Quantum coherence and non-equilibrium statistics are the governing mechanisms for electronic transport in 2-D materials. The present work investigates the electronic transport …
A Nemu, NK Jaiswal - Journal of Molecular Graphics and Modelling, 2023 - Elsevier
The peculiar properties of 2-D nano-materials have always inspired the research community for the further discovery of novel materials. Although III–V nitrides have been extensively …
A Nemu, NK Jaiswal, P Srivastava - Chemical Physics Letters, 2023 - Elsevier
We have investigated how the structural and electronic properties of armchair GaN nanoribbons (AGaNNR) are affected under the influence of fluorine (F 2) molecule …
Zigzag and armchair graphene nanoribbons (ZGNR and AGNR) have been investigated using the density functional theory (DFT) and nonequilibrium Green's function (NEGF) …
The paper presents the structural stability and electronic properties of various gas molecules AGaNNR with a width (N a) of 5, 7 and 9. Width dependency is analysed using density …
The development of robust nano-electronic devices, rely on efficient nano-interconnects to minimize the delay and Schottky barrier issues. Here, we performed first-principles …
B Sakkaki, HR Saghai, G Darvish, M Khatir - Optical Materials, 2021 - Elsevier
We propose new materials based on graphene nanomeshes (GNMs) and investigate the electronic and optical properties of them using a first-principles study based on density …
M Jatkar, KK Jha - Diamond and Related Materials, 2024 - Elsevier
The paper investigated F-functionalized armchair graphene nanoribbons using the density functional theory. The band structures and densities of states of all AGNR configurations …
Abstract Graphene, sp 2 hybridised-2D material has been widely reviewed for its fabulous structural, electronic, magnetic and optical properties. However, its employment in energy …