DE LUCA, GIORGIO
DE LUCA, GIORGIO
Istituto per la Tecnologia delle Membrane - ITM
Advanced Modelling and Simulation in the Chemical and Biochemical Process Industry
2024 Petrosino, Francesco; DE LUCA, Giorgio; Curcio, Stefano
Diffusion and thermodynamic properties of lithium polysulfides in different solvents: a molecular dynamics approach
2024 Luque Di Salvo, Javier; Maldonado-Ochoa, Santiago Agustín; Luque, Guillermina L.; Calderón, Andrea; Bracamonte, Victoria; Vaca Chávez, Fabián; Barraco, Daniel E.; Vizintin, Alen; Dominko, Robert; Leiva, Ezequiel P. M.; De Luca, Giorgio
Insights into Cis-Amide-Modified Carbon Nanotubes for Selective Purification of CH4 and H2 from Gas Mixtures: A Comparative DFT Study
2024 Rahmanzadeh, Atyeh; AL-Hamdani, Nasser; Favvas, Evangelos P.; De Luca, Giorgio
Insights into neodymium interaction with carboxylate-graphene-like support in presence of nitrate: A comparative DFT investigation
2024 AL-Hamdani, Nasser; De Luca, Giorgio; Saha, Dipendu
Molecular insight into LiTFSI and Li2S6 transport through hydrophobic nanochannels
2024 Luque Di Salvo, J.; Luque, G. L.; Leiva, E. P. M.; De Luca, G.
Unraveling the Interactions between Lithium and Twisted Graphene
2024 Ramírez, Maximo; De Luca, Giorgio; Caputi, Lorenzo
Micro-CFD modelling of ultrafiltration bio-fouling
2023 Petrosino, Francesco; De Luca, Giorgio; Curcio, Stefano; Wickramasinghe, S. Ranil; Chakraborty, Sudip
Prediction of equilibrium water uptake and ions diffusivities in ion-exchange membranes combining molecular dynamics and analytical models
2023 Sireci, Enrico; De Luca, Giorgio; Luque Di Salvo, Javier; Cipollina, Andrea; Micale, Giorgio
Advanced descriptors for long-range noncovalent interactions between SARS-CoV-2 spikes and polymer surfaces
2022 De Luca, Giorgio; Petrosino, Francesco; Di Salvo, Javier Luque; Chakraborty, Sudip; Curcio, Stefano
Lithium polysulfide conformer analysis in ether-based solvents for Li–S batteries
2022 Luque Di Salvo, Javier; Luque, Guillermina L.; De Luca, Giorgio
Vertically aligned carbon nanotubes for monovalent cation selective membranes designed by in silico experiments
2022 De Luca, G; Luque Di Salvo, J; Cipollina, A; Luque, G L; Fuoco, A; Leiva, E PM; Micale, G
A full-atom multiscale modelling for sodium chloride diffusion in anion exchange membranes
2021 Luque Di Salvo, Javier; De Luca, Giorgio; Cipollina, Andrea; Micale, Giorgio
A polyoxometalate-based self-cleaning smart material with oxygenic activity for water remediation with membrane technology
2021 Galiano, F; Mancuso, R; Carraro, M; Bundschuh, J; Hoinkis, J; Bonchio, M; DE LUCA, Giorgio; Gabriele, B; Figoli, A
Evidence of massless Dirac fermions in graphitic shells encapsulating hollow iron microparticles
2021 Scarcello, Andrea; Alessandro, Francesca; Arias Polanco, Melvin; Vacacela Gomez, Cristian; Cid Perez, Denia; De Luca, Giorgio; Curcio, Efrem; Caputi, Lorenzo S.
Pullout Force and Inlet Oscillation in Telescopic Carbon Nanotubes: A Quantum Study
2021 DE LUCA, Giorgio; Scarcello, A; Luque Di Salvo, J; S Caputi, L
Why Ag(I) grafted porous carbon matrix prefers alkene over alkane? An inside view from ab-initio study
2021 De Luca, Giorgio; Saha, Dipendu; Chakraborty, Sudip
A review of emerging trends in membrane science and technology for sustainable water treatment
2020 Yusuf, A; Sodiq, A; Giwa, A; Eke, J; Pikuda, O; De Luca, G; Di Salvo, Jl; Chakraborty, S
Computational approaches in membrane science and engineering
2020 Fuoco, A; DE LUCA, Giorgio; Tocci, E; Jansen, Jc
Effect of ion exchange capacity and water uptake on hydroxide transport in PSU-TMA membranes: A DFT and molecular dynamics study
2020 Luque Di Salvo, J; De Luca, G; Cipollina, A; Micale, G
Osmotic pressure and transport coefficient in ultrafiltration: A Monte Carlo study using quantum surface charges
2020 Petrosino, F; Hallez, Y; De Luca, G; Curcio, S