FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2027786551> ?p ?o ?g. }

• W2027786551 abstract "Abstract Adsorbate bonding to a nickel surface has been studied by use of a multiple-scattering Xα (MSXα) model for the adsorption of ethylene (C 2 H 4 ) on a Ni substrate. The Ni(100) surface was simulated by a 10-atom Ni cluster of C 4v point group symmetry, to which an adsorbed ethylene molecule was then added. The Ni 10 (100) cluster was found to be a reasonable model for the Ni(100) substrate; it shows a high density of states near the Fermi level, and a d-bandwidth of ~2.6 eV, as compared to ~3.5 eV for bulk Ni. In addition, the pristine cluster has a weak magnetization of ~0.2 magneton/atom; this is a significant reduction not only from the bulk Ni value (0.54 magneton/atom) but from the values found for small cubic Ni clusters of comparable size. The level structure of the isolated C 2 H 4 molecule was then calculated and compared with that of a Ni 10 (100) + C 2 H 4 π-bonded cluster, and the level shifts analyzed. It is indicated that the reported difference in activation energies for ethylene hydrogenation on paramagnetic and ferromagnetic Ni may be due to shifts in the Ni spd levels relative to the ethylene 1b 3u bonding orbital energy level, via the exchange splitting of ~0.1 eV." @default.
• W2027786551 created "2016-06-24" @default.
• W2027786551 creator A5007109592 @default.
• W2027786551 creator A5071443193 @default.
• W2027786551 date "1984-01-01" @default.
• W2027786551 modified "2023-09-22" @default.
• W2027786551 title "Adsorption of ethylene on a nickel (100) substrate: A multiple-scattering Xα approach" @default.
• W2027786551 cites W1969480435 @default.
• W2027786551 cites W1978483352 @default.
• W2027786551 cites W1989036387 @default.
• W2027786551 cites W1993119212 @default.
• W2027786551 cites W1994881151 @default.
• W2027786551 cites W2002098236 @default.
• W2027786551 cites W2011171456 @default.
• W2027786551 cites W2014223050 @default.
• W2027786551 cites W2019688723 @default.
• W2027786551 cites W2026492451 @default.
• W2027786551 cites W2040795174 @default.
• W2027786551 cites W2049229487 @default.
• W2027786551 cites W2049452625 @default.
• W2027786551 cites W2056096072 @default.
• W2027786551 cites W2080093780 @default.
• W2027786551 cites W2131108881 @default.
• W2027786551 cites W2483928337 @default.
• W2027786551 cites W2917847268 @default.
• W2027786551 doi "https://doi.org/10.1016/0039-6028(84)90667-8" @default.
• W2027786551 hasPublicationYear "1984" @default.
• W2027786551 type Work @default.
• W2027786551 sameAs 2027786551 @default.
• W2027786551 citedByCount "7" @default.
• W2027786551 crossrefType "journal-article" @default.
• W2027786551 hasAuthorship W2027786551A5007109592 @default.
• W2027786551 hasAuthorship W2027786551A5071443193 @default.
• W2027786551 hasConcept C111368507 @default.
• W2027786551 hasConcept C113196181 @default.
• W2027786551 hasConcept C120665830 @default.
• W2027786551 hasConcept C121332964 @default.
• W2027786551 hasConcept C124712363 @default.
• W2027786551 hasConcept C127313418 @default.
• W2027786551 hasConcept C147789679 @default.
• W2027786551 hasConcept C149635348 @default.
• W2027786551 hasConcept C150394285 @default.
• W2027786551 hasConcept C161790260 @default.
• W2027786551 hasConcept C164866538 @default.
• W2027786551 hasConcept C178790620 @default.
• W2027786551 hasConcept C184779094 @default.
• W2027786551 hasConcept C185592680 @default.
• W2027786551 hasConcept C191486275 @default.
• W2027786551 hasConcept C192562407 @default.
• W2027786551 hasConcept C199360897 @default.
• W2027786551 hasConcept C26873012 @default.
• W2027786551 hasConcept C2777289219 @default.
• W2027786551 hasConcept C2778597550 @default.
• W2027786551 hasConcept C41008148 @default.
• W2027786551 hasConcept C43617362 @default.
• W2027786551 hasConcept C504270822 @default.
• W2027786551 hasConcept C55493867 @default.
• W2027786551 hasConcept C58312451 @default.
• W2027786551 hasConcept C8010536 @default.
• W2027786551 hasConcept C82217956 @default.
• W2027786551 hasConceptScore W2027786551C111368507 @default.
• W2027786551 hasConceptScore W2027786551C113196181 @default.
• W2027786551 hasConceptScore W2027786551C120665830 @default.
• W2027786551 hasConceptScore W2027786551C121332964 @default.
• W2027786551 hasConceptScore W2027786551C124712363 @default.
• W2027786551 hasConceptScore W2027786551C127313418 @default.
• W2027786551 hasConceptScore W2027786551C147789679 @default.
• W2027786551 hasConceptScore W2027786551C149635348 @default.
• W2027786551 hasConceptScore W2027786551C150394285 @default.
• W2027786551 hasConceptScore W2027786551C161790260 @default.
• W2027786551 hasConceptScore W2027786551C164866538 @default.
• W2027786551 hasConceptScore W2027786551C178790620 @default.
• W2027786551 hasConceptScore W2027786551C184779094 @default.
• W2027786551 hasConceptScore W2027786551C185592680 @default.
• W2027786551 hasConceptScore W2027786551C191486275 @default.
• W2027786551 hasConceptScore W2027786551C192562407 @default.
• W2027786551 hasConceptScore W2027786551C199360897 @default.
• W2027786551 hasConceptScore W2027786551C26873012 @default.
• W2027786551 hasConceptScore W2027786551C2777289219 @default.
• W2027786551 hasConceptScore W2027786551C2778597550 @default.
• W2027786551 hasConceptScore W2027786551C41008148 @default.
• W2027786551 hasConceptScore W2027786551C43617362 @default.
• W2027786551 hasConceptScore W2027786551C504270822 @default.
• W2027786551 hasConceptScore W2027786551C55493867 @default.
• W2027786551 hasConceptScore W2027786551C58312451 @default.
• W2027786551 hasConceptScore W2027786551C8010536 @default.
• W2027786551 hasConceptScore W2027786551C82217956 @default.
• W2027786551 hasLocation W20277865511 @default.
• W2027786551 hasOpenAccess W2027786551 @default.
• W2027786551 hasPrimaryLocation W20277865511 @default.
• W2027786551 hasRelatedWork W1932471895 @default.
• W2027786551 hasRelatedWork W1969753456 @default.
• W2027786551 hasRelatedWork W1974732736 @default.
• W2027786551 hasRelatedWork W1985354837 @default.
• W2027786551 hasRelatedWork W1988345082 @default.
• W2027786551 hasRelatedWork W1998153790 @default.
• W2027786551 hasRelatedWork W1999377143 @default.
• W2027786551 hasRelatedWork W1999442956 @default.
• W2027786551 hasRelatedWork W2000085964 @default.
• W2027786551 hasRelatedWork W2013423267 @default.

• next