dc.identifier.uri |
http://dx.doi.org/10.15488/2787 |
|
dc.identifier.uri |
http://www.repo.uni-hannover.de/handle/123456789/2813 |
|
dc.contributor.author |
Stampfl, C.
|
|
dc.contributor.author |
Kreuzer, H.J.
|
|
dc.contributor.author |
Payne, S.H.
|
|
dc.contributor.author |
Pfnür, Herbert
|
|
dc.contributor.author |
Scheffler, M.
|
|
dc.date.accessioned |
2018-02-19T14:57:14Z |
|
dc.date.available |
2018-02-19T14:57:14Z |
|
dc.date.issued |
1999 |
|
dc.identifier.citation |
Stampfl, C.; Kreuzer, H.J.; Payne, S.H.; Pfnür, H.; Scheffler, M.: First-principles theory of surface thermodynamics and kinetics. In: Physical Review Letters 83 (1999), Nr. 15, S. 2993-2996. DOI: https://doi.org/10.1103/PhysRevLett.83.2993 |
|
dc.description.abstract |
Understanding the complex behavior of particles at surfaces requires detailed knowledge of both macroscopic and microscopic processes that take place; also certain phenomena depend critically on temperature and gas pressure. To link these processes we combine state-of-the-art microscopic, and macroscopic phenomenological, theories. We apply our theory to the O/Ru(0001) system and calculate thermal desorption spectra, heat of adsorption, and the surface phase diagram. The agreement with experiment provides validity for our approach which thus identifies the way for a predictive simulation of surface thermodynamics and kinetics. 1999 © The American Physical Society. |
eng |
dc.language.iso |
eng |
|
dc.publisher |
College Park, MD : American Physical Society |
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dc.relation.ispartofseries |
Physical Review Letters 83 (1999), Nr. 15 |
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dc.rights |
Es gilt deutsches Urheberrecht. Das Dokument darf zum eigenen Gebrauch kostenfrei genutzt, aber nicht im Internet bereitgestellt oder an Außenstehende weitergegeben werden. |
|
dc.subject |
gas-surface interface |
eng |
dc.subject |
oxygen |
eng |
dc.subject.ddc |
530 | Physik
|
ger |
dc.title |
First-principles theory of surface thermodynamics and kinetics |
|
dc.type |
Article |
|
dc.type |
Text |
|
dc.relation.issn |
00319007 |
|
dc.relation.doi |
https://doi.org/10.1103/PhysRevLett.83.2993 |
|
dc.bibliographicCitation.issue |
15 |
|
dc.bibliographicCitation.volume |
83 |
|
dc.bibliographicCitation.firstPage |
2993 |
|
dc.bibliographicCitation.lastPage |
2996 |
|
dc.description.version |
publishedVersion |
|
tib.accessRights |
frei zug�nglich |
|