FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2057648287> ?p ?o ?g. }

• W2057648287 endingPage "15707" @default.
• W2057648287 startingPage "15699" @default.
• W2057648287 abstract "The mechanism and kinetics of single-walled carbon nanotube (SWNT) nucleation from Fe- and Ni-carbide nanoparticle precursors have been investigated using quantum chemical molecular dynamics (QM/MD) methods. The dependence of the nucleation mechanism and its kinetics on environmental factors, including temperature and metal-carbide carbon concentration, has also been elucidated. It was observed that SWNT nucleation occurred via three distinct stages, viz. the precipitation of the carbon from the metal-carbide, the formation of a “surface/subsurface” carbide intermediate species, and finally the formation of a nascent sp2-hybidrized carbon structure supported by the metal catalyst. The SWNT cap nucleation mechanism itself was unaffected by carbon concentration and/or temperature. However, the kinetics of SWNT nucleation exhibited distinct dependences on these same factors. In particular, SWNT nucleation from NixCy nanoparticles proceeded more favorably compared to nucleation from FexCy nanoparticles. Although SWNT nucleation from FexCy and NixCy nanoparticle precursors occurred via an identical route, the ultimate outcomes of these processes also differed substantially. Explicitly, the Nix-supported sp2-hybridized carbon structures tended to encapsulate the catalyst particle itself, whereas the Fex-supported structures tended to form isolated SWNT cap structures on the catalyst surface. These differences in SWNT nucleation kinetics were attributed directly to the relative strengths of the metal−carbon interaction, which also dictates the precipitation of carbon from the nanoparticle bulk and the longevity of the resultant surface/subsurface carbide species. The stability of the surface/subsurface carbide was also influenced by the phase of the nanoparticle itself. The observations agree well with experimentally available data for SWNT growth on iron and nickel catalyst particles." @default.
• W2057648287 created "2016-06-24" @default.
• W2057648287 creator A5017249076 @default.
• W2057648287 creator A5020600412 @default.
• W2057648287 creator A5023941889 @default.
• W2057648287 creator A5071850859 @default.
• W2057648287 creator A5074396718 @default.
• W2057648287 date "2010-10-20" @default.
• W2057648287 modified "2023-10-02" @default.
• W2057648287 title "QM/MD Simulation of SWNT Nucleation on Transition-Metal Carbide Nanoparticles" @default.
• W2057648287 cites W1973659687 @default.
• W2057648287 cites W1974427084 @default.
• W2057648287 cites W1976206656 @default.
• W2057648287 cites W1986411006 @default.
• W2057648287 cites W1990239471 @default.
• W2057648287 cites W1990719063 @default.
• W2057648287 cites W1998366223 @default.
• W2057648287 cites W2007311858 @default.
• W2057648287 cites W2011097528 @default.
• W2057648287 cites W2016082118 @default.
• W2057648287 cites W2018171695 @default.
• W2057648287 cites W2018651850 @default.
• W2057648287 cites W2018858346 @default.
• W2057648287 cites W2022696619 @default.
• W2057648287 cites W2025207571 @default.
• W2057648287 cites W2025853030 @default.
• W2057648287 cites W2028143786 @default.
• W2057648287 cites W2033076011 @default.
• W2057648287 cites W2036845157 @default.
• W2057648287 cites W2041592402 @default.
• W2057648287 cites W2043746953 @default.
• W2057648287 cites W2045608899 @default.
• W2057648287 cites W2051831029 @default.
• W2057648287 cites W2052352912 @default.
• W2057648287 cites W2056608987 @default.
• W2057648287 cites W2059616232 @default.
• W2057648287 cites W2069598209 @default.
• W2057648287 cites W2076059435 @default.
• W2057648287 cites W2080131977 @default.
• W2057648287 cites W2082904789 @default.
• W2057648287 cites W2083519729 @default.
• W2057648287 cites W2086634221 @default.
• W2057648287 cites W2088709345 @default.
• W2057648287 cites W2090941793 @default.
• W2057648287 cites W2095673685 @default.
• W2057648287 cites W2120897027 @default.
• W2057648287 cites W2147573649 @default.
• W2057648287 cites W2151058832 @default.
• W2057648287 cites W2315608093 @default.
• W2057648287 cites W2321608662 @default.
• W2057648287 doi "https://doi.org/10.1021/ja106264q" @default.
• W2057648287 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/20961094" @default.
• W2057648287 hasPublicationYear "2010" @default.
• W2057648287 type Work @default.
• W2057648287 sameAs 2057648287 @default.
• W2057648287 citedByCount "91" @default.
• W2057648287 countsByYear W20576482872012 @default.
• W2057648287 countsByYear W20576482872013 @default.
• W2057648287 countsByYear W20576482872014 @default.
• W2057648287 countsByYear W20576482872015 @default.
• W2057648287 countsByYear W20576482872016 @default.
• W2057648287 countsByYear W20576482872017 @default.
• W2057648287 countsByYear W20576482872018 @default.
• W2057648287 countsByYear W20576482872019 @default.
• W2057648287 countsByYear W20576482872020 @default.
• W2057648287 countsByYear W20576482872021 @default.
• W2057648287 countsByYear W20576482872022 @default.
• W2057648287 countsByYear W20576482872023 @default.
• W2057648287 crossrefType "journal-article" @default.
• W2057648287 hasAuthorship W2057648287A5017249076 @default.
• W2057648287 hasAuthorship W2057648287A5020600412 @default.
• W2057648287 hasAuthorship W2057648287A5023941889 @default.
• W2057648287 hasAuthorship W2057648287A5071850859 @default.
• W2057648287 hasAuthorship W2057648287A5074396718 @default.
• W2057648287 hasConcept C104779481 @default.
• W2057648287 hasConcept C107054158 @default.
• W2057648287 hasConcept C121332964 @default.
• W2057648287 hasConcept C127413603 @default.
• W2057648287 hasConcept C140205800 @default.
• W2057648287 hasConcept C148898269 @default.
• W2057648287 hasConcept C153294291 @default.
• W2057648287 hasConcept C155672457 @default.
• W2057648287 hasConcept C159985019 @default.
• W2057648287 hasConcept C161790260 @default.
• W2057648287 hasConcept C171250308 @default.
• W2057648287 hasConcept C178790620 @default.
• W2057648287 hasConcept C185592680 @default.
• W2057648287 hasConcept C192562407 @default.
• W2057648287 hasConcept C42360764 @default.
• W2057648287 hasConcept C513720949 @default.
• W2057648287 hasConcept C5335593 @default.
• W2057648287 hasConcept C544153396 @default.
• W2057648287 hasConcept C61048295 @default.
• W2057648287 hasConcept C62520636 @default.
• W2057648287 hasConceptScore W2057648287C104779481 @default.
• W2057648287 hasConceptScore W2057648287C107054158 @default.
• W2057648287 hasConceptScore W2057648287C121332964 @default.
• W2057648287 hasConceptScore W2057648287C127413603 @default.

• next