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Study of The Optical Properties of Boron Nitride Carbon Nanotube (BNCT) Materials for Several Carbon Concentration Variations in Pristine Boron Nitride Nanotube (BNNT)
Riri Jonuarti (a*), Meqorry Yusfi (a, b), Triati Dewi Kencana Wungu (a), Freddy Haryanto (a), Suprijadi (a)

a) School of Energy, Bandung Institute of Technology
Jalan Ganesha 10, Bandung 40132, Indonesia
*riri.jonuarti[at]gmail.com
b) Department of Physics, Universitas Andalas, Jalan Universitas Andalas, Limau manis, Padang, 25163,
Indonesia


Abstract

Density functional theory (DFT) combined with random phase approximation (RPA) was used to determine the dielectric function of (5,0) zigzag and (5,5) armchair boron nitride carbon nanotube (BNCNT). The concentration of carbon atoms in the BNCNT structures varies by 20%, 30%, 40%, 50% and 60% of the total number of atoms in the structure. The results of the optical properties depicted in the dielectric function graphs for each (5,0) zigzag and (5,5) armchair BNCNT. The effect of each quantity of the carbon concentrations to the optical properties of those nanotubes is also discussed. The large concentration of carbon atoms in one BNCNT structure makes the dielectric constant increase which is indicated on the graph of the dielectric function at the energy point 0 eV by a real scale height. Furthermore, the large carbon concentration in the (5.5) BNCNT creates a new absorption peak at 0 eV energy. So that, by understanding that the concentration of carbon atoms in the BNCNT framework affects the optical properties of these hybrid materials, the material can be implemented in multiple applications.

Keywords: Density Functional Theory; Random Phase Approximation; Boron Nitride Carbon Nanotubes; The Concentration of Carbon; Optical Properties

Topic: Computational Physics

Link: https://ifory.id/abstract/Y3xruwtWcpU9

Conference: Asian Physics Symposium (APS 2019)

Plain Format | Corresponding Author (Riri Jonuarti)

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