Theoretical Investigations of Electronic and Optical Properties of Vanadium Doped Wurtzite Zinc Oxide from First Principle Calculation Method
In this study lattice parameters, band structure, and optical characteristics of pure and V-doped ZnO are examined by employing (USP) and (GGA) with the assistance of First-principles calculation (FPC) derived from (DFT). The measurements are performed in the supercell geometry that were optimized....
Main Authors: | Rezhaw A. Qadr, Dlear R. Saber, Shujahadeen B. Aziz |
---|---|
Format: | Article |
Language: | English |
Published: |
University of Baghdad
2022-06-01
|
Series: | Iraqi Journal of Physics |
Subjects: | |
Online Access: | https://ijp.uobaghdad.edu.iq/index.php/physics/article/view/991 |
Similar Items
-
Anisotropic Elastic and Thermal Properties of M<sub>2</sub>InX (M = Ti, Zr and X = C, N) Phases: A First-Principles Calculation
by: Bo Li, et al.
Published: (2022-06-01) -
Role of Titanium replacement with Pd atom on band gap reduction in the anatase Titanium Dioxide: First-Principles calculation approach
by: Shaho M. Rasul, et al.
Published: (2022-07-01) -
First-principles calculations to investigate structural, elastic, electronic, lattice dynamic and optical properties for scandium and yttrium nitrides in zinc blend structure
by: Mohamed Amine Ghebouli, et al.
Published: (2021-09-01) -
First-principles Calculation of the Electronic Structure and Optical Properties of ZnO Co-doped with Nb and Ta
by: Jinpeng WANG, et al.
Published: (2019-05-01) -
Ferromagnetic behavior of native point defects and vacancy-clusters in ZnO studied by first principle calculation
by: Cai-Qin Luo, et al.
Published: (2020-01-01)