Matches in SemOpenAlex for { <https://semopenalex.org/work/W2010057783> ?p ?o ?g. }
Showing items 1 to 100 of
100
with 100 items per page.
- W2010057783 endingPage "2544" @default.
- W2010057783 startingPage "2542" @default.
- W2010057783 abstract "The electronic and structural properties of ultra small-diameter (3,0) and (4,0) zigzag and (2,2) and (3,3) armchair models of boron nitride nanotubes (BNNTs) are investigated by density functional theory (DFT) calculations. The atomic geometries of the considered models are optimized and then the electric field gradient (EFG) tensors are calculated at the sites of boron-11 and nitrogen-14 nuclei in the optimized structures. The results indicate that the small-diameter boron nitride nanotubes are proper for contributing to intermolecular interactions whereas the zigzag models are more preferred rather than the armchair ones. Furthermore, the boron-11 nuclei play dominant roles in the characterization of the electronic and structural properties of the BNNTs. The DFT calculations are performed by the GAUSSIAN 98 package." @default.
- W2010057783 created "2016-06-24" @default.
- W2010057783 creator A5040423441 @default.
- W2010057783 creator A5084498970 @default.
- W2010057783 date "2010-06-01" @default.
- W2010057783 modified "2023-10-17" @default.
- W2010057783 title "Computational investigation of the electronic and structural properties of ultra small-diameter boron nitride nanotubes" @default.
- W2010057783 cites W1969448926 @default.
- W2010057783 cites W1973579599 @default.
- W2010057783 cites W1973857573 @default.
- W2010057783 cites W1981534213 @default.
- W2010057783 cites W1981695810 @default.
- W2010057783 cites W1994427713 @default.
- W2010057783 cites W1995099821 @default.
- W2010057783 cites W1995761404 @default.
- W2010057783 cites W1999088629 @default.
- W2010057783 cites W2013025903 @default.
- W2010057783 cites W2016787461 @default.
- W2010057783 cites W2018631940 @default.
- W2010057783 cites W2018858346 @default.
- W2010057783 cites W2027048476 @default.
- W2010057783 cites W2048246800 @default.
- W2010057783 cites W2048658214 @default.
- W2010057783 cites W2061332681 @default.
- W2010057783 cites W2067058956 @default.
- W2010057783 cites W2071709099 @default.
- W2010057783 cites W2081293655 @default.
- W2010057783 cites W3023377422 @default.
- W2010057783 cites W3170751086 @default.
- W2010057783 cites W617627058 @default.
- W2010057783 cites W2022022611 @default.
- W2010057783 doi "https://doi.org/10.1016/j.physb.2010.03.027" @default.
- W2010057783 hasPublicationYear "2010" @default.
- W2010057783 type Work @default.
- W2010057783 sameAs 2010057783 @default.
- W2010057783 citedByCount "11" @default.
- W2010057783 countsByYear W20100577832012 @default.
- W2010057783 countsByYear W20100577832015 @default.
- W2010057783 countsByYear W20100577832018 @default.
- W2010057783 countsByYear W20100577832022 @default.
- W2010057783 crossrefType "journal-article" @default.
- W2010057783 hasAuthorship W2010057783A5040423441 @default.
- W2010057783 hasAuthorship W2010057783A5084498970 @default.
- W2010057783 hasConcept C121332964 @default.
- W2010057783 hasConcept C147597530 @default.
- W2010057783 hasConcept C152365726 @default.
- W2010057783 hasConcept C159467904 @default.
- W2010057783 hasConcept C171250308 @default.
- W2010057783 hasConcept C178790620 @default.
- W2010057783 hasConcept C185592680 @default.
- W2010057783 hasConcept C192271897 @default.
- W2010057783 hasConcept C192562407 @default.
- W2010057783 hasConcept C194760766 @default.
- W2010057783 hasConcept C2524010 @default.
- W2010057783 hasConcept C2779227376 @default.
- W2010057783 hasConcept C2780243435 @default.
- W2010057783 hasConcept C33923547 @default.
- W2010057783 hasConcept C501308230 @default.
- W2010057783 hasConcept C60799052 @default.
- W2010057783 hasConcept C62520636 @default.
- W2010057783 hasConcept C86025842 @default.
- W2010057783 hasConceptScore W2010057783C121332964 @default.
- W2010057783 hasConceptScore W2010057783C147597530 @default.
- W2010057783 hasConceptScore W2010057783C152365726 @default.
- W2010057783 hasConceptScore W2010057783C159467904 @default.
- W2010057783 hasConceptScore W2010057783C171250308 @default.
- W2010057783 hasConceptScore W2010057783C178790620 @default.
- W2010057783 hasConceptScore W2010057783C185592680 @default.
- W2010057783 hasConceptScore W2010057783C192271897 @default.
- W2010057783 hasConceptScore W2010057783C192562407 @default.
- W2010057783 hasConceptScore W2010057783C194760766 @default.
- W2010057783 hasConceptScore W2010057783C2524010 @default.
- W2010057783 hasConceptScore W2010057783C2779227376 @default.
- W2010057783 hasConceptScore W2010057783C2780243435 @default.
- W2010057783 hasConceptScore W2010057783C33923547 @default.
- W2010057783 hasConceptScore W2010057783C501308230 @default.
- W2010057783 hasConceptScore W2010057783C60799052 @default.
- W2010057783 hasConceptScore W2010057783C62520636 @default.
- W2010057783 hasConceptScore W2010057783C86025842 @default.
- W2010057783 hasIssue "11" @default.
- W2010057783 hasLocation W20100577831 @default.
- W2010057783 hasOpenAccess W2010057783 @default.
- W2010057783 hasPrimaryLocation W20100577831 @default.
- W2010057783 hasRelatedWork W1984755056 @default.
- W2010057783 hasRelatedWork W2000598874 @default.
- W2010057783 hasRelatedWork W2029208601 @default.
- W2010057783 hasRelatedWork W2034842613 @default.
- W2010057783 hasRelatedWork W2038477876 @default.
- W2010057783 hasRelatedWork W2043141808 @default.
- W2010057783 hasRelatedWork W2053924787 @default.
- W2010057783 hasRelatedWork W2090758233 @default.
- W2010057783 hasRelatedWork W3045127264 @default.
- W2010057783 hasRelatedWork W3158901401 @default.
- W2010057783 hasVolume "405" @default.
- W2010057783 isParatext "false" @default.
- W2010057783 isRetracted "false" @default.
- W2010057783 magId "2010057783" @default.
- W2010057783 workType "article" @default.