Alfonso Pedone

ResearcherID Scopus Author ID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 24

Top Topics

Gold Nanoparticles

Machine Learning

Molecular Dynamics

Top Venues

Journal of chemical theory and computation

Molecules (Basel, Switzerland)

Langmuir : the ACS journal of surfaces and colloids

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Francesco Muniz-Miranda, Leonardo Occhi, Francesco Fontanive, Maria Cristina Menziani, Alfonso Pedone
Quantum-Chemistry Study of the Hydrolysis Reaction Profile in Borate Networks: A Benchmark. Molecules (Basel, Switzerland) 29 (6) (2024)
Marco Bertani, Thibault Charpentier, Francesco Faglioni, Alfonso Pedone
Accurate and Transferable Machine Learning Potential for Molecular Dynamics Simulation of Sodium Silicate Glasses. Journal of chemical theory and computation (2024)
Francesco Muniz-Miranda, Leonardo Occhi, Francesco Fontanive, Maria Cristina Menziani, Alfonso Pedone
Quantum-Chemistry Study of the Hydrolysis Reaction Profile in Borate Networks: A Benchmark. Molecules (Basel, Switzerland) 29 (6) (2024)
Francesco Muniz-Miranda, Leonardo Occhi, Francesco Fontanive, Maria Cristina Menziani, Alfonso Pedone
Quantum-Chemistry Study of the Hydrolysis Reaction Profile in Borate Networks: A Benchmark. Molecules (Basel, Switzerland) 29 (6) (2024)
Mirko Di Biase, Luca Brugnoli, Katsuaki Miyatani, Masatoshi Akaji, Takumi Yoshida, Shingo Urata, Alfonso Pedone
Impact of Atomic Defects on Ceria Surfaces on Chemical Mechanical Polishing of Silica Glass Surfaces. Langmuir : the ACS journal of surfaces and colloids 40 (13) (2024)
Mirko Di Biase, Luca Brugnoli, Katsuaki Miyatani, Masatoshi Akaji, Takumi Yoshida, Shingo Urata, Alfonso Pedone
Impact of Atomic Defects on Ceria Surfaces on Chemical Mechanical Polishing of Silica Glass Surfaces. Langmuir : the ACS journal of surfaces and colloids (2024)
Marco Bertani, Thibault Charpentier, Francesco Faglioni, Alfonso Pedone
Accurate and Transferable Machine Learning Potential for Molecular Dynamics Simulation of Sodium Silicate Glasses. Journal of chemical theory and computation 20 (3) (2024)
Federica Lodesani, Maria Cristina Menziani, Shingo Urata, Alfonso Pedone
Evidence of Multiple Crystallization Pathways in Lithium Disilicate: A Metadynamics Investigation. The journal of physical chemistry letters (2023)
Luca Brugnoli, Katsuaki Miyatani, Masatoshi Akaji, Shingo Urata, Alfonso Pedone
New Atomistic Insights on the Chemical Mechanical Polishing of Silica Glass with Ceria Nanoparticles. Langmuir : the ACS journal of surfaces and colloids (2023)
Federica Lodesani, Maria Cristina Menziani, Shingo Urata, Alfonso Pedone
Evidence of Multiple Crystallization Pathways in Lithium Disilicate: A Metadynamics Investigation. The journal of physical chemistry letters 14 (6) (2023)
Luca Brugnoli, Shingo Urata, Alfonso Pedone
H 2 O 2 adsorption and dissociation on various CeO 2 (111) surface models: a first-principles study. Journal of physics. Condensed matter : an Institute of Physics journal 34 (16) (2022)
Luca Brugnoli, Maria Cristina Menziani, Shingo Urata, Alfonso Pedone
Development and Application of a ReaxFF Reactive Force Field for Cerium Oxide/Water Interfaces. The journal of physical chemistry. A 125 (25) (2021)
