Grazia De Angelis

2025

A second-order Dry Glass Reference Perturbation Theory for modeling sorption in glassy polymers: Applications to systems containing light gases, alcohols, and water vapor

Ismaeel, H., Marshall, B., Ricci, E. & De Angelis, M. G., Aug 2025, In: Fluid phase equilibria. 595, 114410.

Research output: Contribution to journal › Article › peer-review

Open Access

Chemical engineering contribution to hemodialysis innovation: achieving the wearable artificial kidneys with nanomaterial-based dialysate regeneration

Zarghamidehaghani, M., Fabiani, T. & De Angelis, G., 5 Mar 2025, (E-pub ahead of print) In: Physical Sciences Reviews. 10, 3, p. 279-299

Research output: Contribution to journal › Article › peer-review

Open Access

Modelling Gas Transport in Multiphasic Materials: Application to Semicrystalline Membranes

Merlonghi, L., Giacinti Baschetti, M. & De Angelis, G., 2 Mar 2025, (E-pub ahead of print) In: Membranes. 15, 3, 76.

Research output: Contribution to journal › Article › peer-review

Open Access

File

2024

New 2D Metal-Organic Monoacid Framework (MOmAF): Realization of Extreme Water Repellence

Chen, T., Wei, X., Fabiani, T., Liu, B., Yang, Y., Lewis, A., Mazlan, N. A., Butt, F. S., Chen, S., Gu, Q., Radacsi, N., Wang, H., De Angelis, M. G., Yang, S., Chen, H. & Huang, Y., 12 Dec 2024, In: Small. 20, 50, p. e2404224 2404224.

Research output: Contribution to journal › Article › peer-review

Open Access

Sorbent-based dialysate regeneration for the wearable artificial kidney: Advancing material innovation via experimental and computational studies

Fabiani, T., Zarghamidehaghani, M., Boi, C., Dimartino, S., Kentish, S. & De Angelis, G., 8 Jul 2025, In: Separation and Purification Technology. 360, 1, 130776.

Research output: Contribution to journal › Review article › peer-review

Open Access

File

Exploring the membrane-based separation of CO2/CO mixtures for CO2 capture and utilisation processes: Challenges and opportunities

Checchetto, R., De Angelis, G. & Minelli, M., 30 Oct 2024, In: Separation and Purification Technology. 346, 20 p., 127401.

Research output: Contribution to journal › Review article › peer-review

Open Access

File

An experimental study of hydrogen sorption and permeation in high-performance polyamides

Merlonghi, L., Atiq, O., Rea, R., Mangano, E., Stroeks, A., Giacinti Baschetti, M. & De Angelis, M. G., 28 Oct 2024, In: International journal of hydrogen energy. 88, p. 1463-1473 11 p.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Modelling Across Multiple Scales to Design Biopolymer Membranes for Sustainable Gas Separations: 2-Multiscale Approach

Papchenko, K., Ricci, E. & De Angelis, M. G., Oct 2024, In: Polymers. 16, 19, 2776.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Molecular Simulations of Hydrogen Sorption in Semicrystalline High-Density Polyethylene: The Impact of the Surface Fraction of Tie-Chains

Atiq, O., Ricci, E., Baschetti, M. G. & De Angelis, G., 21 Mar 2024, In: Journal of Physical Chemistry B (Soft Condensed Matter and Biophysical Chemistry). 128, 11, p. 2799-2810

Research output: Contribution to journal › Article › peer-review

Open Access

File

Estimating Gas Sorption In Polymeric Membranes From The Molecular Structure: A Machine Learning Based Group Contribution Method For The Non-Equilibrium Lattice Fluid Model (ML-GC-NELF)

Ismaeel, H., Gibson, D., Ricci, E. & De Angelis, M. G., 5 Feb 2024, In: Journal of Membrane Science. 691, 122220.

Research output: Contribution to journal › Article › peer-review

Open Access

File

2023

A perspective on data-driven screening and discovery of polymer membranes for gas separation, from the molecular structure to the industrial performance

Ricci, E. & Angelis, M. G. D., 21 Nov 2023, In: Reviews in Chemical Engineering.

