title: Graphitic carbon nitride supported single-atom catalysts for efficient oxygen evolution reaction.
abstract: Based on DFT calculations, we propose a TM@CN hybrid structure, in which the single-atom transition metal (TM = Pt, Pd, Co, Ni, Cu) is supported by graphitic carbon nitride (g-CN), as a promising high-performance OER catalyst. Our work reveals the importance of local TM coordination in catalysts for the OER, which would lead to a new class of low-cost, durable and efficient OER catalysts.
authors.affiliation: Hefei National Laboratory for Physical Sciences at the Microscale, Collaborative Innovation Center of Chemistry for Energy Materials, School of Chemistry and Materials Science, University of Science and Technology of China, Hefei, Anhui 230026, P. R. China. jiangj1@ustc.edu.cn.
authors.forename: Xiyu
authors.initials: X
authors.lastname: Li
authors.affiliation: Hefei National Laboratory for Physical Sciences at the Microscale, Collaborative Innovation Center of Chemistry for Energy Materials, School of Chemistry and Materials Science, University of Science and Technology of China, Hefei, Anhui 230026, P. R. China. jiangj1@ustc.edu.cn.
authors.forename: Peng
authors.initials: P
authors.lastname: Cui
authors.affiliation: Guizhou Provincial Key Laboratory of Computational Nano-Material Science, Institute of Applied Physics, Guizhou Synergetic Innovation Center of Scientific Big Data for Advanced Manufacturing Technology, Guizhou Normal College, Gaoxin Road 115, Guiyang, Guizhou 550018, P. R. China.
authors.forename: Wenhui
authors.initials: W
authors.lastname: Zhong
authors.affiliation: Hefei National Laboratory for Physical Sciences at the Microscale, Collaborative Innovation Center of Chemistry for Energy Materials, School of Chemistry and Materials Science, University of Science and Technology of China, Hefei, Anhui 230026, P. R. China. jiangj1@ustc.edu.cn.
authors.forename: Jun
authors.initials: J
authors.lastname: Li
authors.affiliation: Hefei National Laboratory for Physical Sciences at the Microscale, Collaborative Innovation Center of Chemistry for Energy Materials, School of Chemistry and Materials Science, University of Science and Technology of China, Hefei, Anhui 230026, P. R. China. jiangj1@ustc.edu.cn.
authors.forename: Xijun
authors.initials: X
authors.lastname: Wang
authors.affiliation: School of Physics and Engineering, Henan University of Science and Technology, Luoyang, Henan 471023, P. R. China.
authors.forename: Zhaowu
authors.initials: Z
authors.lastname: Wang
authors.affiliation: Hefei National Laboratory for Physical Sciences at the Microscale, Collaborative Innovation Center of Chemistry for Energy Materials, School of Chemistry and Materials Science, University of Science and Technology of China, Hefei, Anhui 230026, P. R. China. jiangj1@ustc.edu.cn.
authors.forename: Jun
authors.identifier: http://orcid.org/0000-0002-6116-5605
authors.initials: J
authors.lastname: Jiang