This work focuses on macromolecule (poly-ε-caprolactone, PCL) self-assembly in acetone/water mixtures by a novel multiscale approach which combines molecular dynamics (MD), a Smoluchowski population balance model (PBM) and computational fluid dynamics (CFD), to model the self-assembly process from the atomistic to the macro-scale.
Soft matter self-assembly in acetone-water mixtures: a multiscale modeling approach / Lavino, ALESSIO DOMENICO; Di Pasquale, Nicodemo; Carbone, Paola; Marchisio, Daniele. - STAMPA. - (2016), p. 22. (Intervento presentato al convegno SARA 2016 tenutosi a Edinburgh, UK nel December 9, 2016).
Soft matter self-assembly in acetone-water mixtures: a multiscale modeling approach
LAVINO, ALESSIO DOMENICO;MARCHISIO, DANIELE
2016
Abstract
This work focuses on macromolecule (poly-ε-caprolactone, PCL) self-assembly in acetone/water mixtures by a novel multiscale approach which combines molecular dynamics (MD), a Smoluchowski population balance model (PBM) and computational fluid dynamics (CFD), to model the self-assembly process from the atomistic to the macro-scale.Pubblicazioni consigliate
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https://hdl.handle.net/11583/2663852
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