Research output: Contribution to journal › Review article › peer-review

In silico screening of nanoporous materials for urea removal in hemodialysis applications

Fabiani, T., Ricci, E., Boi, C., Dimartino, S. & De Angelis, G., 21 Sept 2023, In: Physical Chemistry Chemical Physics. 25, 35, p. 24069-24080

Research output: Contribution to journal › Article › peer-review

Open Access

File

Simple lattice model explains equilibrium separation phenomena in glassy polymers

Yuan, T., De Angelis, M. G. & Sarkisov, L., 7 Aug 2023, In: The Journal of Chemical Physics. 159, 5, 054705.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Multi-scale modeling of gas solubility in semi-crystalline polymers: bridging Molecular Dynamics with Lattice Fluid Theory

Atiq, O., Ricci, E., Giacinti Baschetti, M. & De Angelis, M. G., Jul 2023, In: Fluid phase equilibria. 570, 113798.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Fully Biobased Polyhydroxyalkanoate/Tannin Films as Multifunctional Materials for Smart Food Packaging Applications

Ferri, M., Papchenko, K., Degli Esposti, M., Tondi, G., De Angelis, MG., Morselli, D. & Fabbri, P., 14 Jun 2023, In: ACS Applied Materials & Interfaces. 15, 23, p. 28594-28605 12 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Modelling across Multiple Scales to Design Biopolymer Membranes for Sustainable Gas Separations: 1—Atomistic Approach

Papchenko, K., Ricci, E. & De angelis, M. G., 6 Apr 2023, (E-pub ahead of print) In: Polymers. 15, 7, p. 1805 1805.

Research output: Contribution to journal › Article › peer-review

Open Access

2022

New sustainable routes for gas separation membranes: The properties of poly(hydroxybutyrate-co-hydroxyvalerate) cast from green solvents

Papchenko, K., Degli Esposti, M., Minelli, M., Fabbri, P., Morselli, D. & De Angelis, M. G., 15 Oct 2022, In: Journal of Membrane Science. 660, 120847.

Research output: Contribution to journal › Article › peer-review

Open Access

File

A view on the future of Applied Thermodynamics

de Hemptinne, J-C., Kontogeorgis, G., Dohrn, R., Economou, I., Ten Kate, A., Kuitunen, S., Fele Žilnik, L., De Angelis, G. & Vesovic, V., 5 Oct 2022, In: Industrial & Engineering Chemistry Research. 61, 39, p. 14664-14680

Research output: Contribution to journal › Article › peer-review

Open Access

File

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

Checchetto, R., Scarpa, M., De Angelis, G. & Minelli, M., 5 Oct 2022, In: Journal of Membrane Science. 659, 120768.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Modelling Sorption and Transport of Gases in Polymeric Membranes across Different Scales: A Review

Ricci, E., Minelli, M. & De Angelis, G., Sept 2022, In: Membranes. 12, 9, 857.

Research output: Contribution to journal › Review article › peer-review

Open Access

File

One year of surgical mask testing at the University of Bologna labs: Lessons learned from data analysis

Boi, C., Borsetti, F., Brugo, T. M., Cappelletti, M., De Angelis, M. G., Fedi, S., Di Giacomo, S., Fabiani, T., Foli, G., Garelli, A., Genchi, U., Ghezzi, D., Gualandi, C., Lalli, E., Magnani, M., Maurizzi, A., Mazzi, F., Mehrabi, N., Minelli, M., Montalbano, R., & 22 othersMorelli, L., Nici, S., Onesti, R., Paglianti, A., Papchenko, K., Pappalardo, S., Parisi, N. F., Rapino, S., Reggio, M., Roselli, M., Ruggeri, E., Sabatini, L., Saracino, E., Scarponi, G. E., Serra, L., Signorini, V., Storione, A., Torsello, M., Tugnoli, E., Vargiu, C. M., Vidali, G. & Violante, F. S., 1 Aug 2022, In: Separation and Purification Technology. 294, 121180.

Research output: Contribution to journal › Article › peer-review

Open Access

File

A comprehensive theoretical framework for the sub and supercritical sorption and transport of CO₂ in polymers

Ricci, E., De Angelis, M. G. & Minelli, M., 1 May 2022, In: Chemical Engineering Journal. 435, 135013.

Research output: Contribution to journal › Article › peer-review

Modelling solubility in semi-crystalline polymers: a critical comparative review

Atiq, O., Ricci, E., Baschetti, M. G. & De Angelis, G., 1 May 2022, In: Fluid phase equilibria. 556, p. 1-18 113412.

Research output: Contribution to journal › Review article › peer-review

Open Access

Mixed Matrix Membranes Adsorbers (MMMAs) for the Removal of Uremic Toxins from Dialysate

De Pascale, M., De Angelis, M. G. & Boi, C., 9 Feb 2022, In: Membranes. 12, 2, 203.