Federica Lodesani, Maria Cristina Menziani, Hiroyuki Hijiya, Yoichi Takato, Shingo Urata, Alfonso Pedone
Structural origins of the Mixed Alkali Effect in Alkali Aluminosilicate Glasses: Molecular Dynamics Study and its Assessment. Scientific reports 10 (1) (2020)
Francesco Tavanti, Alfonso Pedone, Maria Cristina Menziani
Disclosing the Interaction of Gold Nanoparticles with Aβ(1-40) Monomers through Replica Exchange Molecular Dynamics Simulations. International journal of molecular sciences 22 (1) (2020)
Francesco Tavanti, Alfonso Pedone, Maria Cristina Menziani, Alfredo Alexander-Katz
Computational Insights into the Binding of Monolayer-Capped Gold Nanoparticles onto Amyloid-β Fibrils. ACS chemical neuroscience 11 (19) (2020)
Stefano Caporali, Francesco Muniz-Miranda, Alfonso Pedone, Maurizio Muniz-Miranda
SERS, XPS and DFT Study of Xanthine Adsorbed on Citrate-Stabilized Gold Nanoparticles. Sensors (Basel, Switzerland) 19 (12) (2019)
Alessandro F Gualtieri, Gigliola Lusvardi, Alfonso Pedone, Dario Di Giuseppe, Alessandro Zoboli, Adele Mucci, Alfonso Zambon, Monica Filaferro, Giovanni Vitale, Monia Benassi, Rossella Avallone, Luca Pasquali, Magdalena Lassinantti Gualtieri
Structure Model and Toxicity of the Product of Biodissolution of Chrysotile Asbestos in the Lungs. Chemical research in toxicology 32 (10) (2019)
Cristina Gellini, Francesco Muniz-Miranda, Alfonso Pedone, Maurizio Muniz-Miranda
SERS active Ag-SiO2 nanoparticles obtained by laser ablation of silver in colloidal silica. Beilstein journal of nanotechnology 9 (2018)
Alfonso Pedone, Xiaojing Chen, Robert G Hill, Natalia Karpukhina
Molecular Dynamics Investigation of Halide-Containing Phospho-Silicate Bioactive Glasses. The journal of physical chemistry. B 122 (11) (2018)
Luca Bolzonello, Annalisa Polo, Andrea Volpato, Elena Meneghin, Massimiliano Cordaro, Mariachiara Trapani, Mariagrazia Fortino, Alfonso Pedone, Maria Angela Castriciano, Elisabetta Collini
Two-Dimensional Electronic Spectroscopy Reveals Dynamics and Mechanisms of Solvent-Driven Inertial Relaxation in Polar BODIPY Dyes. The journal of physical chemistry letters 9 (5) (2018)
Luca Brugnoli, Anna Maria Ferrari, Bartolomeo Civalleri, Alfonso Pedone, Maria Cristina Menziani
Assessment of Density Functional Approximations for Highly Correlated Oxides: The Case of CeO2 and Ce2O3. Journal of chemical theory and computation 14 (9) (2018)
Francesco Tavanti, Alfonso Pedone, Paolo Matteini, Maria Cristina Menziani
Computational Insight into the Interaction of Cytochrome C with Wet and PVP-Coated Ag Surfaces. The journal of physical chemistry. B 121 (41) (2017)
Davide Presti, Alfonso Pedone, Daniele Licari, Vincenzo Barone
A Modular Implementation for the Simulation of 1D and 2D Solid-State NMR Spectra of Quadrupolar Nuclei in the Virtual Multifrequency Spectrometer-Draw Graphical Interface. Journal of chemical theory and computation 13 (5) (2017)
Valentina Nicolini, Elisa Gambuzzi, Gianluca Malavasi, Ledi Menabue, Maria Cristina Menziani, Gigliola Lusvardi, Alfonso Pedone, Francesco Benedetti, Paola Luches, Sergio D'Addato, Sergio Valeri
Correction to "Evidence of Catalase Mimetic Activity in Ce3+/Ce4+ Doped Bioactive Glasses". The journal of physical chemistry. B 121 (27) (2017)