[HTML][HTML] Experimentally validated phase-field model to design the wettability of micro-structured surfaces

M Provenzano, FM Bellussi, M Morciano, E Rossi… - Materials & Design, 2023 - Elsevier
Surfaces with tailored wettability have attracted considerable attention because of their wide
range of potential applications. Wettability can be finely designed by controlling the …

[HTML][HTML] Modeling Carbon-Based Nanomaterials (CNMs) and Derived Composites and Devices

A Chiminelli, I Radović, M Fasano, A Fantoni… - Sensors, 2024 - mdpi.com
A review of different modeling techniques, specifically in the framework of carbon-based
nanomaterials (CNMs, including nanoparticles such as graphene and carbon nanotubes …

[HTML][HTML] Water filling in carbon nanotubes with different wettability and implications on nanotube/water heat transfer via atomistic simulations

A Casto, FM Bellussi, M Diego, N Del Fatti… - International Journal of …, 2023 - Elsevier
The peculiar heat and mass transfer properties of Carbon Nanotubes (CNTs) envision
promising applications in nanoengineering and nanofluidic devices, such as heat sinks and …

Mesoscopic modeling and experimental validation of thermal and mechanical properties of polypropylene nanocomposites reinforced by graphene-based fillers

A Muhammad, R Srivastava, N Koutroumanis… - …, 2023 - ACS Publications
The development of nanocomposites relies on structure–property relations, which
necessitate multiscale modeling approaches. This study presents a modeling framework that …

[HTML][HTML] Method for predicting the wettability of micro-structured surfaces by continuum phase-field modelling

M Provenzano, FM Bellussi, M Morciano, P Asinari… - MethodsX, 2023 - Elsevier
Numerical prediction of material properties is attracting the attention of the scientific
community and industry because of its usefulness in the design process. In the fields of fluid …

Mesoscopic Modeling of Bio-Compatible PLGA Polymers with Coarse-Grained Molecular Dynamics Simulations

FM Bellussi, M Ricci, M Fasano… - The Journal of Physical …, 2024 - ACS Publications
A challenging topic in materials engineering is the development of numerical models that
can accurately predict material properties with atomistic accuracy, matching the scale and …

Diffusion of curcumin in PLGA-based carriers for drug delivery: a molecular dynamics study

A De Giorgi, FM Bellussi, S Parlani, A Lucisano… - Journal of Molecular …, 2024 - Springer
Context: The rapid growth and diversification of drug delivery systems have been
significantly supported by advancements in micro-and nano-technologies, alongside the …

[PDF][PDF] Modelling Carbon-Based Nanomaterials (CNMs) and Derived Composites and Devices

M Provenzano, M Fernandes - 2024 - preprints.org
A review of different modelling techniques, specifically in the framework of carbon-based
nanomaterials (CNMs, including nanoparticles as graphene and carbon nanotubes—CNTs) …