MERCURI, FRANCESCO
MERCURI, FRANCESCO
Istituto per lo Studio dei Materiali Nanostrutturati - ISMN
Proposta di adesione del CNR all'Associazione EMMC AISBL, European Materials Modelling Council - Studio di fattibilità
2023 Francesco Mercuri
Early steps in the formation of the interface between organic molecular semiconductors and metals: a computational approach
2020 F. Mercuri
Coarse-grain simulations of mechanically induced transformations in supported lipid bilayers and micelles at heterointerfaces
2018 Baldoni, M; Lorenzoni, A; Brucale, M; Valle, F; Mercuri, F
Morphology and Electronic Properties of N,N'-Ditridecylperylene-3,4,9,10-tetracarboxylic Diimide Layered Aggregates: From Structural Predictions to Charge Transport
2017 Lorenzoni, Andrea; Muccini, Michele; Mercuri, Francesco
Release of chemisorbed hydrogen from carbon nanotubes: Insights from ab-initio molecular dynamics simulations
2017 Mercuri, F
Atomistic Modeling of Corrosion Resistance: A First Principles Study of O-2 Reduction on the Al(111) Surface Covered with a Thin Hydroxylated Alumina Film
2014 Costa, Dominique; Ribeiro, Thomas; Mercuri, Francesco; Pacchioni, Gianfranco; Marcus, Philippe
Molecular doping and gas sensing in Si nanowires: From charge injection to reduced dielectric mismatch
2013 Amato, Giampiero; Cultrera, Alessandro; Boarino, Luca; Lamberti, Carlo; Bordiga, Silvia; Mercuri, Francesco; Cartoixa, Xavier; Rurali, Riccardo
Electronic properties and stability of graphene nanoribbons: An interpretation based on Clar sextet theory
2008 Baldoni, M.; Sgamellotti, A.; Mercuri, F.
INOR 65-AgI@SWCNT: Low dimensional nanoaggregates and energy storage
2008 Leoni, Stefano; Mercuri, Francesco; Baldoni, Matteo; Sgamellotti, Antonio; Seifert Gotthard, Sr
Formation, structure and polymorphism of novel lowest-dimensional AgI nanoaggregates by encapsulation in carbon nanotubes
2007 Baldoni, M; Leoni, S; Sgamellotti, A; Seifert, G; Mercuri, F
Role of defects on the gas sensing properties of carbon nanotubes thin films: experiment and theory
2004 Valentini, L; Mercuri, F; Armentano, I; Cantalini, C; Picozzi, S; Lozzi, L; Santucci, S; Sgamellotti, A; Kenny, Jm
The Interaction of Cr(CO)3 on the (n,0) Nanotube Side-Walls: a Density Functional Study through a Cluster Model Approach
2003 Nunzi, F; Mercuri, F; Sgamellotti, A
High performance computing development for the next decade, and its implications for molecular modelling applications - Sectoral report
2002 Fagerstroem, J.; Faxen, T.; Muenger, P.; Ynnerman, A.; Desplat, JC; De Angelis, F.; Mercuri, F.; Rosi, M.; Sgamellotti, A.; Tarantelli, F.; Vitillaro, G.J. Fagerstroem, T. Faxen, P. Muenger, A. Ynnerman, F. De Angelis, F. Mercuri, M. Rosi, A. Sgamellotti, F. Tarantelli, G. Vitillaro
Influence of substituents and length of silanylene units on the electronic structure of pi-conjugated polymeric organosilicon systems
1999 Mercuri, F; Re, N; Sgamellotti, A