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Fluorescence of variously terminated nanodiamond particles: quantum chemical calculations

The result's identifiers

  • Result code in IS VaVaI

    <a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F68378271%3A_____%2F10%3A00348149" target="_blank" >RIV/68378271:_____/10:00348149 - isvavai.cz</a>

  • Alternative codes found

    RIV/61388955:_____/10:00348149 RIV/61388963:_____/10:00348149

  • Result on the web

  • DOI - Digital Object Identifier

Alternative languages

  • Result language

    angličtina

  • Original language name

    Fluorescence of variously terminated nanodiamond particles: quantum chemical calculations

  • Original language description

    Nanodiamond is a novel and promising material for in-vitro and in-vivo imaging in living cells. In this work we study (using quantum chemical calculation methods) how the various surface terminations affect conditions for fluorescence of Nitrogen-vacancy(NV) centers in nanodiamond particles. We worked with clusters containing from 35 to 86 atoms of carbon containing NV centers with different charge states of vacancies (NV- & NV0) and with different terminations: OH, H, NH2, carbonyl, carboxyl and hydroxyl groups. Systems under study were modelled by DFT based calculations using Gaussian 09 and Turbomole-5.10. program packages.

  • Czech name

  • Czech description

Classification

  • Type

    J<sub>x</sub> - Unclassified - Peer-reviewed scientific article (Jimp, Jsc and Jost)

  • CEP classification

    BM - Solid-state physics and magnetism

  • OECD FORD branch

Result continuities

  • Project

    Result was created during the realization of more than one project. More information in the Projects tab.

  • Continuities

    P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)<br>Z - Vyzkumny zamer (s odkazem do CEZ)

Others

  • Publication year

    2010

  • Confidentiality

    S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

Data specific for result type

  • Name of the periodical

    Physica Status Solidi. A

  • ISSN

    1862-6300

  • e-ISSN

  • Volume of the periodical

    207

  • Issue of the periodical within the volume

    9

  • Country of publishing house

    DE - GERMANY

  • Number of pages

    4

  • Pages from-to

  • UT code for WoS article

    000282766100007

  • EID of the result in the Scopus database