Microphase separation and morphology of the real polymer system by dynamic density functional theory, based on the equation of state / Hui Xu in Industrial & engineering chemistry research, Vol. 47 N°17 (Septembre 2008)  

Public ISBD [article]  inIndustrial & engineering chemistry research > Vol. 47 N°17 (Septembre 2008) . - p. 6368–6373 Titre : Microphase separation and morphology of the real polymer system by dynamic density functional theory, based on the equation of state Type de document : texte imprimé Auteurs : Hui Xu, Auteur ; Tengfang Wang, Auteur ; Yongmin Huang, Auteur Année de publication : 2008 Article en page(s) : p. 6368–6373 Note générale : Chemical engineering Langues : Anglais (eng) Mots-clés : Polystyrene blends Polybutadiene EOS-based DDFT Résumé : Microphase separation and morphology evolution of polystyrene and polybutadiene blends are quantitatively studied by the dynamic density functional theory that is based on the equation of state (EOS-based DDFT). The structure parameters of coarse-grained beads are regressed from the experimental pressure−volume−temperature data of pure components. The comparisons between simulated and experimental results are presented as illustrations. Notably, in the region near the critical composition, the deviation of the order−disorder transition temperature between simulation and experiment is En ligne : http://pubs.acs.org/doi/abs/10.1021/ie701776r [article] Microphase separation and morphology of the real polymer system by dynamic density functional theory, based on the equation of state [texte imprimé] / Hui Xu, Auteur ; Tengfang Wang, Auteur ; Yongmin Huang, Auteur . - 2008 . - p. 6368–6373. Chemical engineering Langues : Anglais (eng) in Industrial & engineering chemistry research > Vol. 47 N°17 (Septembre 2008) . - p. 6368–6373 Mots-clés : Polystyrene blends Polybutadiene EOS-based DDFT Résumé : Microphase separation and morphology evolution of polystyrene and polybutadiene blends are quantitatively studied by the dynamic density functional theory that is based on the equation of state (EOS-based DDFT). The structure parameters of coarse-grained beads are regressed from the experimental pressure−volume−temperature data of pure components. The comparisons between simulated and experimental results are presented as illustrations. Notably, in the region near the critical composition, the deviation of the order−disorder transition temperature between simulation and experiment is En ligne : http://pubs.acs.org/doi/abs/10.1021/ie701776r

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