Computational studies on the structural, electronic and optical properties of graphene-like MXenes (M<sub>2</sub>CT<sub>2</sub>, M = Ti, Zr, Hf; T = O, F, OH) and their potential applications as visible-light driven photocatalysts

2016273 citationsJournal Article

Authors

Haijun Zhang · Hefei University

Guang Yang · Urban College of Boston

Xueqin Zuo · Hefei University

Huaibao Tang · Hefei University

Qun Yang · Hefei University

Guang Li · Hefei University

Abstract

Our computational results suggest the great possibility of utilizing functionalized MXene materials as high-efficiency visible-light-driven photocatalysts.

Topics & Keywords

MXene and MAX Phase Materials Advanced Photocatalysis Techniques 2D Materials and Applications

Publication Details

Published in: Journal of Materials Chemistry A

Volume 4, Issue 33, pp. 12913-12920

DOI: 10.1039/c6ta04628b

Field-Weighted Citation Impact: 8.86

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Computational studies on the structural, electronic and optical properties of graphene-like MXenes (M<sub>2</sub>CT<sub>2</sub>, M = Ti, Zr, Hf; T = O, F, OH) and their potential applications as visible-light driven photocatalysts

Authors

Abstract

Topics & Keywords

Publication Details