Matches in SemOpenAlex for { <https://semopenalex.org/work/W2016121107> ?p ?o ?g. }
- W2016121107 endingPage "224011" @default.
- W2016121107 startingPage "224011" @default.
- W2016121107 abstract "We have performed first principles metadynamics simulations of the grafting process of tetraethoxysilane (TEOS) at two surface sites of dry amorphous silica: the two-membered silicon ring and the isolated silanol. The ab initio activation energies for the grafting reaction are 0.2 eV and 1.4 eV, at the 2M and SiOH sites, respectively. The simulations support the experimental evidence based on IR vibrational spectroscopy that the ring is more reactive than the surface SiOH group for the grating of organosilanes." @default.
- W2016121107 created "2016-06-24" @default.
- W2016121107 creator A5012646575 @default.
- W2016121107 creator A5014039622 @default.
- W2016121107 creator A5053628907 @default.
- W2016121107 date "2008-05-13" @default.
- W2016121107 modified "2023-09-27" @default.
- W2016121107 title "Simulation of the grafting of organosilanes at the surface of dry amorphous silica" @default.
- W2016121107 cites W1855844464 @default.
- W2016121107 cites W1964010416 @default.
- W2016121107 cites W1976869857 @default.
- W2016121107 cites W1977294851 @default.
- W2016121107 cites W1977569451 @default.
- W2016121107 cites W1978633493 @default.
- W2016121107 cites W1989060947 @default.
- W2016121107 cites W1990417626 @default.
- W2016121107 cites W1990548659 @default.
- W2016121107 cites W1999015519 @default.
- W2016121107 cites W2004904244 @default.
- W2016121107 cites W2005135128 @default.
- W2016121107 cites W2014166972 @default.
- W2016121107 cites W2019266755 @default.
- W2016121107 cites W2023271753 @default.
- W2016121107 cites W2028592656 @default.
- W2016121107 cites W2029186981 @default.
- W2016121107 cites W2035266068 @default.
- W2016121107 cites W2040094988 @default.
- W2016121107 cites W2044792071 @default.
- W2016121107 cites W2046823297 @default.
- W2016121107 cites W2052676610 @default.
- W2016121107 cites W2054913898 @default.
- W2016121107 cites W2056308731 @default.
- W2016121107 cites W2072405376 @default.
- W2016121107 cites W2073550251 @default.
- W2016121107 cites W2074784102 @default.
- W2016121107 cites W2075545717 @default.
- W2016121107 cites W2081981955 @default.
- W2016121107 cites W2086957099 @default.
- W2016121107 cites W2089799306 @default.
- W2016121107 cites W2091283009 @default.
- W2016121107 cites W2094046437 @default.
- W2016121107 cites W2113541957 @default.
- W2016121107 cites W2117740704 @default.
- W2016121107 cites W2132428108 @default.
- W2016121107 cites W2149655632 @default.
- W2016121107 cites W2317498826 @default.
- W2016121107 cites W2950963249 @default.
- W2016121107 cites W2951515498 @default.
- W2016121107 cites W2952084653 @default.
- W2016121107 cites W3101808090 @default.
- W2016121107 cites W3103267922 @default.
- W2016121107 cites W4234051711 @default.
- W2016121107 doi "https://doi.org/10.1088/0953-8984/20/22/224011" @default.
- W2016121107 hasPublicationYear "2008" @default.
- W2016121107 type Work @default.
- W2016121107 sameAs 2016121107 @default.
- W2016121107 citedByCount "4" @default.
- W2016121107 countsByYear W20161211072016 @default.
- W2016121107 countsByYear W20161211072023 @default.
- W2016121107 crossrefType "journal-article" @default.
- W2016121107 hasAuthorship W2016121107A5012646575 @default.
- W2016121107 hasAuthorship W2016121107A5014039622 @default.
- W2016121107 hasAuthorship W2016121107A5053628907 @default.
- W2016121107 hasConcept C127413603 @default.
- W2016121107 hasConcept C147597530 @default.
- W2016121107 hasConcept C147789679 @default.
- W2016121107 hasConcept C153642686 @default.
- W2016121107 hasConcept C161790260 @default.
- W2016121107 hasConcept C178790620 @default.
- W2016121107 hasConcept C185592680 @default.
- W2016121107 hasConcept C188027245 @default.
- W2016121107 hasConcept C192562407 @default.
- W2016121107 hasConcept C2775937945 @default.
- W2016121107 hasConcept C2777581007 @default.
- W2016121107 hasConcept C2780378348 @default.
- W2016121107 hasConcept C2993056060 @default.
- W2016121107 hasConcept C42360764 @default.
- W2016121107 hasConcept C521977710 @default.
- W2016121107 hasConcept C544956773 @default.
- W2016121107 hasConcept C56052488 @default.
- W2016121107 hasConcept C59593255 @default.
- W2016121107 hasConcept C62752575 @default.
- W2016121107 hasConcept C8010536 @default.
- W2016121107 hasConceptScore W2016121107C127413603 @default.
- W2016121107 hasConceptScore W2016121107C147597530 @default.
- W2016121107 hasConceptScore W2016121107C147789679 @default.
- W2016121107 hasConceptScore W2016121107C153642686 @default.
- W2016121107 hasConceptScore W2016121107C161790260 @default.
- W2016121107 hasConceptScore W2016121107C178790620 @default.
- W2016121107 hasConceptScore W2016121107C185592680 @default.
- W2016121107 hasConceptScore W2016121107C188027245 @default.
- W2016121107 hasConceptScore W2016121107C192562407 @default.
- W2016121107 hasConceptScore W2016121107C2775937945 @default.
- W2016121107 hasConceptScore W2016121107C2777581007 @default.
- W2016121107 hasConceptScore W2016121107C2780378348 @default.
- W2016121107 hasConceptScore W2016121107C2993056060 @default.
- W2016121107 hasConceptScore W2016121107C42360764 @default.
- W2016121107 hasConceptScore W2016121107C521977710 @default.