Papchenko, Kseniya; Ricci, Eleonora; De Angelis, Maria Grazia, Modelling Across Multiple Scales to Design Biopolymer Membranes for Sustainable Gas Separations: 2-Multiscale Approach, «POLYMERS», 2024, 16, Article number: 2776 , pp. 1 - 18 [Scientific article]
Atiq, O.; Ricci, E.; Baschetti, M. G.; De Angelis, M. G., Molecular Simulations of Hydrogen Sorption in Semicrystalline High-Density Polyethylene: The Impact of the Surface Fraction of Tie-Chains, «THE JOURNAL OF PHYSICAL CHEMISTRY. B», 2024, 128, pp. 2799 - 2810 [Scientific article]Open Access
Chen, Ting; Wei, Xiuming; Fabiani, Thomas; Liu, Baoyu; Yang, Yaohao; Lewis, Allana; Mazlan, Nurul A.; Butt, Fraz Saeed; Chen, Siyu; Gu, Qinfeng; Radacsi, Norbert; Wang, Huanting; De Angelis, Maria Grazia; Yang, Shuiqing; Chen, Haiqun; Huang, Yi, New 2D Metal‐Organic Monoacid Framework (MOmAF): Realization of Extreme Water Repellence, «SMALL», 2024, 20, Article number: 2404224 , pp. 1 - 9 [Scientific article]Open Access
Ricci E.; De Angelis M.G., A perspective on data-driven screening and discovery of polymer membranes for gas separation, from the molecular structure to the industrial performance, «REVIEWS IN CHEMICAL ENGINEERING», 2023, 0, pp. 1 - 34 [Scientific article]
Ferri M.; Papchenko K.; Degli Esposti M.; Tondi G.; De Angelis M.G.; Morselli D.; Fabbri P., Fully Biobased Polyhydroxyalkanoate/Tannin Films as Multifunctional Materials for Smart Food Packaging Applications, «ACS APPLIED MATERIALS & INTERFACES», 2023, 15, pp. 28594 - 28605 [Scientific article]Open Access
Fabiani, Thomas; Ricci, Eleonora; Boi, Cristiana; Dimartino, Simone; De Angelis, Maria Grazia, In silico screening of nanoporous materials for urea removal in hemodialysis applications, «PHYSICAL CHEMISTRY CHEMICAL PHYSICS», 2023, 25, pp. 24069 - 24080 [Scientific article]Open Access
Merlonghi, Lorenzo; Giacinti Baschetti, Marco; De Angelis, Maria Grazia, Modelling Flux Reduction of Gases in Semicrystalline Polymers:
Effect of Volume Fraction, Aspect Ratio, Dispersion, Size Distribution and Orientation of Crystalline Domains, in: ICOM 2023, 2023, pp. 1 - 1 (atti di: International Congress on Membranes & Membrane Processes 2023, Chiba, Japan, 09/07/23-14/07/22) [Contribution to conference proceedings]
Atiq, O.; Ricci, E.; Giacinti Baschetti, M.; De Angelis, M. G., Multi-scale modeling of gas solubility in semi-crystalline polymers: bridging Molecular Dynamics with Lattice Fluid Theory, «FLUID PHASE EQUILIBRIA», 2023, 570, Article number: 113798 , pp. 1 - 11 [Scientific article]Open Access
Yuan T.; De Angelis M.G.; Sarkisov L., Simple lattice model explains equilibrium separation phenomena in glassy polymers, «THE JOURNAL OF CHEMICAL PHYSICS», 2023, 159, Article number: 054705 , pp. 1 - 11 [Scientific article]
Ricci, Eleonora; De Angelis, Maria Grazia; Minelli, Matteo, A comprehensive theoretical framework for the sub and supercritical sorption and transport of CO2 in polymers, «CHEMICAL ENGINEERING JOURNAL», 2022, 435, Article number: 135013 , pp. 1 - 12 [Scientific article]Open Access
De Hemptinne J.-C.; Kontogeorgis G.M.; Dohrn R.; Economou I.G.; Ten Kate A.; Kuitunen S.; Fele Zilnik L.; De Angelis M.G.; Vesovic V., A View on the Future of Applied Thermodynamics, «INDUSTRIAL & ENGINEERING CHEMISTRY RESEARCH», 2022, 61, pp. 14664 - 14680 [Scientific article]Open Access
Checchetto, R.; Scarpa, M.; De Angelis, M. G.; Minelli, M., Mixed gas diffusion and permeation of ternary and quaternary CO2/CO/N2/O2 gas mixtures in Matrimid®, polyetherimide and poly(lactic acid) membranes for CO2/CO separation, «JOURNAL OF MEMBRANE SCIENCE», 2022, 659, Article number: 120768 , pp. 1 - 11 [Scientific article]Open Access
De Pascale M.; De Angelis M.G.; Boi C., Mixed Matrix Membranes Adsorbers (MMMAs) for the Removal of Uremic Toxins from Dialysate, «MEMBRANES», 2022, 12, Article number: 203 , pp. 1 - 21 [Scientific article]Open Access
Merlonghi, Lorenzo; Giacinti Baschetti, Marco; De Angelis, Maria Grazia, Modeling Flux Reduction in Multiphase Gas Barrier Materials Trough 3D CFD Approach, in: BOOK OF ABSTRACTS Congresso Nazionale GRICU2022, ISCHIA, 3‐6 Luglio, 2022, 2022, pp. 130 - 131 (atti di: Congresso Nazionale GRICU2022, ISCHIA, 3‐6 Luglio, 2022, Ischia, Italia, 03/06/22-06/06/22) [Abstract]
Atiq, O.; Ricci, E.; Baschetti, M. G.; De Angelis, M. G., Modelling solubility in semi-crystalline polymers: a critical comparative review, «FLUID PHASE EQUILIBRIA», 2022, 556, Article number: 113412 , pp. 1 - 18 [Scientific article]
