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Theoretical Study of the Energetic Stability and Geometry of Terminated and B-Doped Diamond (111) Surfaces

[Image: see text] The effect of B doping on the surface (111) reactivity has, in the present study, been investigated for various surface terminations, H, OH, O(on-top), and F. This type of surface modification has experimentally been proven to be extremely important for, for example, applications b...

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Hlavní autoři: Zhao, Shuainan, Larsson, Karin
Médium: Artigo
Jazyk:Inglês
Vydáno: American Chemical Society 2013
On-line přístup:https://ncbi.nlm.nih.gov/pmc/articles/PMC3910271/
https://ncbi.nlm.nih.gov/pubmed/24501614
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/jp409278x
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