FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W3194885414> ?p ?o ?g. }

• W3194885414 endingPage "117024" @default.
• W3194885414 startingPage "117024" @default.
• W3194885414 abstract "• Microstructures and dynamics of ILs/methanol with and without PET were investigated. • A better miscibility between [OAc]-containing ILs and methanol. • Hydrogen-bonding networks exist between cation, anion, and methanol. • Hydroxyl groups of [Cho] cations display a significant interaction with carbonyl groups of PET. • PET oligomers diffuse quite faster in [Cho][OAc]. Ionic liquids (ILs) have proved to be efficient catalysts for the alcoholysis of poly(ethylene terephthalate) (PET). However, the in-depth understanding about the alcoholysis of PET at a molecular level remains scarce. Herein, the microstructures and dynamics of ILs/methanol systems with and without PET oligomer were investigated using molecular dynamics (MD) simulations. A better miscibility between [OAc]-containing ILs and methanol is observed. There exist hydrogen-bonding networks between cation, anion, and methanol, in which the cation serves as a donor and methanol as an acceptor, while the anion/methanol hydrogen-bonding interaction follows the opposite donor–acceptor relationship. In ILs/methanol/PET ternary systems, the hydroxyl groups of [Cho] cations display a more significant interaction with carbonyl groups of PET oligomer than [Emim] cations. In addition, PET oligomer diffuses quite faster in [Cho][OAc] compared to [Emim][OAc]. The information obtained in this work is helpful to better understand the mechanism of the PET alcoholysis process." @default.
• W3194885414 created "2021-08-30" @default.
• W3194885414 creator A5026011213 @default.
• W3194885414 creator A5026765046 @default.
• W3194885414 creator A5051323002 @default.
• W3194885414 creator A5069545004 @default.
• W3194885414 creator A5069585202 @default.
• W3194885414 creator A5086624286 @default.
• W3194885414 date "2022-01-01" @default.
• W3194885414 modified "2023-09-24" @default.
• W3194885414 title "Unveiling the microenvironments between ionic liquids and methanol for alcoholysis of poly(ethylene terephthalate)" @default.
• W3194885414 cites W1545400572 @default.
• W3194885414 cites W1976890226 @default.
• W3194885414 cites W1980221052 @default.
• W3194885414 cites W1984701372 @default.
• W3194885414 cites W1987200073 @default.
• W3194885414 cites W1988073500 @default.
• W3194885414 cites W1993365398 @default.
• W3194885414 cites W1995678695 @default.
• W3194885414 cites W1997879856 @default.
• W3194885414 cites W2001993416 @default.
• W3194885414 cites W2003257483 @default.
• W3194885414 cites W2003949305 @default.
• W3194885414 cites W2019327801 @default.
• W3194885414 cites W2026051257 @default.
• W3194885414 cites W2028139957 @default.
• W3194885414 cites W2029411860 @default.
• W3194885414 cites W2051381895 @default.
• W3194885414 cites W2053707920 @default.
• W3194885414 cites W2056780077 @default.
• W3194885414 cites W2058078276 @default.
• W3194885414 cites W2063394718 @default.
• W3194885414 cites W2063957748 @default.
• W3194885414 cites W2074165404 @default.
• W3194885414 cites W2090962188 @default.
• W3194885414 cites W2165166086 @default.
• W3194885414 cites W2171268876 @default.
• W3194885414 cites W2317047099 @default.
• W3194885414 cites W2317462850 @default.
• W3194885414 cites W2318204074 @default.
• W3194885414 cites W2325030609 @default.
• W3194885414 cites W2560015341 @default.
• W3194885414 cites W2769566580 @default.
• W3194885414 cites W2805649650 @default.
• W3194885414 cites W2908793462 @default.
• W3194885414 cites W2992923196 @default.
• W3194885414 cites W3012199788 @default.
• W3194885414 cites W3016782565 @default.
• W3194885414 cites W3108849936 @default.
• W3194885414 doi "https://doi.org/10.1016/j.ces.2021.117024" @default.
• W3194885414 hasPublicationYear "2022" @default.
• W3194885414 type Work @default.
• W3194885414 sameAs 3194885414 @default.
• W3194885414 citedByCount "3" @default.
• W3194885414 countsByYear W31948854142022 @default.
• W3194885414 countsByYear W31948854142023 @default.
• W3194885414 crossrefType "journal-article" @default.
• W3194885414 hasAuthorship W3194885414A5026011213 @default.
• W3194885414 hasAuthorship W3194885414A5026765046 @default.
• W3194885414 hasAuthorship W3194885414A5051323002 @default.
• W3194885414 hasAuthorship W3194885414A5069545004 @default.
• W3194885414 hasAuthorship W3194885414A5069585202 @default.
• W3194885414 hasAuthorship W3194885414A5086624286 @default.
• W3194885414 hasConcept C110884469 @default.
• W3194885414 hasConcept C112887158 @default.
• W3194885414 hasConcept C121332964 @default.
• W3194885414 hasConcept C147597530 @default.
• W3194885414 hasConcept C154881586 @default.
• W3194885414 hasConcept C161790260 @default.
• W3194885414 hasConcept C178790620 @default.
• W3194885414 hasConcept C185592680 @default.
• W3194885414 hasConcept C188027245 @default.
• W3194885414 hasConcept C26873012 @default.
• W3194885414 hasConcept C2777516009 @default.
• W3194885414 hasConcept C2779607525 @default.
• W3194885414 hasConcept C2779892579 @default.
• W3194885414 hasConcept C2780642029 @default.
• W3194885414 hasConcept C32909587 @default.
• W3194885414 hasConcept C512968161 @default.
• W3194885414 hasConcept C521977710 @default.
• W3194885414 hasConcept C59593255 @default.
• W3194885414 hasConceptScore W3194885414C110884469 @default.
• W3194885414 hasConceptScore W3194885414C112887158 @default.
• W3194885414 hasConceptScore W3194885414C121332964 @default.
• W3194885414 hasConceptScore W3194885414C147597530 @default.
• W3194885414 hasConceptScore W3194885414C154881586 @default.
• W3194885414 hasConceptScore W3194885414C161790260 @default.
• W3194885414 hasConceptScore W3194885414C178790620 @default.
• W3194885414 hasConceptScore W3194885414C185592680 @default.
• W3194885414 hasConceptScore W3194885414C188027245 @default.
• W3194885414 hasConceptScore W3194885414C26873012 @default.
• W3194885414 hasConceptScore W3194885414C2777516009 @default.
• W3194885414 hasConceptScore W3194885414C2779607525 @default.
• W3194885414 hasConceptScore W3194885414C2779892579 @default.
• W3194885414 hasConceptScore W3194885414C2780642029 @default.
• W3194885414 hasConceptScore W3194885414C32909587 @default.
• W3194885414 hasConceptScore W3194885414C512968161 @default.
• W3194885414 hasConceptScore W3194885414C521977710 @default.

• next