FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W1567866466> ?p ?o ?g. }

• W1567866466 abstract "Polytetrafluoroethylene (Teflon®) is encountered in many environments – frying pans, clothing, osmotic distillation membranes, to name a few – yet the solubility and clustering behaviour of water with this material was not found in the open literature. This information may be useful in applications where an absence of water is desired, such as in clothing and textiles. Previous work on polyethylene + water has shown that small water clusters form in the amorphous portion of the polymer. This work investigated this phenomenon for the case of polytetrafluoroethylene + water. Initially, a test system of light alcohols + water + n-dodecane was investigated using Gibbs Ensemble Monte Carlo simulations and compared to previous laboratory experiments. This test system was investigated in order to gain expertise in the methodologies and theory behind Monte Carlo simulation, as well as to gain experience with using the necessary software. For this test system, it was found that the TraPPE parameters representing the interactions between the alcohols and the n-dodecane were not adequate and lead to increasing deviations with increasing carbon number in the alcohol. To replicate the conditions of the amorphous polymer matrix, liquid-liquid equilibrium between water and the polymer was investigated. Gibbs Ensemble Monte Carlo simulations have been performed for systems of perfluoroalkanes and water to determine the influence of temperature and carbon number on the solubility and clustering behaviour of water within the perfluoroalkanes. The temperature range in this study was from 450 K to 600 K, and the perfluoroalkane carbon number range was from 8 to 300 carbon atoms. With increasing carbon number, it was found that there was an asymptotic value of 98.0 mole percent water in the polymer phase. With increasing temperatures it was found that there were exponential increases in solubility of water into the polymer matrix. Previous work on clustering and supramolecular structure of perfluoroalkanes described the rigidity of the perfluoroalkane chains in comparison to alkane chains, thus explaining the large increases in free volume with increasing temperature in the polymer matrix observed in this work. A discontinuity with regard to both solubility and clustering behavior was observed for a polymer carbon number of 10 to 12 carbon atoms. Prior work on the energy contributions towards the helical structure of perfluoroalkanes showed a shift in the energy contribution regime for carbon numbers larger than ~10 carbon atoms, which may explain this discontinuity. It was found that linear water clusters accounted for up to ~90 percent of the water clusters, concurring with previous work on water clustering in polyethylene." @default.
• W1567866466 created "2016-06-24" @default.
• W1567866466 creator A5007088213 @default.
• W1567866466 date "2011-01-01" @default.
• W1567866466 modified "2023-09-27" @default.
• W1567866466 title "Monte Carlo simulations of systems of light alcohols + water + n-dodecane and water solubility and structures in polytetrafluoroethylene." @default.
• W1567866466 cites W1491824558 @default.
• W1567866466 cites W1503999617 @default.
• W1567866466 cites W1510362854 @default.
• W1567866466 cites W1516218868 @default.
• W1567866466 cites W1518085033 @default.
• W1567866466 cites W1518747218 @default.
• W1567866466 cites W1526367188 @default.
• W1567866466 cites W1551364856 @default.
• W1567866466 cites W1586794894 @default.
• W1567866466 cites W1965438743 @default.
• W1567866466 cites W1975507694 @default.
• W1567866466 cites W1976053633 @default.
• W1567866466 cites W1984104023 @default.
• W1567866466 cites W1987193967 @default.
• W1567866466 cites W1989163589 @default.
• W1567866466 cites W1991601522 @default.
• W1567866466 cites W1995116238 @default.
• W1567866466 cites W1996210157 @default.
• W1567866466 cites W1997704471 @default.
• W1567866466 cites W1999062034 @default.
• W1567866466 cites W2001093338 @default.
• W1567866466 cites W2001676859 @default.
• W1567866466 cites W2003670327 @default.
• W1567866466 cites W2008312376 @default.
• W1567866466 cites W2010587930 @default.
• W1567866466 cites W2012986398 @default.
• W1567866466 cites W2013979082 @default.
• W1567866466 cites W2016898693 @default.
• W1567866466 cites W2016903896 @default.
• W1567866466 cites W2023158146 @default.
• W1567866466 cites W2029723863 @default.
• W1567866466 cites W2030787892 @default.
• W1567866466 cites W2030971064 @default.
• W1567866466 cites W2031208268 @default.
• W1567866466 cites W2039794499 @default.
• W1567866466 cites W2041902442 @default.
• W1567866466 cites W2048675518 @default.
• W1567866466 cites W2049475242 @default.
• W1567866466 cites W2053086566 @default.
• W1567866466 cites W2053875610 @default.
• W1567866466 cites W2056760934 @default.
• W1567866466 cites W2060684620 @default.
• W1567866466 cites W2065746459 @default.
• W1567866466 cites W2070710114 @default.
• W1567866466 cites W2076591604 @default.
• W1567866466 cites W2077953230 @default.
• W1567866466 cites W2078402834 @default.
• W1567866466 cites W2086319521 @default.
• W1567866466 cites W2091351360 @default.
• W1567866466 cites W2094254655 @default.
• W1567866466 cites W2097194736 @default.
• W1567866466 cites W2118717214 @default.
• W1567866466 cites W2121214624 @default.
• W1567866466 cites W2136968473 @default.
• W1567866466 cites W2153102171 @default.
• W1567866466 cites W2153288616 @default.
• W1567866466 cites W2157081197 @default.
• W1567866466 cites W2158844256 @default.
• W1567866466 cites W2162581698 @default.
• W1567866466 cites W2165431578 @default.
• W1567866466 cites W2169861002 @default.
• W1567866466 cites W2318311418 @default.
• W1567866466 cites W2798297576 @default.
• W1567866466 cites W3036155690 @default.
• W1567866466 cites W328030011 @default.
• W1567866466 cites W609191808 @default.
• W1567866466 cites W2124191860 @default.
• W1567866466 hasPublicationYear "2011" @default.
• W1567866466 type Work @default.
• W1567866466 sameAs 1567866466 @default.
• W1567866466 citedByCount "0" @default.
• W1567866466 crossrefType "dissertation" @default.
• W1567866466 hasAuthorship W1567866466A5007088213 @default.
• W1567866466 hasConcept C105795698 @default.
• W1567866466 hasConcept C121332964 @default.
• W1567866466 hasConcept C155574463 @default.
• W1567866466 hasConcept C178790620 @default.
• W1567866466 hasConcept C185592680 @default.
• W1567866466 hasConcept C192562407 @default.
• W1567866466 hasConcept C19499675 @default.
• W1567866466 hasConcept C2775846362 @default.
• W1567866466 hasConcept C2780557906 @default.
• W1567866466 hasConcept C33923547 @default.
• W1567866466 hasConcept C521977710 @default.
• W1567866466 hasConcept C56052488 @default.
• W1567866466 hasConcept C97355855 @default.
• W1567866466 hasConceptScore W1567866466C105795698 @default.
• W1567866466 hasConceptScore W1567866466C121332964 @default.
• W1567866466 hasConceptScore W1567866466C155574463 @default.
• W1567866466 hasConceptScore W1567866466C178790620 @default.
• W1567866466 hasConceptScore W1567866466C185592680 @default.
• W1567866466 hasConceptScore W1567866466C192562407 @default.
• W1567866466 hasConceptScore W1567866466C19499675 @default.
• W1567866466 hasConceptScore W1567866466C2775846362 @default.

• next