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Generalized Langevin theory of gas/solid‐surface dynamics: A formulation for thermal desorption
1.See, for example, (a) S. A. Adelman and J. D. Doll, J. Chem. Phys. 64, 2375 (1976);
1.(b) S. A. Adelman and B. J. Garrison, J. Chem. Phys. 65, 3751 (1976);
1.(c) J. D. Doll and D. R. Dion, J. Chem. Phys. 65, 3762 (1976).
2.For a review, see S. A. Adelman and J. D. Doll, Acc. Chem. Res. 10, 378 (1977).
3.J. B. Anderson, J. Chem. Phys. 58, 4684 (1973);
3.R. L. Jaffe, J. M. Henry, and J. B. Anderson, J. Chem. Phys. 59, 1128 (1973).
4.C. H. Bennett, in Diffusion in Solids: Recent Developments, edited by A. S. Nowick and J. J. Burton, (Academic, New York, 1975), pp. 74–113.
5.See also P. J. Pagni and J. C. Keck, J. Chem. Phys. 58, 1162 (1973);
5.Adsorption‐Desorption Phenomena, edited by F. Ricca (Academic, New York, 1972).
6.H. A. Kramers, Physica 7, 284 (1950).
7.S. Chandrasekhar, Rev. Mod. Phys. 15, 1 (1943).
8.See the discussion in Ref. 7 following Eqs. (465) and (479).
9.In this procedure the attainment of a critical extension in the separation coordinate is used as a signal to initiate explicit dynamical study.
10.In the present problem this was taken as
11.For certain situations a steepest descent’s evaluation of this term may prove acceptable.
12.In writing (2.5) it is understood that the sampling surface reflects any substrate symmetry that is present.
13.In the Debye Model the effective friction constant is where is the Debye frequency. The lattice‐dynamical dependence of will ultimately have to be assessed on the basis of more realistic models than this simple stochastic one.
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