Carbon materials: structures, properties, synthesis and applications
As one of the most versatile elements, carbon materials occupy the most plentiful allotropies
composed of pure or mixed hybridization orbitals of sp1/sp2/sp3. The design and synthesis …
composed of pure or mixed hybridization orbitals of sp1/sp2/sp3. The design and synthesis …
Dielectric properties of a monolayer nano-graphyne structure: Monte Carlo simulations
Z Fadil, A Mhirech, B Kabouchi, L Bahmad… - Superlattices and …, 2019 - Elsevier
In this paper, the dielectric properties of a monolayer nano-graphyne structure, with mixed
spins σ= 7/2 and S= 1, have been studied, using Monte Carlo simulations. Firstly, the ground …
spins σ= 7/2 and S= 1, have been studied, using Monte Carlo simulations. Firstly, the ground …
Graphyne as an anode material for Mg-ion batteries: A computational study
Y Mao, H Soleymanabadi - Journal of Molecular Liquids, 2020 - Elsevier
Although Li-ion batteries have different advantages, they suffer from short lifetime, high cost,
and safety problems. The wide availability, multivalent character, and nontoxicity of …
and safety problems. The wide availability, multivalent character, and nontoxicity of …
Topological insulator states in a honeycomb lattice of s-triazines
Two-dimensional (2D) graphitic carbon nitride materials have been drawing increasing
attentions in energy conversion, environment protection and spintronic devices. Here, based …
attentions in energy conversion, environment protection and spintronic devices. Here, based …
Unveiling the adsorption, activation and reduction of CO2 via inorganic, biphenylene akin Pt-doped ZnMgO2
The performance of numerous existing two-dimensional (2D) materials as CO 2 sequestrator
remains suboptimal due to their limited capacity to adsorb and subsequently activate CO 2 …
remains suboptimal due to their limited capacity to adsorb and subsequently activate CO 2 …
New nanoporous graphyne monolayer as nodal line semimetal: Double Dirac points with an ultrahigh Fermi velocity
Abstract Two-dimensional (2D) carbon materials play an important role in nanomaterials.
We propose a new carbon monolayer, named hexagonal-4, 4, 4-graphyne (H 4, 4, 4 …
We propose a new carbon monolayer, named hexagonal-4, 4, 4-graphyne (H 4, 4, 4 …
Carbon-rich carbon nitride monolayers with Dirac cones: Dumbbell C4N
Abstract Two-dimensional (2D) carbon nitride materials play an important role in energy-
harvesting, energy-storage and environmental applications. Recently, a new carbon nitride …
harvesting, energy-storage and environmental applications. Recently, a new carbon nitride …
Magnetic properties and compensation temperature in tri-layer graphyne-like structure: Monte Carlo simulations
Z Fadil, N Maaouni, A Mhirech, B Kabouchi… - International Journal of …, 2021 - Springer
In this paper, we study the magnetic properties of a tri-layer graphyne-like structure using
Blume-Capel Ising model. The studied system is composed by a mixed spins σ=±5/2,±3/2 …
Blume-Capel Ising model. The studied system is composed by a mixed spins σ=±5/2,±3/2 …
Exploring the enhancement of the thermoelectric properties of bilayer graphyne nanoribbons
Carbon materials are vital for sustainable energy applications based on abundant and non-
toxic raw materials. In this scenario, carbon nanoribbons have superior thermoelectric …
toxic raw materials. In this scenario, carbon nanoribbons have superior thermoelectric …
Dirac cones and highly anisotropic electronic structure of super-graphyne
Graphynes consisting of sp-and sp 2-hybridized carbon atoms represent two-dimensional
allotropes of the carbon family with intriguing properties. Based on first-principles …
allotropes of the carbon family with intriguing properties. Based on first-principles …