Theoretical study on transport properties of group-III doped SiCNRs

YZ Li, MY Sun, XX Yu, WK Liu, SS Kong, YL Li… - The European Physical …, 2022 - Springer
Silicon carbide nanoribbons (SiCNRs) have a broad application in the field of new-
generation micro-nanoelectronic devices. In this paper, first-principles data are used to …

Comparative study on the optical properties of group-V doped SiC nanoribbons

YZ Li, MY Sun, XX Yu, WK Liu, SS Kong, P Gong… - Materials Science and …, 2022 - Elsevier
In this paper, the zigzag silicon carbide nanoribbons (ZSiCNRs) doped with group-V are
studied in the first principles, especially the differences of the energy bands and optical …

[HTML][HTML] First-principles prediction of the electronic property, carrier mobility and optical absorption in edge-modified pristine sawtooth penta-graphene nanoribbons …

T Wu, M Yao, J Li, M Li, M Long - Results in Physics, 2020 - Elsevier
Based on the first-principle calculations, we systematically study the electronic property,
carrier mobility and optical absorption spectra in the monohydrogen (H), dihydrogen (2H) …

Transport and recombination properties of doped SiC nanoribbons with different atoms substituted by group-V elements

YZ Li, XX Yu, WK Liu, SS Kong, YL Li… - Materials Science and …, 2023 - Elsevier
Based on semiconductor theory and optimization data derived from first-principles, we
simulate the conductive and recombination properties of group-V doped zigzag SiCNRs …

First-principles study on the electronic and magnetic properties of P edge-doped armchair germanium selenide nanoribbon

G Guo, Y Shi, Y Zhang, Y Deng, F Du, Z Xie… - Computational Materials …, 2020 - Elsevier
By using first-principles calculations, we performed the study on the structural stability,
electronic and magnetic properties of phosphorus (P) edge-doped armchair germanium …

Structural, electronic and magnetic properties of some adatoms adsorbed at the edges and Mg-doped SiC nanoribbons

N Taheri, M Moradi, MH Farzad - Computational Condensed Matter, 2022 - Elsevier
In this paper, we use the density functional theory to study comprehensively the structural,
electronic and magnetic properties of the B-, F-and H-terminated edges of SiC nanoribbons …

Effect of edge dual-hydrogenation on electronic and magnetic properties of armchair silicon carbide nanoribbons

SL Deng, W Zhou, Q Liu, D Wu, ZQ Fan, F Xie - Physica B: Condensed …, 2024 - Elsevier
Using the first-principles calculations, we investigate the electronic and magnetic properties
of armchair silicon carbide nanoribbon (aSiCNR) with different combinations of edge dual …

A computational study of rectification behavior of doped α-graphyne nanotubes

E Zaminpayma, S Ghorbanali - Computational Condensed Matter, 2024 - Elsevier
Abstract α-graphyne is a carbon nanosheet with sp and sp 2 hybridization. This sheet is a
hexagonal semi-metal like graphene. In this paper, we roll α-graphyne sheet and build …

Rectifying and spin filtering behavior of aluminum doped silicon carbide nanoribbons: the first principles study

N Rahmani-Ivriq, AA Kordbacheh - Journal of Physics D: Applied …, 2021 - iopscience.iop.org
In this paper, spin transport properties of aluminum-doped zigzag silicon carbide
nanoribbons (Al-ZSiC NRs) are investigated using the first-principle calculations and the …