First-principles study on the structure and electronic properties of M2CSx (M = Sc, Ti, Y, Zr and Hf, x = 1, 2)-Reference-Cited by-同舟云学术

First-principles study on the structure and electronic properties of M₂CS_x (M = Sc, Ti, Y, Zr and Hf, x = 1, 2)

Published:2023 Issue:31 Volume:13 Page:21690-21702
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Zhu Huaijin¹²^ORCID,Qiu Nianxiang²,Fang Gang²,Du Shiyu²³⁴⁵^ORCID

Affiliation:

1. Faculty of Electrical Engineering and Computer Science, Ningbo University, Ningbo, Zhejiang 351201, China

2. Engineering Laboratory of Advanced Energy Materials, Ningbo Institute of Materials Technology and Engineering, Chinese Academy of Sciences, Ningbo, Zhejiang 315201, P. R. China

3. School of Materials Science and Engineering, China University of Petroleum (East China), Qingdao, 266580, China

4. School of Computer Science, China University of Petroleum (East China), Qingdao, 266580, China

5. Milky-Way Sustainable Energy Ltd, Zhuhai, China

Abstract

S-functionalized MXenes have attracted extensive attention as electrode materials for potential metal ion batteries. The M2CS is stronger than that of the M2CS2 due to the stronger p–d hybridization between the M-d state and the C/S-p state.

Funder

National Natural Science Foundation of China

National Science and Technology Major Project

Natural Science Foundation of Ningbo

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2023/RA/D3RA03340F

Reference77 articles.

1. Recent Advances in Layered Ti3C2TxMXene for Electrochemical Energy Storage