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Ab initio studies of fluorine passivation on the electronic structure of the NV- defect in nanodiamond
College of Engineering, Mathematics and Physical Sciences, University of Exeter.
College of Engineering, Mathematics and Physical Sciences, University of Exeter.
College of Engineering, Mathematics and Physical Sciences, University of Exeter.
School of Electrical, Electronic and Computer Engineering, University of Newcastle upon Tyne.
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2012 (English)In: Journal of Nanoscience and Nanotechnology, ISSN 1533-4880, E-ISSN 1533-4899, Vol. 12, no 11, p. 8589-8593Article in journal (Refereed) Published
Abstract [en]

We have investigated using density functional theory the effect of fluorine termination of a (001) diamond surface on the electronic energy levels of an NV- centre buried beneath the surface. We find that, like OH termination, fluorine passivates the surface and reduces the influence of the surface on the electronic properties of the NV- centre. The results have significance for the optical properties of NV- defects in nanodiamonds

Place, publisher, year, edition, pages
2012. Vol. 12, no 11, p. 8589-8593
National Category
Computational Mathematics
Research subject
Scientific Computing
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URN: urn:nbn:se:ltu:diva-7994DOI: 10.1166/jnn.2012.6821ISI: 000313851000050Scopus ID: 2-s2.0-84871913149Local ID: 66fbf936-7aa2-4aac-85f2-8db4a353b243OAI: oai:DiVA.org:ltu-7994DiVA, id: diva2:980884
Note
Validerad; 2013; 20130111 (andbra)Available from: 2016-09-29 Created: 2016-09-29 Last updated: 2018-07-10Bibliographically approved

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Öberg, Sven

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