| Automated extraction of chemical synthesis actions from experimental procedures AC Vaucher, F Zipoli, J Geluykens, VH Nair, P Schwaller, T Laino Nature communications 11 (1), 3601, 2020 | 182 | 2020 |
| Simulation of structural phase transitions by metadynamics MP Roman Martoňák, Alessandro Laio, Marco Bernasconi Zeitschrift für Kristallographie - Crystalline Materials 220 (5-6 …, 2005 | 171 | 2005 |
| 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 | 114 | 2017 |
| 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 | 83 | 2018 |
| Structural origin of resistance drift in amorphous GeTe F Zipoli, D Krebs, A Curioni Physical Review B 93 (11), 115201, 2016 | 75 | 2016 |
| Simulating diffusion properties of solid‐state electrolytes via a neural network potential: performance and training scheme A Marcolongo, T Binninger, F Zipoli, T Laino ChemSystemsChem 2 (3), e1900031, 2020 | 54 | 2020 |
| 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 | 45 | 2011 |
| Amorphous carbon resistive memory element with lateral heat dissipating structure A Curioni, WW Koelmans, A Sebastian, F Zipoli US Patent 9,640,759, 2017 | 43 | 2017 |
| 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, 41-47, 2004 | 42 | 2004 |
| Quality of uncertainty estimates from neural network potential ensembles L Kahle, F Zipoli Physical Review E 105 (1), 015311, 2022 | 38 | 2022 |
| Electron-phonon coupling in halogen-doped carbon clathrates from first principles F Zipoli, M Bernasconi, G Benedek Physical Review B—Condensed Matter and Materials Physics 74 (20), 205408, 2006 | 36 | 2006 |
| 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 | 33 | 2010 |
| 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 | 29 | 2016 |
| Thermal-Hydrogen Promoted Selective Desorption and Enhanced Mobility<? format?> of Adsorbed Radicals in Silicon Film Growth S Cereda, F Zipoli, M Bernasconi, L Miglio, F Montalenti Physical review letters 100 (4), 046105, 2008 | 29 | 2008 |
| 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 | 28 | 2008 |
| Reactive potential for the study of phase-change materials: GeTe F Zipoli, A Curioni New Journal of Physics 15 (12), 123006, 2013 | 20 | 2013 |
| 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), 2013 | 20 | 2013 |
| Ab initio simulations of lewis-acid-catalyzed hydrosilylation of alkynes F Zipoli, M Bernasconi, A Laio ChemPhysChem 6 (9), 1772-1775, 2005 | 20 | 2005 |
| Multiscale quantum simulation of resistance switching in amorphous carbon GN Shumkin, F Zipoli, AM Popov, A Curioni Procedia Computer Science 9, 641-650, 2012 | 19 | 2012 |
| 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 | 18 | 2006 |