Carbon nitride nanotube-based materials for energy and environmental applications: a review of recent progresses

Y Zhu, Y Feng, S Chen, M Ding, J Yao - Journal of Materials Chemistry …, 2020 - pubs.rsc.org
Among the diverse graphitic carbon nitride (CN) nanostructures, CN nanotubes (CNNTs) are
currently attracting increasing interest due to the appealing properties of CN and the …

Multifunctional 2D gC4N3/MoS2 vdW Heterostructure-Based Nanodevices: Spin Filtering and Gas Sensing Properties

X Dong, T Chen, G Liu, L Xie, G Zhou, M Long - ACS sensors, 2022 - ACS Publications
Two-dimensional (2D) magnetic materials are the key to the development of the new
generation in spintronics technology and engineering multifunctional devices. Herein, the …

Recent Progress in Computational Design of Single-Atom/Cluster Catalysts for Electrochemical and Solar-Driven N2 Fixation

S Ghoshal, A Ghosh, P Roy, B Ball, A Pramanik… - ACS …, 2022 - ACS Publications
Fixation of dinitrogen into ammonia is an essential biological process for the evolution of life,
and at the same time ammonia is an essential component for many industrial processes …

A Facile One‐Step Synthesis of Fe‐Doped g‐C3N4 Nanosheets and Their Improved Visible‐Light Photocatalytic Performance

J Gao, Y Wang, S Zhou, W Lin, Y Kong - ChemCatChem, 2017 - Wiley Online Library
A simple one‐step pyrolysis process (compared with the routine method of liquid exfoliation
and impregnation) was designed to synthesize Fe‐doped graphitic carbon nitride (g‐C3N4) …

A first-principles study of the effects of atom impurities, defects, strain, electric field and layer thickness on the electronic and magnetic properties of the C2N nanosheet

A Bafekry, C Stampfl, M Ghergherehchi, SF Shayesteh - Carbon, 2020 - Elsevier
Using the first-principles calculations, we explore the structural and novel electronic/optical
properties of the C 2 N nanosheet. To this goal, we systematically investigate the affect of …

Two-dimensional carbon nitride (2DCN) nanosheets: Tuning of novel electronic and magnetic properties by hydrogenation, atom substitution and defect engineering

A Bafekry, SF Shayesteh, FM Peeters - Journal of Applied Physics, 2019 - pubs.aip.org
By employing first-principles calculations within the framework of density functional theory,
we investigated the structural, electronic, and magnetic properties of graphene and various …

Atomically Thin B doped gC3N4 Nanosheets: High-Temperature Ferromagnetism and calculated Half-Metallicity

D Gao, Y Liu, P Liu, M Si, D Xue - Scientific reports, 2016 - nature.com
Since the graphitic carbon nitride (g-C4N3), which can be seen as C-doped graphitic-C3N4
(g-C3N4), was reported to display ferromagnetic ground state and intrinsic half-metallicity …

Tunable electronic and magnetic properties of graphene/carbon-nitride van der Waals heterostructures

A Bafekry, B Akgenc, SF Shayesteh, B Mortazavi - Applied Surface Science, 2020 - Elsevier
In this paper, we explore the electronic properties of C 3 N, C 3 N 4 and C 4 N 3 and
graphene (Gr) van der Waals heterostructures by conducting extensive first-principles …

Stable half-metallic monolayers of FeCl2

E Torun, H Sahin, SK Singh, FM Peeters - Applied Physics Letters, 2015 - pubs.aip.org
The structural, electronic, and magnetic properties of single layers of Iron Dichloride (FeCl 2)
were calculated using first principles calculations. We found that the 1T phase of the single …

Control of C 3 N 4 and C 4 N 3 carbon nitride nanosheets' electronic and magnetic properties through embedded atoms

A Bafekry, C Stampfl, B Akgenc… - Physical Chemistry …, 2020 - pubs.rsc.org
In the present work, the effect of various embedded atom impurities on tuning electronic and
magnetic properties of C3N4 and C4N3 nanosheets have been studied using first-principles …