Research output: Contribution to journal › Article › peer-review

Open Access

2021

Enabling experimental characterization and prediction of ternary mixed-gas sorption in polymers: C2H6/CO2/CH4 in PIM-1

Ricci, E., Benedetti, F. M., Noto, A., Merkel, T., Jin, J. & De Angelis, G., 15 Dec 2021, In: Chemical Engineering Journal. 426, p. 1 17 p., 130715.

Research output: Contribution to journal › Article › peer-review

Open Access

File

Mixed matrix membranes based on torlon® and ZIF-8 for high-temperature, size-selective gas separations

De Pascale, M., Benedetti, F. M., Lasseuguette, E., Ferrari, M. C., Papchenko, K., Esposti, M. D., Fabbri, P. & De Angelis, M. G., 15 Dec 2021, In: Membranes. 11, 12, 982.

Research output: Contribution to journal › Article › peer-review

Open Access

The influence of propane and n-butane on the structure and separation performance of cellulose acetate membranes

Liu, L., Doherty, C., Ricci, E., Chen, G. Q., De Angelis, G. & Kentish, S., 15 Nov 2021, In: Journal of Membrane Science. 638, 119677.

Research output: Contribution to journal › Article › peer-review

Towards a systematic determination of multicomponent gas separation with membranes: the case of CO₂/CH₄ in cellulose acetates

Ricci, E., Di Maio, E., Degli Esposti, M., Liu, L., Mensitieri, G., Fabbri, P., Kentish, S. & De Angelis, G., 15 Jun 2021, In: Journal of Membrane Science. 628, 20 p., 119226.

Research output: Contribution to journal › Article › peer-review

Open Access

File

An Analysis of the Effect of ZIF-8 Addition on the Separation Properties of Polysulfone at Various Temperatures

Papchenko, K., Risaliti, G., Ferroni, M., Christian, M. & De Angelis, G., 4 Jun 2021, In: Membranes. 11, 6, 24 p., 427.

Research output: Contribution to journal › Article › peer-review

Open Access

Gas Transport in Glassy Polymers

De Angelis, G. (ed.) & Sarti, G. C. (ed.), Apr 2021, Basel: Multidisciplinary Digital Publishing Institute (MDPI). 258 p.

Research output: Book/Report › Book

Open Access

2020

Gas transport in glassy polymers

De Angelis, M. G. & Sarti, G. C., 7 Dec 2020, In: Membranes. 10, 12, p. 1-5 5 p.

Research output: Contribution to journal › Editorial › peer-review

Open Access

Competitive sorption in CO2/CH4 separations: the case of HAB-6FDA polyimide and its TR derivative and a general analysis of its impact on the selectivity of glassy polymers at multicomponent conditions

Ricci, E., Benedetti, F. M., Dose, M. E., De Angelis, M. G., Freeman, B. D. & Paul, D. R., 15 Oct 2020, In: Journal of Membrane Science. 612, 118374.

Research output: Contribution to journal › Article › peer-review

Molecular Simulations and Mechanistic Analysis of the Effect of CO2 Sorption on Thermodynamics, Structure, and Local Dynamics of Molten Atactic Polystyrene

Ricci, E., Vergadou, N., Vogiatzis, G. G., Angelis, M. G. D. & Theodorou, D. N., 26 May 2020, In: Macromolecules. 53, 10, p. 3669–3689

Research output: Contribution to journal › Article › peer-review

Open Access

Molecular Simulations and Mechanistic Analysis of the Effect of CO2Sorption on Thermodynamics, Structure, and Local Dynamics of Molten Atactic Polystyrene

Ricci, E., Vergadou, N., Vogiatzis, G. G., De Angelis, M. G. & Theodorou, D. N., 11 May 2020, In: Macromolecules. 53, 10, p. 3669-3689 21 p.

Research output: Contribution to journal › Article › peer-review

Enhancing the separation performance of glassy PPO with the addition of a molecular sieve (ZIF-8): Gas transport at various temperatures

Benedetti, F. M., De Angelis, M. G., Esposti, M. D., Fabbri, P., Masili, A., Orsini, A. & Pettinau, A., 27 Mar 2020, In: Membranes. 10, 4, 56.

Research output: Contribution to journal › Article › peer-review

Open Access

Competitive H2S – CO2 absorption in reactive aqueous methyldiethanolamine solution: Prediction with ePC-SAFT

Cleeton, C., Kvam, O., Rea, R., Sarkisov, L. & De Angelis, M. G., 10 Jan 2020, (E-pub ahead of print) In: Fluid phase equilibria. 511, 112453.

