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http://dx.doi.org/10.1103/physrevb.46.4607 | DOI Listing |
Nanomaterials (Basel)
December 2024
Grupo de Materia Condensada-UdeA, Instituto de Física, Facultad de Ciencias Exactas y Naturales, Universidad de Antioquia UdeA, Calle 70 No. 52-21, Medellín 050010, Colombia.
Using the effective mass approximation and the finite difference method, we examined the linear, non-linear, and total optical absorption coefficients (OAC), as well as the relative refractive index coefficients (RIC) variations for an off-center shallow donor impurity in a 2D-curved electronic nanostructure subjected to external electric and magnetic fields. Our results reveal that the peak positions of the OAC and RIC are susceptible to the geometrical angles, the impurity position, and the strength of the applied electric and magnetic fields. In particular, the positions of the OAC and RIC peaks can be shifted towards blue or red by adjusting the geometric angle.
View Article and Find Full Text PDFNanophotonics
April 2024
Faculty of Physics, University of Warsaw, ul. L. Pasteura 5, 02-093 Warsaw, Poland.
J Am Chem Soc
September 2024
MDX Research Center for Element Strategy, International Research Frontiers Initiative, Tokyo Institute of Technology, 4259 Nagatsuta-cho, Midori-ku, Yokohama 226-8501, Japan.
Phys Chem Chem Phys
July 2023
Department of Physics, Faculty of Science, Kasetsart University, Bangkok 10900, Thailand.
The ceramic material zinc antimony oxide ZnSbO has promising electrical and magnetic properties, making it suitable for various applications such as electrochemical and energy storage. However, the effects of point defects and impurities on its electrical properties have never been revealed. Here, we employ hybrid density-functional calculations to investigate the energetics and electronic properties of native point defects and donor impurities in ZnSbO.
View Article and Find Full Text PDFPhys Chem Chem Phys
April 2023
School of Physics, Huazhong University of Science and Technology, Wuhan, 430074, China.
Wide bandgap semiconductors materials (WBGSMs) are of great interest for their applications in transparent electronics and power electronics. Recent studies have shown that BaS is a potential transparent conducting material but the knowledge of it is deficient. Herein, we systemically investigate its electronic structure and evaluate the effects of its intrinsic defects and extrinsic dopants by utilizing the hybrid density functional method.
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