Density functional theory-based modeling of the half-metallic g-C3N4/CoN4 heterojunction for photocatalytic water splitting reaction-Reference-Cited by-同舟云学术

Density functional theory-based modeling of the half-metallic g-C₃N₄/CoN₄ heterojunction for photocatalytic water splitting reaction

Published:2024 Issue:31 Volume:26 Page:21117-21133
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

V. N Dhilshada.¹,Chandran Aiswarya¹,Sen Sabyasachi²,Chattopadhyaya Mausumi¹^ORCID

Affiliation:

1. Department of Chemistry, National Institute of Technology, Calicut, Calicut Mukkam Road, Kattangal, Kerala 673601, India

2. Department of Physics, Shyampur Siddheswari Mahavidyalaya, Ajodhya, Shyampur, Howrah, Pin-711312& JIS College of Engineering Block A, Phase-III, Kalyani, Nadia, Pin-741235, India

Abstract

Using DFT, we have investigated the structural, optical, electronic and magnetic properties of g-C3N4 and CoN4 composite to explore the effect of the heterojunction on the photocatalytic performance of g-C3N4.

Funder

Science and Engineering Research Board

National Institute of Technology Calicut

University Grants Commission

Publisher

Royal Society of Chemistry (RSC)

Link

http://pubs.rsc.org/en/content/articlepdf/2024/CP/D4CP00929K

Reference100 articles.

1. Review of photocatalytic water-splitting methods for sustainable hydrogen production

2. Enhanced photocatalytic pure water splitting of porous g-C3N4/CdS composite by the bimetallic phosphide

3. Layered g-C3N4/TiO2 nanocomposites for efficient photocatalytic water splitting and CO2 reduction: a review

4. Graphitic carbon nitride (g-C3N4) synthesis and heterostructures, principles, mechanisms, and recent advances: A critical review

5. Effect of rutile TiO2 on the photocatalytic performance of g-C3N4/brookite-TiO2-xNy photocatalyst for NO decomposition