Research output: Contribution to journal › Article › peer-review

2019

Sorption of CO2/CH4 mixtures in TZ-PIM, PIM-1 and PTMSP: Experimental data and NELF-model analysis of competitive sorption and selectivity in mixed gases

Ricci, E., Gemeda, A. E., Du, N., Li, N., De Angelis, M. G., Guiver, M. D. & Sarti, G. C., 1 Sept 2019, In: Journal of Membrane Science. 585, p. 136-149 14 p.

Research output: Contribution to journal › Article › peer-review

Tuning the Molecular Weights, Chain Packing, and Gas-Transport Properties of CANAL Ladder Polymers by Short Alkyl Substitutions

Lai, H. W. H., Benedetti, F. M., Jin, Z., Teo, Y. C., Wu, A. X., De Angelis, M. G., Smith, Z. P. & Xia, Y., 27 Aug 2019, In: Macromolecules. 52, 16, p. 6294-6302 9 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Modelling Mixed-Gas Sorption in Glassy Polymers for CO2 Removal: A Sensitivity Analysis of the Dual Mode Sorption Model

Ricci, E. & Angelis, M. G. D., 4 Jan 2019, In: Membranes. 9, 1

Research output: Contribution to journal › Article › peer-review

Open Access

Modelling mixed-gas sorption in glassy polymers for CO 2 removal: A sensitivity analysis of the dual mode sorption model

Ricci, E. & De Angelis, M. G., 4 Jan 2019, In: Membranes. 9, 1, 8.

Research output: Contribution to journal › Article › peer-review

Open Access

2018

Reducing ageing of thin PTMSP films by incorporating graphene and graphene oxide: Effect of thickness, gas type and temperature

Olivieri, L., Meneguzzo, S., Ligi, S., Saccani, A., Giorgini, L., Orsini, A., Pettinau, A. & De Angelis, M. G., 1 Jun 2018, In: Journal of Membrane Science. 555, p. 258-267 10 p.

Research output: Contribution to journal › Article › peer-review

Barrier properties and mechanical strength of bio-renewable, heat-sealable films based on gelatin, glycerol and soybean oil for sustainable food packaging

Ciannamea, E. M., Castillo, L. A., Barbosa, S. E. & De Angelis, M. G., 1 Apr 2018, In: Reactive and Functional Polymers. 125, p. 29-36 8 p.

Research output: Contribution to journal › Article › peer-review

Permeability and selectivity of PPO/graphene composites as mixed matrix membranes for CO2 capture and gas separation

Rea, R., Ligi, S., Christian, M., Morandi, V., Baschetti, M. G. & de Angelis, M. G., 29 Jan 2018, In: Polymers. 10, 2, 129.

Research output: Contribution to journal › Article › peer-review

Open Access

Effect of relative humidity on the gas transport properties of zeolite A/PTMSP mixed matrix membranes

Fernández-Barquín, A., Rea, R., Venturi, D., Giacinti-Baschetti, M., De Angelis, M. G., Casado-Coterillo, C. & Irabien, Á., 17 Jan 2018, In: RSC Advances. 8, 7, p. 3536-3546 11 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Evaluation of electrospun nanofibrous mats as materials for CO2 capture: A feasibility study on functionalized poly(acrylonitrile) (PAN)

Olivieri, L., Roso, M., De Angelis, M. G. & Lorenzetti, A., 15 Jan 2018, In: Journal of Membrane Science. 546, p. 128-138 11 p.

Research output: Contribution to journal › Article › peer-review

2017

Sorption, diffusion, and permeability of humid gases and aging of thermally rearranged (TR) polymer membranes from a novel ortho-hydroxypolyimide

Comesaña-Gandara, B., Ansaloni, L., Lee, Y. M., Lozano, A. E. & De Angelis, M. G., 15 Nov 2017, In: Journal of Membrane Science. 542, p. 439-455 17 p.

Research output: Contribution to journal › Article › peer-review

How to monitor HPMC concentration through conductivity measurement

Zakhvatayeva, A., De Angelis, M. G., De Carolis, C., Pirera, P. & Resta, A., 2 Oct 2017, In: Pharmaceutical Technology. 41, 10, p. 46-52 7 p.

Research output: Contribution to journal › Article › peer-review

Open Access

Grazia De Angelis

Research output

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