Session information

Modeling / Molecular simulation

Processes and Fundamentals

Modeling / Molecular simulation 6

Tue. Jul 11, 2023 2:00 PM - 3:40 PM Room 8 (301 B)

Chair:Fang Xu, Zhaohuan Mai

Cancelled

2:00 PM - 2:25 PM

[O2.MM-09(KN)] Effect of Membrane Surfaces on Nucleation and Growth of Inorganic Crystals

*Elena Tocci¹, Maria Luisa Perrotta¹, Chiara Muzzi¹, Antonio G. Bruno², Francesca Macedonio¹, Enrico Drioli¹ (1. Institute on Membrane Technology, 2. University of Leicester)

2:25 PM - 2:50 PM

[O2.MM-10] Novel assessment of topology and anisotropy of microporous membranes by computational fluid dynamics on digitally-reconstructed real 3D structures

*Alessio Caravella¹, Piergiuseppe Fiore¹, Giulia Azzato¹, Giuseppe de Marco¹ (1. University of Calabria)

2:50 PM - 3:15 PM

[O2.MM-11] Process optimization of a membrane contactor for the separation of chiral amines using computational fluid dynamics

*Gilles Van Eygen^1,2, Anita Buekenhoudt³, Bart Van der Bruggen¹, Patricia Luis^2,4 (1. KU Leuven, 2. UC Louvain, 3. VITO NV, 4. ReCIPE)

3:15 PM - 3:40 PM

[O2.MM-12] Modelling flux reduction of gases in semicrystalline polymers: effect of volume fraction, aspect ratio, dispersion, size distribution and orientation of crystalline domains.

*Lorenzo Merlonghi¹, Marco Giacinti Baschetti¹, Maria Grazia De Angelis² (1. University of Bologna, 2. University of Edinburgh)

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