DOI: 10.1063/1.446907. Model studies of atom and molecule diffusion on surfaces

Model studies of atom and molecule diffusion on surfaces

10.1063/1.446907

Crossref journal-article

AIP Publishing

The Journal of Chemical Physics (317)

Abstract

We report a classical trajectory study of the diffusive dynamics of a rigid-rotor N2 trapped on a rigid but corrugated LiF(001) surface. An analogous study is also made for a fictitious atom with the atomic weight of N2. The ensemble-averaged square displacement as well as the velocity autocorrelation functions are computed for a range of kinetic energies, each exhibiting the standard signatures for diffusive behavior. The ‘‘temperature’’ dependence of the diffusion coefficients determined show Arrhenius behavior with an activation energy which can be approximately related to barriers on the three-dimensional potential surface.

Bibliography

Park, S. C., & Bowman, J. M. (1984). Model studies of atom and molecule diffusion on surfaces. The Journal of Chemical Physics, 80(5), 2191â2196.

Authors 2

Seung C. Park (first)
Joel M. Bowman (additional)

References 27 Referenced 10

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Dates

Type	When
Created	22 years, 6 months ago (Feb. 28, 2003, 12:18 p.m.)
Deposited	1 year, 6 months ago (Feb. 9, 2024, 8:57 p.m.)
Indexed	1 year, 6 months ago (Feb. 11, 2024, 2:19 a.m.)
Issued	41 years, 6 months ago (March 1, 1984)
Published	41 years, 6 months ago (March 1, 1984)
Published Print	41 years, 6 months ago (March 1, 1984)

Funders 0

None

BibTeX

@article{Park_1984, title={Model studies of atom and molecule diffusion on surfaces}, volume={80}, ISSN={1089-7690}, url={http://dx.doi.org/10.1063/1.446907}, DOI={10.1063/1.446907}, number={5}, journal={The Journal of Chemical Physics}, publisher={AIP Publishing}, author={Park, Seung C. and Bowman, Joel M.}, year={1984}, month=mar, pages={2191–2196} }

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