First Principeles Initio Study of the Electronic and Optical Properties of Bulk TiC and Its Narrow Nanowires by Density Functional Theory

First Principeles Initio Study of the Electronic and Optical Properties of Bulk TiC and Its Narrow Nanowires by Density Functional Theory

In this article, the electronic  and optical properties of bulk TiC and  its narrow nanowires  were investigated using Quantum-Espresso/PWSCF computational package in the framework of density functional theory. According to the results, this compound showed a  metallic behavior in the bulk structure...

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Bibliographic Details
Main Authors: H. Salehi, P. Amiri, Y. loveimi motlagh
Format: Article
Language:fas
Published: Isfahan University of Technology 2018-06-01
Series:Journal of Advanced Materials in Engineering
Subjects:
pseudopotential
band structure
density of states
dielectric function
refractive index
loss function
Online Access:http://jame.iut.ac.ir/article-1-862-en.html

Internet

http://jame.iut.ac.ir/article-1-862-en.html

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