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Random Force in Molecular Dynamics with Electronic Friction

[Image: see text] Originally conceived to describe thermal diffusion, the Langevin equation includes both a frictional drag and a random force, the latter representing thermal fluctuations first seen as Brownian motion. The random force is crucial for the diffusion problem as it explains why frictio...

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Vydáno v:J Phys Chem C Nanomater Interfaces
Hlavní autoři: Hertl, Nils, Martin-Barrios, Raidel, Galparsoro, Oihana, Larrégaray, Pascal, Auerbach, Daniel J., Schwarzer, Dirk, Wodtke, Alec M., Kandratsenka, Alexander
Médium: Artigo
Jazyk:Inglês
Vydáno: American Chemical Society 2021
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC8273891/
https://ncbi.nlm.nih.gov/pubmed/34267855
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/acs.jpcc.1c03436
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