[HTML][HTML] Theory-oriented screening and discovery of advanced energy transformation materials in electrocatalysis

H **g, P Zhu, X Zheng, Z Zhang, D Wang… - Advanced Powder …, 2022 - Elsevier
Various metal-based electrocatalysts from nanocrystals, to clusters and single-atoms, have
been well-discovered towards high-efficient power devices and electrocatalytic conversion …

Comprehensive understanding of the thriving ambient electrochemical nitrogen reduction reaction

X Zhao, G Hu, GF Chen, H Zhang, S Zhang… - Advanced …, 2021 - Wiley Online Library
The electrochemical method of combining N2 and H2O to produce ammonia (ie, the
electrochemical nitrogen reduction reaction [E‐NRR]) continues to draw attention as it is …

Dynamic stability of copper single-atom catalysts under working conditions

X Bai, X Zhao, Y Zhang, C Ling, Y Zhou… - Journal of the …, 2022 - ACS Publications
The long-term stability of single-atom catalysts is a major factor affecting their large-scale
commercial application. How to evaluate the dynamic stability of single-atom catalysts under …

Recent progress of metal single-atom catalysts for energy applications

Q Yang, Y Jiang, H Zhuo, EM Mitchell, Q Yu - Nano Energy, 2023 - Elsevier
Single-atom catalysts (SACs) have received tremendous attention in heterogeneous
catalysis because of their excellent catalytic performance and robust stability. Metal SACs …

Single-atom (iron-based) catalysts: synthesis and applications

B Singh, MB Gawande, AD Kute, RS Varma… - Chemical …, 2021 - ACS Publications
Supported single-metal atom catalysts (SACs) are constituted of isolated active metal
centers, which are heterogenized on inert supports such as graphene, porous carbon, and …

Theoretical understandings of graphene-based metal single-atom catalysts: stability and catalytic performance

HY Zhuo, X Zhang, JX Liang, Q Yu, H **ao… - Chemical reviews, 2020 - ACS Publications
Research on heterogeneous single-atom catalysts (SACs) has become an emerging frontier
in catalysis science because of their advantages in high utilization of noble metals, precisely …

Single‐atom catalysts for electrocatalytic applications

Q Zhang, J Guan - Advanced Functional Materials, 2020 - Wiley Online Library
The recent advances in electrocatalysis for oxygen reduction reaction (ORR), oxygen
evolution reaction (OER), hydrogen evolution reaction (HER), hydrogen oxidation reaction …

High-throughput screening of synergistic transition metal dual-atom catalysts for efficient nitrogen fixation

X Lv, W Wei, B Huang, Y Dai, T Frauenheim - Nano Letters, 2021 - ACS Publications
Great enthusiasm in single-atom catalysts (SACs) for the nitrogen reduction reaction (NRR)
has been aroused by the discovery of metal–N x as a promising catalytic center. However …

Theoretical insights into single-atom catalysts

L Li, X Chang, X Lin, ZJ Zhao, J Gong - Chemical Society Reviews, 2020 - pubs.rsc.org
Single-atom catalysts (SACs) with atomically dispersed metals have emerged as a new
class of heterogeneous catalysts and have attracted considerable interest because they …

Recent advances in MOF‐derived single atom catalysts for electrochemical applications

Z Song, L Zhang, K Doyle‐Davis, X Fu… - Advanced Energy …, 2020 - Wiley Online Library
Electrocatalysis plays a critical role in clean energy conversion, enabling great improvement
for future sustainable technologies. Single atom catalysts (SACs) derived from metal …