Influence of F and H adsorption on the elasto-plastic properties of silicene: a DFT investigation
The density functional theory is used here to study the influence of adsorption on the elastic
and plastic properties of silicene. The hydrogen and fluorine atoms are considered as the …
and plastic properties of silicene. The hydrogen and fluorine atoms are considered as the …
Quantum capacitance of supercapacitor electrodes based on germanene influenced by vacancy and co-doping: A first-principles study
Q Zhou, W Ju, Y Yong, Y Liu, J Li - Computational Materials Science, 2021 - Elsevier
Germanene with high volume/surface ratio similar to graphene is expected to be promising
electrodes for supercapacitors. Based on first-principles method, the stability, quantum …
electrodes for supercapacitors. Based on first-principles method, the stability, quantum …
Molecular dynamic simulations of the heat transfer in double-layered graphene/silicene nanosheets
H Pourmirzaagha, S Rouhi - Physica B: Condensed Matter, 2023 - Elsevier
Using molecular dynamics simulations, the heat transfer characteristics of the double-
layered graphene/silicene nanosheets are investigated. Fourier's heat transfer equation is …
layered graphene/silicene nanosheets are investigated. Fourier's heat transfer equation is …
First-principles calculation of optimizing the performance of germanene-based supercapacitors by vacancies and metal atoms
Germanene with folded atomic layers has double surfaces and high surface/volume ratio,
similar to carbon nanomaterials, and is expected to be used in supercapacitors and field …
similar to carbon nanomaterials, and is expected to be used in supercapacitors and field …
[HTML][HTML] Quantum nuclear motion in silicene: Assessing structural and vibrational properties through path-integral simulations
CP Herrero, M del Canizo - Journal of Physics and Chemistry of Solids, 2025 - Elsevier
This paper explores the interplay between quantum nuclear motion and anharmonicity,
which causes nontrivial effects on the structural and dynamical characteristics of silicene, a …
which causes nontrivial effects on the structural and dynamical characteristics of silicene, a …
Influence of aluminum doping on the mechanical properties of bilayer silicene
BAL dos Santos, AM Barboza, LCR Aliaga… - Ciência e …, 2024 - periodicos.ufsm.br
Silicene, a two-dimensional material with potential applications in future technologies, has
garnered significant interest in the past decade. Recent attention has focused on modifying …
garnered significant interest in the past decade. Recent attention has focused on modifying …
In Situ Measurements of Strain Evolution in Graphene/Boron Nitride Heterostructures Using a Non-Destructive Raman Spectroscopy Approach
The mechanical properties of engineered van der Waals (vdW) 2D materials and
heterostructures are critically important for their implementation into practical applications …
heterostructures are critically important for their implementation into practical applications …