FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2019105337> ?p ?o ?g. }

• W2019105337 endingPage "1647" @default.
• W2019105337 startingPage "1638" @default.
• W2019105337 abstract "The diffusion of hydrogen atoms on a reconstructed Si(111)-(7×7) surface has been investigated using variational phase-space theory methods. The dimer–adatom-stacking (DAS) fault model of the reconstructed Si(111)-(7×7) surface proposed by Takayanagi et al. is employed to describe a four-layer lattice structure containing 292 atoms. The lattice potential is that developed by Bolding and Andersen; the gas–lattice interaction potential is described by a sum of Morse functions and bending terms between the hydrogen adatom and the Si atoms in the first and second layers. Canonical Markov walks with importance sampling are used to evaluate the flux across a set of dividing surfaces separating different adsorption sites. The minimum jump frequencies are then used as input to a set of coupled phenomenological kinetics equations that describe the diffusion rates of adatoms between adjacent adsorption sites. The diffusion coefficients D at different temperatures are computed from the slope of plots of the time variation of the root-mean-square displacements obtained from the solution of the rate equations. The results at 300, 500, and 800 K yield D=0.023 exp(−1.54 eV/kT) cm2/s. The calculated activation energy of 1.54 eV is in excellent agreement with the experimental results obtained by Reider et al. using an optical second-harmonic diffraction technique. The coordinates corresponding to the minimum energy diffusion path suggest that hydrogen-atom diffusion between atop sites occurs along paths that involve lattice penetration. Calculated upper limits for the tunneling rates at 300, 500, and 800 K show that tunneling processes make only a small contribution to the total diffusion rate." @default.
• W2019105337 created "2016-06-24" @default.
• W2019105337 creator A5039116799 @default.
• W2019105337 creator A5050881482 @default.
• W2019105337 creator A5073595309 @default.
• W2019105337 date "1994-07-15" @default.
• W2019105337 modified "2023-09-27" @default.
• W2019105337 title "Diffusion of hydrogen atoms on a Si(111)‐(7×7) reconstructed surface: Monte Carlo variational phase‐space theory" @default.
• W2019105337 cites W1965308120 @default.
• W2019105337 cites W1967428375 @default.
• W2019105337 cites W1972479463 @default.
• W2019105337 cites W1973798914 @default.
• W2019105337 cites W1983208255 @default.
• W2019105337 cites W1983413195 @default.
• W2019105337 cites W1995650948 @default.
• W2019105337 cites W1998615109 @default.
• W2019105337 cites W2002796843 @default.
• W2019105337 cites W2004942647 @default.
• W2019105337 cites W2006769216 @default.
• W2019105337 cites W2009546685 @default.
• W2019105337 cites W2016616007 @default.
• W2019105337 cites W2018776094 @default.
• W2019105337 cites W2023241466 @default.
• W2019105337 cites W2023505060 @default.
• W2019105337 cites W2024765074 @default.
• W2019105337 cites W2025938739 @default.
• W2019105337 cites W2033187512 @default.
• W2019105337 cites W2037264138 @default.
• W2019105337 cites W2039959185 @default.
• W2019105337 cites W2043339850 @default.
• W2019105337 cites W2044559728 @default.
• W2019105337 cites W2047440128 @default.
• W2019105337 cites W2050086101 @default.
• W2019105337 cites W2050737454 @default.
• W2019105337 cites W2052484780 @default.
• W2019105337 cites W2058182792 @default.
• W2019105337 cites W2060499681 @default.
• W2019105337 cites W2061728725 @default.
• W2019105337 cites W2066038783 @default.
• W2019105337 cites W2066401828 @default.
• W2019105337 cites W2067291596 @default.
• W2019105337 cites W2067326868 @default.
• W2019105337 cites W2071881029 @default.
• W2019105337 cites W2075716517 @default.
• W2019105337 cites W2090816459 @default.
• W2019105337 cites W2092105166 @default.
• W2019105337 cites W2119839567 @default.
• W2019105337 cites W2147415793 @default.
• W2019105337 cites W2158859305 @default.
• W2019105337 cites W2916712866 @default.
• W2019105337 cites W2988564995 @default.
• W2019105337 cites W4231314842 @default.
• W2019105337 cites W4238399617 @default.
• W2019105337 doi "https://doi.org/10.1063/1.467785" @default.
• W2019105337 hasPublicationYear "1994" @default.
• W2019105337 type Work @default.
• W2019105337 sameAs 2019105337 @default.
• W2019105337 citedByCount "14" @default.
• W2019105337 countsByYear W20191053372012 @default.
• W2019105337 countsByYear W20191053372013 @default.
• W2019105337 crossrefType "journal-article" @default.
• W2019105337 hasAuthorship W2019105337A5039116799 @default.
• W2019105337 hasAuthorship W2019105337A5050881482 @default.
• W2019105337 hasAuthorship W2019105337A5073595309 @default.
• W2019105337 hasConcept C105795698 @default.
• W2019105337 hasConcept C111350023 @default.
• W2019105337 hasConcept C121332964 @default.
• W2019105337 hasConcept C13153151 @default.
• W2019105337 hasConcept C140894746 @default.
• W2019105337 hasConcept C147789679 @default.
• W2019105337 hasConcept C150394285 @default.
• W2019105337 hasConcept C15696416 @default.
• W2019105337 hasConcept C184779094 @default.
• W2019105337 hasConcept C185592680 @default.
• W2019105337 hasConcept C19499675 @default.
• W2019105337 hasConcept C24890656 @default.
• W2019105337 hasConcept C2775961149 @default.
• W2019105337 hasConcept C2781204021 @default.
• W2019105337 hasConcept C33923547 @default.
• W2019105337 hasConcept C41999313 @default.
• W2019105337 hasConcept C97355855 @default.
• W2019105337 hasConceptScore W2019105337C105795698 @default.
• W2019105337 hasConceptScore W2019105337C111350023 @default.
• W2019105337 hasConceptScore W2019105337C121332964 @default.
• W2019105337 hasConceptScore W2019105337C13153151 @default.
• W2019105337 hasConceptScore W2019105337C140894746 @default.
• W2019105337 hasConceptScore W2019105337C147789679 @default.
• W2019105337 hasConceptScore W2019105337C150394285 @default.
• W2019105337 hasConceptScore W2019105337C15696416 @default.
• W2019105337 hasConceptScore W2019105337C184779094 @default.
• W2019105337 hasConceptScore W2019105337C185592680 @default.
• W2019105337 hasConceptScore W2019105337C19499675 @default.
• W2019105337 hasConceptScore W2019105337C24890656 @default.
• W2019105337 hasConceptScore W2019105337C2775961149 @default.
• W2019105337 hasConceptScore W2019105337C2781204021 @default.
• W2019105337 hasConceptScore W2019105337C33923547 @default.
• W2019105337 hasConceptScore W2019105337C41999313 @default.
• W2019105337 hasConceptScore W2019105337C97355855 @default.

• next