
172013
Ab Initio Simulations of Lewis‐Acid‐Catalyzed Hydrosilylation of Alkynes
F Zipoli, M Bernasconi, A Laio
ChemPhysChem 6 (9), 1772-1775, 2005
162005
A QUICKSTEP-based quantum mechanics/molecular mechanics approach for silica
F Zipoli, T Laino, A Laio, M Bernasconi, M Parrinello
The Journal of chemical physics 124 (15), 154707, 2006
152006
Collective Structural Relaxation in Phase‐Change Memory Devices
M Le Gallo, D Krebs, F Zipoli, M Salinga, A Sebastian
Advanced Electronic Materials 4 (9), 1700627, 2018
142018
Inherent stochasticity in phase-change memory devices
M Le Gallo, T Tuma, F Zipoli, A Sebastian, E Eleftheriou
2016 46th European Solid-State Device Research Conference (ESSDERC), 373-376, 2016
142016
Ab initio simulation of the grafting of phenylacetylene on hydrogenated surfaces of crystalline silicon catalyzed by a Lewis acid
F Zipoli, M Bernasconi
The Journal of Physical Chemistry B 110 (46), 23403-23409, 2006
142006
First principles study of three-dimensional polymers of C 60: Structure, electronic properties, and Raman spectra
F Zipoli, M Bernasconi
Physical Review B 77 (11), 115432, 2008
122008
Temperature evolution in nanoscale carbon-based memory devices due to local Joule heating
TA Bachmann, AM Alexeev, WW Koelmans, F Zipoli, AK Ott, C Dou, ...
IEEE Transactions on Nanotechnology 16 (5), 806-811, 2017
112017
Reactive potential for the study of phase-change materials: GeTe
F Zipoli, A Curioni
New Journal of Physics 15 (12), 123006, 2013
112013
Multiscale quantum simulation of resistance switching in amorphous carbon
GN Shumkin, F Zipoli, AM Popov, A Curioni
Procedia Computer Science 9, 641-650, 2012
112012
Theoretical Design by First Principles Molecular Dynamics of a Bioinspired Electrode− Catalyst System for Electrocatalytic Hydrogen Production from Acidified Water
F Zipoli, R Car, MH Cohen, A Selloni
Journal of chemical theory and computation 6 (11), 3490-3502, 2010
112010
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Artiklar 1–20