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Orbital-Dependent Electronic Friction Significantly Affects the Description of Reactive Scattering of N(2) from Ru(0001)
[Image: see text] Electron–hole pair (ehp) excitation is thought to substantially affect the dynamics of molecules on metal surfaces, but it is not clear whether this can be better addressed by orbital-dependent friction (ODF) or the local density friction approximation (LDFA). We investigate the ef...
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| Vydáno v: | J Phys Chem Lett |
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| Hlavní autoři: | , , , , |
| Médium: | Artigo |
| Jazyk: | Inglês |
| Vydáno: |
American Chemical
Society
2019
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| On-line přístup: | https://ncbi.nlm.nih.gov/pmc/articles/PMC6558642/ https://ncbi.nlm.nih.gov/pubmed/31088059 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpclett.9b00523 |
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