FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2059334877> ?p ?o ?g. }

• W2059334877 endingPage "5035" @default.
• W2059334877 startingPage "5029" @default.
• W2059334877 abstract "Molecular dynamics simulations using two all-atom force fields, the OPLS force field of Jorgensen et al. and the recently developed force field of Borodin et al. (exp-6), have been used to study the equilibrium liquid−vapor interface properties of perfluorinated alkanes. Both force fields predict similar liquid densities and are in excellent agreement with existing experimental data for short chains. The OPLS force field offers better agreement with experimental data for surface tension at lower molecular weights than the exp-6 force field, which overpredicts it by as much as 9%. However, for longer chains the OPLS force field predicts higher surface tension than the exp-6 force field. Also, the OPLS substantially overpredicts the melting temperature confirming a recent suggestion that this force field may not be transferable to longer perfluorinated alkane chains. The orientation of the chains at the surface is found to be strongly dependent on both chain length and temperature. On average, the chain segments tend to orient perpendicular to the surface with the −CF3 end segments at the surface." @default.
• W2059334877 created "2016-06-24" @default.
• W2059334877 creator A5001454717 @default.
• W2059334877 creator A5072768235 @default.
• W2059334877 date "2008-03-07" @default.
• W2059334877 modified "2023-09-23" @default.
• W2059334877 title "Surface Tension and Surface Orientation of Perfluorinated Alkanes" @default.
• W2059334877 cites W1672666614 @default.
• W2059334877 cites W1968196838 @default.
• W2059334877 cites W1968291688 @default.
• W2059334877 cites W1974128000 @default.
• W2059334877 cites W1974835203 @default.
• W2059334877 cites W1975507694 @default.
• W2059334877 cites W1978132962 @default.
• W2059334877 cites W1987395781 @default.
• W2059334877 cites W1999277179 @default.
• W2059334877 cites W2002877343 @default.
• W2059334877 cites W2004291098 @default.
• W2059334877 cites W2013343005 @default.
• W2059334877 cites W2018397400 @default.
• W2059334877 cites W2019465613 @default.
• W2059334877 cites W2019703704 @default.
• W2059334877 cites W2019720929 @default.
• W2059334877 cites W2024478338 @default.
• W2059334877 cites W2027281853 @default.
• W2059334877 cites W2029723863 @default.
• W2059334877 cites W2030697575 @default.
• W2059334877 cites W2030710841 @default.
• W2059334877 cites W2033461008 @default.
• W2059334877 cites W2047514627 @default.
• W2059334877 cites W2048998347 @default.
• W2059334877 cites W2053086566 @default.
• W2059334877 cites W2056387310 @default.
• W2059334877 cites W2063226885 @default.
• W2059334877 cites W2069181636 @default.
• W2059334877 cites W2084992405 @default.
• W2059334877 cites W2090555333 @default.
• W2059334877 cites W2094395150 @default.
• W2059334877 cites W2110128220 @default.
• W2059334877 cites W2150320555 @default.
• W2059334877 cites W2157275347 @default.
• W2059334877 cites W2329277949 @default.
• W2059334877 cites W4211219673 @default.
• W2059334877 doi "https://doi.org/10.1021/jp710678w" @default.
• W2059334877 hasPublicationYear "2008" @default.
• W2059334877 type Work @default.
• W2059334877 sameAs 2059334877 @default.
• W2059334877 citedByCount "30" @default.
• W2059334877 countsByYear W20593348772012 @default.
• W2059334877 countsByYear W20593348772013 @default.
• W2059334877 countsByYear W20593348772014 @default.
• W2059334877 countsByYear W20593348772015 @default.
• W2059334877 countsByYear W20593348772016 @default.
• W2059334877 countsByYear W20593348772017 @default.
• W2059334877 countsByYear W20593348772018 @default.
• W2059334877 countsByYear W20593348772019 @default.
• W2059334877 countsByYear W20593348772020 @default.
• W2059334877 countsByYear W20593348772022 @default.
• W2059334877 crossrefType "journal-article" @default.
• W2059334877 hasAuthorship W2059334877A5001454717 @default.
• W2059334877 hasAuthorship W2059334877A5072768235 @default.
• W2059334877 hasConcept C10803110 @default.
• W2059334877 hasConcept C119049451 @default.
• W2059334877 hasConcept C121332964 @default.
• W2059334877 hasConcept C147597530 @default.
• W2059334877 hasConcept C159467904 @default.
• W2059334877 hasConcept C178790620 @default.
• W2059334877 hasConcept C185592680 @default.
• W2059334877 hasConcept C199631012 @default.
• W2059334877 hasConcept C202444582 @default.
• W2059334877 hasConcept C2524010 @default.
• W2059334877 hasConcept C2776799497 @default.
• W2059334877 hasConcept C2777207669 @default.
• W2059334877 hasConcept C2781327020 @default.
• W2059334877 hasConcept C33923547 @default.
• W2059334877 hasConcept C38660458 @default.
• W2059334877 hasConcept C59593255 @default.
• W2059334877 hasConcept C62520636 @default.
• W2059334877 hasConcept C8892853 @default.
• W2059334877 hasConcept C9652623 @default.
• W2059334877 hasConcept C97355855 @default.
• W2059334877 hasConceptScore W2059334877C10803110 @default.
• W2059334877 hasConceptScore W2059334877C119049451 @default.
• W2059334877 hasConceptScore W2059334877C121332964 @default.
• W2059334877 hasConceptScore W2059334877C147597530 @default.
• W2059334877 hasConceptScore W2059334877C159467904 @default.
• W2059334877 hasConceptScore W2059334877C178790620 @default.
• W2059334877 hasConceptScore W2059334877C185592680 @default.
• W2059334877 hasConceptScore W2059334877C199631012 @default.
• W2059334877 hasConceptScore W2059334877C202444582 @default.
• W2059334877 hasConceptScore W2059334877C2524010 @default.
• W2059334877 hasConceptScore W2059334877C2776799497 @default.
• W2059334877 hasConceptScore W2059334877C2777207669 @default.
• W2059334877 hasConceptScore W2059334877C2781327020 @default.
• W2059334877 hasConceptScore W2059334877C33923547 @default.
• W2059334877 hasConceptScore W2059334877C38660458 @default.
• W2059334877 hasConceptScore W2059334877C59593255 @default.
• W2059334877 hasConceptScore W2059334877C62520636 @default.

• next