Interstitial nitrogen atoms in diamond. A quantum mechanical investigation of its electronic and vibrational properties-Reference-Cited by-同舟云学术

Interstitial nitrogen atoms in diamond. A quantum mechanical investigation of its electronic and vibrational properties

Published:2018 Issue:24 Volume:20 Page:16615-16624
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Salustro Simone¹²³⁴^ORCID,Pascale Fabien⁵⁶⁷⁸⁹,Mackrodt William C.¹²³⁴,Ravoux Corentin¹²³⁴¹⁰,Erba Alessandro¹²³⁴^ORCID,Dovesi Roberto¹²³⁴

Affiliation:

1. Dipartimento di Chimica

2. Università di Torino

3. IT-10125 Torino

4. Italy

5. Université de Lorraine – Nancy

6. CNRS

7. Laboratoire de Physique et Chimie Théoriques

8. UMR 7019

9. France

10. Laboratoire Structure Propriétés et Modélisation des Solides (SPMS)

Abstract

The electronic and vibrational features of the single- and double-nitrogen interstitial defects in diamond are investigated at the quantum mechanical level.

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2018/CP/C8CP02484G

Reference63 articles.

1. Ab initioinvestigation of the native defects in diamond and self-diffusion

2. Modelling of interstitial-related defects in diamond

3. Ion-Implantation-Induced Defects in Diamond and Their Annealing: Experiment and Simulation

4. Interstitials, Vacancies and Impurities in Diamond

5. First Principles Study of the Self-Interstitial Defect in Diamond

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