Prediction of HER electrocatalyst with enhanced performance based on atoms-doped black phosphorene: A first-principles study

被引：0
|
作者：
Liang, Tingting [1 ,2 ]
Xie, Jingpei [1 ,3 ]
Wang, Aiqin [1 ,3 ]
Ma, Douqin [1 ,3 ]
Mao, Zhiping [1 ,3 ]
Wang, Jian [1 ,3 ]
Li, Haisheng [3 ,4 ]
机构：
[1] School of Materials Science and Engineering, Henan University of Science and Technology, Luoyang,471023, China
[2] State Key Laboratory for Powder Metallurgy, Central South University, Changsha,410083, China
[3] Provincial and Ministerial Co-construction of Collaborative Innovation Center of Non-ferrous Metals New Materials and Advanced Processing Technology, Henan University of Science and Technology, Luoyang,471023, China
[4] School of Physics and Engineering, Henan University of Science and Technology, Luoyang,471023, China
来源：
Applied Surface Science | 2022年 / 604卷
关键词：
D O I：
暂无
中图分类号：
学科分类号：
摘要：
39
引用
收藏
相关论文
共 50 条
  • [41] The potential application of black and blue phosphorene as cathode materials in rechargeable aluminum batteries: a first-principles study
    Xiao, Xiang
    Wang, Mingyong
    Tu, Jiguo
    Jiao, Shuqiang
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2019, 21 (13) : 7021 - 7028
  • [42] A first-principles study of bilayered black phosphorene as a potential anode material for sodium-ion batteries
    Li, Jiaxin
    Chen, Weiling
    Lin, Xian
    Xu, Guigui
    Zhong, Kehua
    Zhang, Jian-Min
    Huang, Zhigao
    PHYSICAL CHEMISTRY CHEMICAL PHYSICS, 2023, 25 (17) : 12013 - 12024
  • [43] Sensing properties of nonmetal doped blue phosphorene toward NO and NO2 molecules: A first-principles study
    Chen, Guo-Xiang
    Wang, Rui-Xue
    Li, Han-Xiao
    Chen, Xiao-Na
    An, Guo
    Zhang, Jian-Min
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2022, 122 (15)
  • [44] Enhanced ferromagnetism in N-doped BiFeo3: A first-principles prediction
    Wang, Q. J.
    Tan, Q. H.
    Liu, Y. K.
    JOURNAL OF ALLOYS AND COMPOUNDS, 2015, 644 : 30 - 39
  • [45] First-principles study of enhanced magnetic anisotropies in transition-metal atoms doped WS2 monolayer
    Song, Yu-Xi
    Tong, Wen-Yi
    Shen, Yu-Hao
    Gong, Shi-Jing
    Tang, Zheng
    Duan, Chun-Gang
    JOURNAL OF PHYSICS-CONDENSED MATTER, 2017, 29 (47)
  • [46] The performance prediction and mechanism study of doped DLC films by the combination of molecular dynamics and first-principles calculations
    Hou, Ming-hao
    Jia, Lei
    Kang, Rong-zhen
    Lu, Zhen-lin
    Ma, Guo-zheng
    Cui, Jie
    DIAMOND AND RELATED MATERIALS, 2024, 149
  • [47] Enhanced SOx sensing performance of BC3 nanosheets functionalized with Na atoms: A first-principles study
    Meng, Chenxiaoning
    Zhao, Keyan
    Yang, Mei
    Liang, Yaohua
    Bu, Xiaodan
    PHYSICA E-LOW-DIMENSIONAL SYSTEMS & NANOSTRUCTURES, 2021, 132
  • [48] Doped fullerene as a metal-free electrocatalyst for oxygen reduction reaction: A first-principles study
    Wang, Ying
    Jiao, Menggai
    Song, Wei
    Wu, Zhijian
    CARBON, 2017, 114 : 393 - 401
  • [49] Anomalously enhanced thermal stability of phosphorene via metal adatom doping: An experimental and first-principles study
    Xuewei Feng
    Vadym V. Kulish
    Ping Wu
    Xinke Liu
    Kah-Wee Ang
    Nano Research, 2016, 9 : 2687 - 2695
  • [50] Anomalously enhanced thermal stability of phosphorene via metal adatom doping: An experimental and first-principles study
    Feng, Xuewei
    Kulish, Vadym V.
    Wu, Ping
    Liu, Xinke
    Ang, Kah-Wee
    NANO RESEARCH, 2016, 9 (09) : 2687 - 2695
12345