Stability and electronic properties of XO (X= Be, Mg, Zn, Cd) biphenylene and graphenylene networks: A first-principles study
YZ Abdullahi, F Ersan - Applied Physics Letters, 2023 - pubs.aip.org
The ultrawide bandgap semiconducting property of materials is key to the development of
advanced optoelectronic nanodevices with potential applications in flexible and transparent …
advanced optoelectronic nanodevices with potential applications in flexible and transparent …
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 …
Stability, electronic and optical properties of buckled XO (X= Ge, Cu) graphenylene monolayers: A first-principles study
The demand for sustainable semiconducting devices that can be used in various
applications necessitates the development of revolutionary materials with multifunctional …
applications necessitates the development of revolutionary materials with multifunctional …
Can Stable MoS2 Monolayers and Multilayers Be Constituted in the Biphenylene Network?
Based on the first-principles calculations, we predict that the well-known 2H-MoS2
monolayer of the trigonal prismatic phase appearing in a hexagonal network can also …
monolayer of the trigonal prismatic phase appearing in a hexagonal network can also …
Unveiling a New 2D Semiconductor: Biphenylene-Based InN
The two-dimensional (2D) materials class earned a boost in 2021 with biphenylene
synthesis, which is structurally formed by the fusion of four-, six-, and eight-membered …
synthesis, which is structurally formed by the fusion of four-, six-, and eight-membered …
Lateral Composite Structures of Graphene/Graphane/Graphone: Electronic Confinement, Heterostructures with Tunable Band Alignment, and Magnetic State
Graphene can be hydrogenated fully on both sides and also semihydrogenated on one side
to constitute graphane and graphone, respectively. While both are wide band gap …
to constitute graphane and graphone, respectively. While both are wide band gap …
Robustness of type-II Dirac cones in biphenylene: From nanoribbons to symmetric bilayer stacking
The electronic properties of one-and two-dimensional biphenylene-based systems, such as
nanoribbons and bilayers, are studied within a unified approach. Besides the bilayer with …
nanoribbons and bilayers, are studied within a unified approach. Besides the bilayer with …
Structural, mechanical, electronic and optical properties of biphenylene hydrogenation: a first-principles study
K Chen, J Zhou, W Zhao, R Yang, C Qiao… - Physical Chemistry …, 2023 - pubs.rsc.org
Biphenylene networks typically exhibit a metallic electronic nature, while hydrogenation can
open the band gap changing it to a semiconductor. This property makes hydrogenated …
open the band gap changing it to a semiconductor. This property makes hydrogenated …
Single-atom Pd directly anchored on biphenylene: a promising bifunctional electrocatalyst for overall water splitting
TT Wang, Y Meng, HC Huang, L Zhang… - Physical Chemistry …, 2025 - pubs.rsc.org
The development of bifunctional single-atom catalysts (SACs) for overall water splitting is
crucial for clean energy production in the context of sustainable development. Using first …
crucial for clean energy production in the context of sustainable development. Using first …
New stable inorganic BX (X= P, As, Sb) biphenylene and graphenylene monolayers: A first-principles investigation
YZ Abdullahi, F Ersan - Computational Materials Science, 2024 - Elsevier
Abstract Porous two-dimensional (2D) materials with semiconducting property are promising
candidates for a variety of multifunctional energy harvesting applications. Motivated by the …
candidates for a variety of multifunctional energy harvesting applications. Motivated by the …