Parameters Affecting the Fluorescence of Nanodiamond Particles: Quantum Chemical Calculations

Result code in IS VaVaI

<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F68407700%3A21340%2F11%3A00185574" target="_blank" >RIV/68407700:21340/11:00185574 - isvavai.cz</a>

Result on the web

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DOI - Digital Object Identifier

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Result language

angličtina

Original language name

Parameters Affecting the Fluorescence of Nanodiamond Particles: Quantum Chemical Calculations

Original language description

In this work was theoretically studied how the various surface terminations affect the conditions for the luminescence of shallow-laying nitrogen-vacancy (NV) color centers in nanodiamond particles. To get qualitatively better understanding of the complicated and specific process of nanodiamond particles luminescence density functional theory (DFT) was applied for modeling processes and states influencing the luminescence of ND particles. Clusters containing NV centers terminated by various chemical groups were modeled. To study possible interaction between NV centers and other crystal defects, clusters containing both NV0 and N- centers were modeled.

Czech name

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Czech description

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Type

D - Article in proceedings

CEP classification

BE - Theoretical physics

OECD FORD branch

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Project

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Continuities

S - Specificky vyzkum na vysokych skolach

Publication year

2011

Confidentiality

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

Article name in the collection

Sborník příspěvků 1. Studentské vědecké konference fyziky pevných látek, Tetřeví Boudy 2011

ISBN

978-80-01-04869-6

ISSN

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e-ISSN

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Number of pages

8

Pages from-to

100-107

Publisher name

České vysoké učení technické v Praze, Fakulta jaderná a fyzikálně inženýrská

Place of publication

Praha

Event location

Tetřeví Boudy

Event date

Jun 30, 2011

Type of event by nationality

CST - Celostátní akce

UT code for WoS article

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